Mock Version: 3.5
ENTER ['do_with_status'](['bash', '--login', '-c', '/usr/bin/rpmbuild -bs --target i686 --nodeps /builddir/build/SPECS/inchi.spec'], chrootPath='/var/lib/mock/fedora-rawhide-i686-1671971935.318346/root'env={'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;<mock-chroot>\\007"', 'PS1': '<mock-chroot> \\s-\\v\\$ ', 'LANG': 'C.UTF-8'}shell=Falselogger=<mockbuild.trace_decorator.getLog object at 0x7f320faa3fd0>timeout=0uid=1000gid=135user='mockbuild'nspawn_args=['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']unshare_net=TrueprintOutput=True)
Using nspawn with args ['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']
Executing command: ['/usr/bin/systemd-nspawn', '-q', '-M', '9b4ec917c7ed49c69402f339314bfd73', '-D', '/var/lib/mock/fedora-rawhide-i686-1671971935.318346/root', '-a', '-u', 'mockbuild', '--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11', '--console=pipe', '--setenv=TERM=vt100', '--setenv=SHELL=/bin/bash', '--setenv=HOME=/builddir', '--setenv=HOSTNAME=mock', '--setenv=PATH=/usr/bin:/bin:/usr/sbin:/sbin', '--setenv=PROMPT_COMMAND=printf "\\033]0;<mock-chroot>\\007"', '--setenv=PS1=<mock-chroot> \\s-\\v\\$ ', '--setenv=LANG=C.UTF-8', '--resolv-conf=off', 'bash', '--login', '-c', '/usr/bin/rpmbuild -bs --target i686 --nodeps /builddir/build/SPECS/inchi.spec'] with env {'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;<mock-chroot>\\007"', 'PS1': '<mock-chroot> \\s-\\v\\$ ', 'LANG': 'C.UTF-8', 'SYSTEMD_NSPAWN_TMPFS_TMP': '0', 'SYSTEMD_SECCOMP': '0'} and shell False
Building target platforms: i686
Building for target i686
setting SOURCE_DATE_EPOCH=1658361600
Wrote: /builddir/build/SRPMS/inchi-1.0.6-5.fc38.src.rpm
Child return code was: 0
ENTER ['do_with_status'](['bash', '--login', '-c', '/usr/bin/rpmbuild -bb --target i686 --nodeps /builddir/build/SPECS/inchi.spec'], chrootPath='/var/lib/mock/fedora-rawhide-i686-1671971935.318346/root'env={'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;<mock-chroot>\\007"', 'PS1': '<mock-chroot> \\s-\\v\\$ ', 'LANG': 'C.UTF-8'}shell=Falselogger=<mockbuild.trace_decorator.getLog object at 0x7f320faa3fd0>timeout=0uid=1000gid=135user='mockbuild'nspawn_args=['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']unshare_net=TrueprintOutput=True)
Using nspawn with args ['--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11']
Executing command: ['/usr/bin/systemd-nspawn', '-q', '-M', '30d422603fbe422aa5b81a78a6884561', '-D', '/var/lib/mock/fedora-rawhide-i686-1671971935.318346/root', '-a', '-u', 'mockbuild', '--capability=cap_ipc_lock', '--rlimit=RLIMIT_NOFILE=10240', '--capability=cap_ipc_lock', '--bind=/tmp/mock-resolv.n3px2haa:/etc/resolv.conf', '--bind=/dev/btrfs-control', '--bind=/dev/mapper/control', '--bind=/dev/loop-control', '--bind=/dev/loop0', '--bind=/dev/loop1', '--bind=/dev/loop2', '--bind=/dev/loop3', '--bind=/dev/loop4', '--bind=/dev/loop5', '--bind=/dev/loop6', '--bind=/dev/loop7', '--bind=/dev/loop8', '--bind=/dev/loop9', '--bind=/dev/loop10', '--bind=/dev/loop11', '--console=pipe', '--setenv=TERM=vt100', '--setenv=SHELL=/bin/bash', '--setenv=HOME=/builddir', '--setenv=HOSTNAME=mock', '--setenv=PATH=/usr/bin:/bin:/usr/sbin:/sbin', '--setenv=PROMPT_COMMAND=printf "\\033]0;<mock-chroot>\\007"', '--setenv=PS1=<mock-chroot> \\s-\\v\\$ ', '--setenv=LANG=C.UTF-8', '--resolv-conf=off', 'bash', '--login', '-c', '/usr/bin/rpmbuild -bb --target i686 --nodeps /builddir/build/SPECS/inchi.spec'] with env {'TERM': 'vt100', 'SHELL': '/bin/bash', 'HOME': '/builddir', 'HOSTNAME': 'mock', 'PATH': '/usr/bin:/bin:/usr/sbin:/sbin', 'PROMPT_COMMAND': 'printf "\\033]0;<mock-chroot>\\007"', 'PS1': '<mock-chroot> \\s-\\v\\$ ', 'LANG': 'C.UTF-8', 'SYSTEMD_NSPAWN_TMPFS_TMP': '0', 'SYSTEMD_SECCOMP': '0'} and shell False
Building target platforms: i686
Building for target i686
setting SOURCE_DATE_EPOCH=1658361600
Executing(%prep): /bin/sh -e /var/tmp/rpm-tmp.WdHZBO
+ umask 022
+ cd /builddir/build/BUILD
+ cd /builddir/build/BUILD
+ rm -rf INCHI-1-SRC
+ /usr/lib/rpm/rpmuncompress -x /builddir/build/SOURCES/INCHI-1-SRC.zip
+ STATUS=0
+ '[' 0 -ne 0 ']'
+ cd INCHI-1-SRC
+ /usr/lib/rpm/rpmuncompress -x /builddir/build/SOURCES/INCHI-1-DOC.zip
+ STATUS=0
+ '[' 0 -ne 0 ']'
+ /usr/lib/rpm/rpmuncompress -x /builddir/build/SOURCES/INCHI-1-TEST.zip
+ STATUS=0
+ '[' 0 -ne 0 ']'
+ /usr/bin/chmod -Rf a+rX,u+w,g-w,o-w .
Patch #0 (inchi-rpm.patch):
+ echo 'Patch #0 (inchi-rpm.patch):'
+ /usr/bin/patch --no-backup-if-mismatch -f -p1 -b --suffix .r --fuzz=0
patching file INCHI_API/demos/inchi_main/gcc/makefile
patching file INCHI_EXE/inchi-1/gcc/makefile
Patch #1 (inchi-1.0.6-0001-MolfileReadCountsLine-fix-storing-n_atoms-n_bonds-me.patch):
+ echo 'Patch #1 (inchi-1.0.6-0001-MolfileReadCountsLine-fix-storing-n_atoms-n_bonds-me.patch):'
+ /usr/bin/patch --no-backup-if-mismatch -f -p1 -b --suffix .big_endian --fuzz=0
patching file INCHI_BASE/src/mol_fmt1.c
+ for file in readme.txt
+ dos2unix -k readme.txt
dos2unix: converting file readme.txt to Unix format...
~/build/BUILD/INCHI-1-SRC/INCHI-1-TEST/test ~/build/BUILD/INCHI-1-SRC
+ pushd INCHI-1-TEST/test
+ unzip -d reference -qq -a test-results.zip
+ unzip -qq -a test-datasets.zip
+ dos2unix -k reference/its-non-std-01.inc reference/its-non-std-02.inc reference/its-non-std-03.inc reference/its-non-std-04.inc reference/its-non-std-05.inc reference/its-non-std-06.inc reference/its-non-std-07.inc reference/its-non-std-08.inc reference/its-non-std-09.inc reference/its-non-std-10.inc reference/its-non-std-11.inc reference/its-non-std-12.inc reference/its-non-std-13.inc reference/its-non-std-14.inc reference/its-non-std-15.inc reference/its-non-std-16.inc reference/its-non-std-17.inc reference/its-non-std-18.inc reference/its-non-std-19.inc reference/its-non-std-20.inc reference/its-non-std-21.inc reference/its-non-std-22.inc reference/its-non-std-23.inc reference/its-non-std-24.inc reference/its-non-std-25.inc reference/its-non-std-26.inc reference/its-non-std-27.inc reference/its-non-std-28.inc reference/its-std-01.inc reference/its-std-02.inc reference/its-std-03.inc reference/its-std-04.inc reference/its-std-05.inc reference/zzp-NPZZ.inc reference/zzp-Polymers-FoldCRU-NPZZ.inc reference/zzp-Polymers.inc reference/zzp-Polymers105-NPZZ.inc reference/zzp-Polymers105.inc reference/zzp.inc InChI_TestSet.sdf zzp.sdf
dos2unix: converting file reference/its-non-std-01.inc to Unix format...
dos2unix: converting file reference/its-non-std-02.inc to Unix format...
dos2unix: converting file reference/its-non-std-03.inc to Unix format...
dos2unix: converting file reference/its-non-std-04.inc to Unix format...
dos2unix: converting file reference/its-non-std-05.inc to Unix format...
dos2unix: converting file reference/its-non-std-06.inc to Unix format...
dos2unix: converting file reference/its-non-std-07.inc to Unix format...
dos2unix: converting file reference/its-non-std-08.inc to Unix format...
dos2unix: converting file reference/its-non-std-09.inc to Unix format...
dos2unix: converting file reference/its-non-std-10.inc to Unix format...
dos2unix: converting file reference/its-non-std-11.inc to Unix format...
dos2unix: converting file reference/its-non-std-12.inc to Unix format...
dos2unix: converting file reference/its-non-std-13.inc to Unix format...
dos2unix: converting file reference/its-non-std-14.inc to Unix format...
dos2unix: converting file reference/its-non-std-15.inc to Unix format...
dos2unix: converting file reference/its-non-std-16.inc to Unix format...
dos2unix: converting file reference/its-non-std-17.inc to Unix format...
dos2unix: converting file reference/its-non-std-18.inc to Unix format...
dos2unix: converting file reference/its-non-std-19.inc to Unix format...
dos2unix: converting file reference/its-non-std-20.inc to Unix format...
dos2unix: converting file reference/its-non-std-21.inc to Unix format...
dos2unix: converting file reference/its-non-std-22.inc to Unix format...
dos2unix: converting file reference/its-non-std-23.inc to Unix format...
dos2unix: converting file reference/its-non-std-24.inc to Unix format...
dos2unix: converting file reference/its-non-std-25.inc to Unix format...
dos2unix: converting file reference/its-non-std-26.inc to Unix format...
dos2unix: converting file reference/its-non-std-27.inc to Unix format...
dos2unix: converting file reference/its-non-std-28.inc to Unix format...
dos2unix: converting file reference/its-std-01.inc to Unix format...
dos2unix: converting file reference/its-std-02.inc to Unix format...
dos2unix: converting file reference/its-std-03.inc to Unix format...
dos2unix: converting file reference/its-std-04.inc to Unix format...
dos2unix: converting file reference/its-std-05.inc to Unix format...
dos2unix: converting file reference/zzp-NPZZ.inc to Unix format...
dos2unix: converting file reference/zzp-Polymers-FoldCRU-NPZZ.inc to Unix format...
dos2unix: converting file reference/zzp-Polymers.inc to Unix format...
dos2unix: converting file reference/zzp-Polymers105-NPZZ.inc to Unix format...
dos2unix: converting file reference/zzp-Polymers105.inc to Unix format...
dos2unix: converting file reference/zzp.inc to Unix format...
dos2unix: converting file InChI_TestSet.sdf to Unix format...
dos2unix: converting file zzp.sdf to Unix format...
+ for f in inchify_{InChI_TestSet,zzp}
+ sed -e s,REM,#,g -e s,/,-,g -e s,NUL,/dev/null,g -e s,inchi-1.exe,../../INCHI_EXE/bin/Linux/inchi-1,g inchify_InChI_TestSet.cmd
+ dos2unix inchify_InChI_TestSet.sh
dos2unix: converting file inchify_InChI_TestSet.sh to Unix format...
+ for f in inchify_{InChI_TestSet,zzp}
+ sed -e s,REM,#,g -e s,/,-,g -e s,NUL,/dev/null,g -e s,inchi-1.exe,../../INCHI_EXE/bin/Linux/inchi-1,g inchify_zzp.cmd
+ dos2unix inchify_zzp.sh
dos2unix: converting file inchify_zzp.sh to Unix format...
~/build/BUILD/INCHI-1-SRC
+ popd
+ RPM_EC=0
++ jobs -p
+ exit 0
Executing(%build): /bin/sh -e /var/tmp/rpm-tmp.zKBGkK
+ umask 022
+ cd /builddir/build/BUILD
~/build/BUILD/INCHI-1-SRC/INCHI_API/demos/inchi_main/gcc ~/build/BUILD/INCHI-1-SRC
+ CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CFLAGS
+ CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CXXFLAGS
+ FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FFLAGS
+ FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FCFLAGS
+ VALAFLAGS=-g
+ export VALAFLAGS
+ LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -specs=/usr/lib/rpm/redhat/redhat-package-notes'
+ export LDFLAGS
+ LT_SYS_LIBRARY_PATH=/usr/lib:
+ export LT_SYS_LIBRARY_PATH
+ CC=gcc
+ export CC
+ CXX=g++
+ export CXX
+ cd INCHI-1-SRC
+ pushd INCHI_API/demos/inchi_main/gcc
+ /usr/bin/make -O -j2 V=1 VERBOSE=1 'SHARED_LINK_PARM=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection' 'OPTFLAGS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable'
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_ichimain.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_ichi_io.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_ichi_parms.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_inchi_atom.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_0dstereo.c
In function 'e_set_stereo_atom_parity',
inlined from 'set_0D_stereo_parities' at ../src/e_0dstereo.c:3803:25:
../src/e_0dstereo.c:3402:14: warning: 'rmin' may be used uninitialized [-Wmaybe-uninitialized]
3402 | if (rmin / rmax < MIN_SINE)
| ~~~~~^~~~~~
../src/e_0dstereo.c: In function 'set_0D_stereo_parities':
../src/e_0dstereo.c:3272:34: note: 'rmin' was declared here
3272 | double bond_len_xy[4], rmax, rmin;
| ^~~~
In function 'e_set_stereo_atom_parity',
inlined from 'set_0D_stereo_parities' at ../src/e_0dstereo.c:3803:25:
../src/e_0dstereo.c:3402:14: warning: 'rmax' may be used uninitialized [-Wmaybe-uninitialized]
3402 | if (rmin / rmax < MIN_SINE)
| ~~~~~^~~~~~
../src/e_0dstereo.c: In function 'set_0D_stereo_parities':
../src/e_0dstereo.c:3272:28: note: 'rmax' was declared here
3272 | double bond_len_xy[4], rmax, rmin;
| ^~~~
In function 'e_Get2DTetrahedralAmbiguity',
inlined from 'e_set_stereo_atom_parity' at ../src/e_0dstereo.c:3555:45,
inlined from 'set_0D_stereo_parities' at ../src/e_0dstereo.c:3803:25:
../src/e_0dstereo.c:1288:36: warning: 'cur_first_Up' may be used uninitialized [-Wmaybe-uninitialized]
1288 | next2 = ( first_Up + len_Up + i ) % nNumNeigh; /* the 2nd after Up sequence */
| ~~~~~~~~~^~~~~~~~
../src/e_0dstereo.c: In function 'set_0D_stereo_parities':
../src/e_0dstereo.c:1189:51: note: 'cur_first_Up' was declared here
1189 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~~~~~
In function 'e_Get2DTetrahedralAmbiguity',
inlined from 'e_set_stereo_atom_parity' at ../src/e_0dstereo.c:3555:45,
inlined from 'set_0D_stereo_parities' at ../src/e_0dstereo.c:3803:25:
../src/e_0dstereo.c:1395:68: warning: 'first_Up' may be used uninitialized [-Wmaybe-uninitialized]
1395 | dBondDirection[nBondOrder[( first_Up ) % nNumNeigh]];
| ~~~~~~~~~~~~~^~~~~~~~~~~
../src/e_0dstereo.c: In function 'set_0D_stereo_parities':
../src/e_0dstereo.c:1189:73: note: 'first_Up' was declared here
1189 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_mol2atom.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_readmol.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_readstru.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_readinch.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_ichimain_a.c
gcc -DBUILD_LINK_AS_DLL -DTARGET_EXE_USING_API -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/e_util.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichicano.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichi_io.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichierr.c
../../../../INCHI_BASE/src/ichierr.c:34: warning: ignoring '#pragma warning ' [-Wunknown-pragmas]
34 | #pragma warning( disable : 4706 4127 4514 4100 4786 4996 4244 4267 )
|
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichican2.c
../../../../INCHI_BASE/src/ichican2.c: In function 'CanonGraph':
../../../../INCHI_BASE/src/ichican2.c:4217:21: warning: the address of 'kLeast_rho_fix' will always evaluate as 'true' [-Waddress]
4217 | if (pzb_rho_fix && kLeast_rho_fix && 0 == qzb_rho_fix)
| ^~
../../../../INCHI_BASE/src/ichican2.c:4220:13: warning: the comparison will always evaluate as 'true' for the address of 'kLeast_rho_fix' will never be NULL [-Waddress]
4220 | if (kLeast_rho_fix)
| ^~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichican2.c:3762:12: note: 'kLeast_rho_fix' declared here
3762 | kLeast kLeast_rho_fix[MAX_LAYERS];
| ^~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichican2.c:4269:9: warning: the address of 'kLeast_rho' will always evaluate as 'true' [-Waddress]
4269 | if (kLeast_rho)
| ^~~~~~~~~~
../../../../INCHI_BASE/src/ichican2.c:4425:10: warning: 'tvc' may be used uninitialized [-Wmaybe-uninitialized]
4425 | GetUnorderedPartitionMcrNode( &theta, tvh ))
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichican2.c:3736:10: note: 'tvc' was declared here
3736 | Node tvc, tvh;
| ^~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichicans.c
../../../../INCHI_BASE/src/ichicans.c: In function 'UnmarkNonStereo':
../../../../INCHI_BASE/src/ichicans.c:494:42: warning: 'j' may be used uninitialized [-Wmaybe-uninitialized]
494 | nPrevAtomRank = nRank[j];
| ^
../../../../INCHI_BASE/src/ichicans.c:320:20: note: 'j' was declared here
320 | int i, i1, i2, j, k, k1, k2, kn /* neigh*/, val, ic/* center*/, jc, num_implicit_H;
| ^
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiisot.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ichilnct.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichimak2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichimap1.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichimake.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichimap2.c
../../../../INCHI_BASE/src/ichimap2.c: In function 'parity_of_mapped_atom2':
../../../../INCHI_BASE/src/ichimap2.c:1233:32: warning: 'neigh_canon_from_min' may be used uninitialized [-Wmaybe-uninitialized]
1233 | r1 = nNeighRankFrom[neigh_canon_from_min];
| ~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichimap2.c:1155:42: note: 'neigh_canon_from_min' was declared here
1155 | int r1, r2, r, r_canon_from_min, neigh_canon_from_min, r_canon_from;
| ^~~~~~~~~~~~~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichimap4.c
../../../../INCHI_BASE/src/ichimap4.c: In function 'map_stereo_bonds4':
../../../../INCHI_BASE/src/ichimap4.c:995:25: warning: 'at_to_n1' may be used uninitialized [-Wmaybe-uninitialized]
995 | CurTreeRemoveIfLastAtom( cur_tree, at_to_n1 );
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichimap4.c:737:37: note: 'at_to_n1' was declared here
737 | int at_from_n1, at_to_n1, at_no_n1_num_success = 0;
| ^~~~~~~~
../../../../INCHI_BASE/src/ichimap4.c:979:37: warning: 'at_to_n2' may be used uninitialized [-Wmaybe-uninitialized]
979 | CurTreeRemoveIfLastAtom( cur_tree, at_to_n2 );
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichimap4.c:810:41: note: 'at_to_n2' was declared here
810 | int at_from_n2, at_to_n2;
| ^~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichinorm.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiparm.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiprt2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiprt1.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiqueu.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiring.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichisort.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiprt3.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichister.c
In function 'Get2DTetrahedralAmbiguity',
inlined from 'set_stereo_atom_parity' at ../../../../INCHI_BASE/src/ichister.c:4208:35:
../../../../INCHI_BASE/src/ichister.c:549:36: warning: 'cur_first_Up' may be used uninitialized [-Wmaybe-uninitialized]
549 | next2 = ( first_Up + len_Up + i ) % nNumNeigh; /* the 2nd after Up sequence */
| ~~~~~~~~~^~~~~~~~
../../../../INCHI_BASE/src/ichister.c: In function 'set_stereo_atom_parity':
../../../../INCHI_BASE/src/ichister.c:398:51: note: 'cur_first_Up' was declared here
398 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~~~~~
In function 'Get2DTetrahedralAmbiguity',
inlined from 'set_stereo_atom_parity' at ../../../../INCHI_BASE/src/ichister.c:4208:35:
../../../../INCHI_BASE/src/ichister.c:590:39: warning: 'first_Up' may be used uninitialized [-Wmaybe-uninitialized]
590 | dAlpha = dBondDirection[nBondOrder[first_Up]];
| ~~~~~~~~~~^~~~~~~~~~
../../../../INCHI_BASE/src/ichister.c: In function 'set_stereo_atom_parity':
../../../../INCHI_BASE/src/ichister.c:398:73: note: 'first_Up' was declared here
398 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichitaut.c
../../../../INCHI_BASE/src/ichitaut.c: In function 'MarkTautomerGroups':
../../../../INCHI_BASE/src/ichitaut.c:4352:29: warning: the address of 'DfsPath' will always evaluate as 'true' [-Waddress]
4352 | if (!nDfsPathPos || !DfsPath)
| ^
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/inchi_dll.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichi_bns.c
../../../../INCHI_BASE/src/ichi_bns.c: In function 'ReInitBnStructForAltBns':
../../../../INCHI_BASE/src/ichi_bns.c:11800:45: warning: operation on 'pBond->cap' may be undefined [-Wsequence-point]
11800 | pBond->nBondNonStereoAltBns =
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~^
11801 | pBond->nBlockNumberAltBns =
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~
11802 | pBond->nNumAtInBlockAltBns = 0;
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichi_bns.c: In function 'fix_special_bonds':
../../../../INCHI_BASE/src/ichi_bns.c:2462:56: warning: 'n2' may be used uninitialized [-Wmaybe-uninitialized]
2462 | if (NULL != memchr( en + ELEM_N_FST, at[n2].el_number, ELEM_N_LEN ))
| ^
../../../../INCHI_BASE/src/ichi_bns.c:2196:19: note: 'n2' was declared here
2196 | int i, k, n1, n2, n3, n4, i1, i2, i3, i4, bond_type;
| ^~
../../../../INCHI_BASE/src/ichi_bns.c:2482:24: warning: 'i2' may be used uninitialized [-Wmaybe-uninitialized]
2482 | if (i1 != i2)
| ^
../../../../INCHI_BASE/src/ichi_bns.c:2196:35: note: 'i2' was declared here
2196 | int i, k, n1, n2, n3, n4, i1, i2, i3, i4, bond_type;
| ^~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichiread.c
../../../../INCHI_BASE/src/ichiread.c: In function 'ParseSegmentSp2':
../../../../INCHI_BASE/src/ichiread.c:6923:48: warning: the comparison will always evaluate as 'false' for the pointer operand in 'pInChIFrom + ((sizetype)iComponent + (sizetype)i) * 88' must not be NULL [-Waddress]
6923 | if (NULL == pInChIFrom || NULL == pInChIFrom + iComponent + i)
| ^~
../../../../INCHI_BASE/src/ichiread.c: In function 'ParseSegmentSp3':
../../../../INCHI_BASE/src/ichiread.c:6678:20: warning: 'mpy_component' may be used uninitialized [-Wmaybe-uninitialized]
6678 | iComponent += mpy_component;
| ~~~~~~~~~~~^~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichiread.c:6472:9: note: 'mpy_component' was declared here
6472 | int mpy_component, val;
| ^~~~~~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr1.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr2.c
../../../../INCHI_BASE/src/ichirvr2.c: In function 'RestoreAtomConnectionsSetStereo':
../../../../INCHI_BASE/src/ichirvr2.c:307:24: warning: operation on 'jv' may be undefined [-Wsequence-point]
307 | at[jv = at[n_vertex].neighbor[0]].valence + at[jv].num_H == 3 &&
| ~~~^~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichirvr2.c:309:24: warning: operation on 'jn' may be undefined [-Wsequence-point]
309 | at[jn = at[n_vertex].neighbor[1]].valence + at[jn].num_H == 3 &&
| ~~~^~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichirvr2.c: In function 'MovePlusFromS2DiaminoCarbon':
../../../../INCHI_BASE/src/ichirvr2.c:3778:20: warning: operation on 'pvS' may be undefined [-Wsequence-point]
3778 | ( pvS = pBNS->vert + i )->st_edge.cap == pvS->st_edge.flow &&
| ~~~~~~^~~~~~~~~~~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr3.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr5.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr4.c
../../../../INCHI_BASE/src/ichirvr4.c: In function 'FixMoreHydrogenInFormula':
../../../../INCHI_BASE/src/ichirvr4.c:451:24: warning: operation on 'neigh' may be undefined [-Wsequence-point]
451 | at2[neigh = at2[i].neighbor[0]].chem_bonds_valence > at2[neigh].valence
| ~~~~~~^~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichirvr4.c: In function 'AddRemIsoProtonsInRestrStruct':
../../../../INCHI_BASE/src/ichirvr4.c:3865:44: warning: the address of 'num_prot' will always evaluate as 'true' [-Waddress]
3865 | for (iComp = 0; iComp < num_components && num_prot; iComp++)
| ^~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr6.c
../../../../INCHI_BASE/src/ichirvr6.c: In function 'FixRestoredStructureStereo':
../../../../INCHI_BASE/src/ichirvr6.c:241:15: warning: 'pe' may be used uninitialized [-Wmaybe-uninitialized]
241 | pe->flow--; /* new radical on v2 */
| ~~^~~~~~
../../../../INCHI_BASE/src/ichirvr6.c:84:17: note: 'pe' was declared here
84 | BNS_EDGE *pe, *peRad;
| ^~
../../../../INCHI_BASE/src/ichirvr6.c:1183:23: warning: 'e' may be used uninitialized [-Wmaybe-uninitialized]
1183 | if (ret = AddToEdgeList( &AllChargeEdges, e, INC_ADD_EDGE ))
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/ichirvr6.c:82:22: note: 'e' was declared here
82 | int j12, v1, v2, e, vRad;
| ^
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ikey_dll.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ikey_base26.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/inchi_dll_main.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/inchi_dll_a.c
../../../libinchi/src/inchi_dll_a.c: In function 'INCHIGEN_Reset':
../../../libinchi/src/inchi_dll_a.c:1215:21: warning: the comparison will always evaluate as 'true' for the address of 'vt_group_info' will never be NULL [-Waddress]
1215 | if (&( ( HGen->cti[k] )->vt_group_info ))
| ^
In file included from ../../../libinchi/src/inchi_dll_a.c:70:
../../../libinchi/src/inchi_dll_a.h:49:18: note: 'vt_group_info' declared here
49 | T_GROUP_INFO vt_group_info;
| ^~~~~~~~~~~~~
../../../libinchi/src/inchi_dll_a.c:1220:21: warning: the comparison will always evaluate as 'true' for the address of 'vt_group_info_orig' will never be NULL [-Waddress]
1220 | if (&( ( HGen->cti[k] )->vt_group_info_orig ))
| ^
../../../libinchi/src/inchi_dll_a.h:50:18: note: 'vt_group_info_orig' declared here
50 | T_GROUP_INFO vt_group_info_orig;
| ^~~~~~~~~~~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/ichirvr7.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/inchi_dll_a2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_inchikey_builder.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/inchi_dll_b.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_status.c
../../../libinchi/src/ixa/ixa_status.c: In function 'STATUS_PushMessage':
../../../libinchi/src/ixa/ixa_status.c:177:12: warning: implicit declaration of function 'vsnprintf'; did you mean 'vsprintf'? [-Wimplicit-function-declaration]
177 | size = vsnprintf( buffer, sizeof( buffer ), pFormat, arguments ) + 1;
| ^~~~~~~~~
| vsprintf
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_read_mol.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_builder.c
In function 'IXA_INCHIBUILDER_SetMolecule',
inlined from 'IXA_INCHIBUILDER_SetMolecule' at ../../../libinchi/src/ixa/ixa_builder.c:758:17:
../../../libinchi/src/ixa/ixa_builder.c:1231:28: warning: 'internal1' may be used uninitialized [-Wmaybe-uninitialized]
1231 | flag = IsRectOrAntiRectCentre( hStatus, hMolecule,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
1232 | vertex1a, vertex1b, internal1, vertex2a, vertex2b, internal2 );
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../libinchi/src/ixa/ixa_builder.c: In function 'IXA_INCHIBUILDER_SetMolecule':
../../../libinchi/src/ixa/ixa_builder.c:1192:32: note: 'internal1' was declared here
1192 | IXA_ATOMID internal1;
| ^~~~~~~~~
In function 'IXA_INCHIBUILDER_SetMolecule',
inlined from 'IXA_INCHIBUILDER_SetMolecule' at ../../../libinchi/src/ixa/ixa_builder.c:758:17:
../../../libinchi/src/ixa/ixa_builder.c:1231:28: warning: 'internal2' may be used uninitialized [-Wmaybe-uninitialized]
1231 | flag = IsRectOrAntiRectCentre( hStatus, hMolecule,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
1232 | vertex1a, vertex1b, internal1, vertex2a, vertex2b, internal2 );
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../libinchi/src/ixa/ixa_builder.c: In function 'IXA_INCHIBUILDER_SetMolecule':
../../../libinchi/src/ixa/ixa_builder.c:1195:32: note: 'internal2' was declared here
1195 | IXA_ATOMID internal2;
| ^~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_read_inchi.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../libinchi/src/ixa/ixa_mol.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/mol_fmt2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/mol_fmt1.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/mol_fmt3.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/mol2atom.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/mol_fmt4.c
../../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../../INCHI_BASE/src/mol_fmt4.c:1258:39: warning: '%3d' directive writing between 3 and 4 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1258 | sprintf( entry, " %3d %3d", i + 1, (int) at[i].charge );
| ^~~
../../../../INCHI_BASE/src/mol_fmt4.c:1258:33: note: directive argument in the range [-128, 127]
1258 | sprintf( entry, " %3d %3d", i + 1, (int) at[i].charge );
| ^~~~~~~~~~
In file included from /usr/include/stdio.h:906,
from ../../../../INCHI_BASE/src/mode.h:38,
from ../../../../INCHI_BASE/src/mol_fmt4.c:41:
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../../INCHI_BASE/src/mol_fmt4.c:1258:17:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 15 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../../INCHI_BASE/src/mol_fmt4.c:1286:43: warning: '%3d' directive writing 3 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1286 | sprintf( entry, " %3d %3d", i + 1, radical );
| ^~~
../../../../INCHI_BASE/src/mol_fmt4.c:1286:37: note: directive argument in the range [1, 3]
1286 | sprintf( entry, " %3d %3d", i + 1, radical );
| ^~~~~~~~~~
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../../INCHI_BASE/src/mol_fmt4.c:1286:21:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 14 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
../../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../../INCHI_BASE/src/mol_fmt4.c:1347:39: warning: '%3d' directive writing between 3 and 11 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1347 | sprintf( entry, " %3d %3d", i + 1, iso );
| ^~~
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../../INCHI_BASE/src/mol_fmt4.c:1347:17:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 22 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/readinch.c
../../../../INCHI_BASE/src/readinch.c: In function 'InchiToInpAtom':
../../../../INCHI_BASE/src/readinch.c:626:17: warning: the address of 'szLine' will always evaluate as 'true' [-Waddress]
626 | if (szLine && strstr( szLine, "/Z:" ))
| ^~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/runichi.c
In file included from ../../../../INCHI_BASE/src/runichi.c:48:
In function 'mark_atoms_to_delete_or_renumber',
inlined from 'OAD_StructureEdits_Apply' at ../../../../INCHI_BASE/src/runichi.c:2498:16:
../../../../INCHI_BASE/src/mode.h:1133:24: warning: argument 1 range [2147483648, 4294967295] exceeds maximum object size 2147483647 [-Walloc-size-larger-than=]
1133 | #define inchi_calloc calloc
In file included from ../../../../INCHI_BASE/src/runichi.c:40:
/usr/include/stdlib.h: In function 'OAD_StructureEdits_Apply':
/usr/include/stdlib.h:556:14: note: in a call to allocation function 'calloc' declared here
556 | extern void *calloc (size_t __nmemb, size_t __size)
| ^~~~~~
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/runichi2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/runichi4.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/runichi3.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/sha2.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/util.c
gcc -fPIC -DTARGET_API_LIB -DCOMPILE_ANSI_ONLY -ansi -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../../INCHI_BASE/src/strutil.c
gcc -shared -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -o ../../../bin/Linux/libinchi.so.1.06.00 \
ichican2.o ichicano.o ichi_io.o ichierr.o ichicans.o ichiisot.o ichilnct.o ichimak2.o ichimake.o ichimap1.o ichimap2.o ichimap4.o ichinorm.o ichiparm.o ichiprt1.o ichiprt2.o ichiprt3.o ichiqueu.o ichiring.o ichisort.o ichister.o ichitaut.o ichi_bns.o inchi_dll.o ichiread.o ichirvr1.o ichirvr2.o ichirvr3.o ichirvr4.o ichirvr5.o ichirvr6.o ichirvr7.o ikey_dll.o ikey_base26.o inchi_dll_main.o inchi_dll_a.o inchi_dll_a2.o inchi_dll_b.o ixa_inchikey_builder.o ixa_read_mol.o ixa_status.o ixa_builder.o ixa_mol.o ixa_read_inchi.o mol_fmt1.o mol_fmt2.o mol_fmt3.o mol2atom.o mol_fmt4.o readinch.o runichi.o runichi2.o runichi3.o runichi4.o sha2.o strutil.o util.o -Wl,--version-script=libinchi.map,-z,relro,-soname,libinchi.so.1 -lm
ln -fs libinchi.so.1.06.00 \
../../../bin/Linux/libinchi.so.1
In function 'mark_atoms_to_delete_or_renumber',
inlined from 'OAD_StructureEdits_Apply.isra' at ../../../../INCHI_BASE/src/runichi.c:2498:16:
../../../../INCHI_BASE/src/runichi.c:3086:25: warning: argument 1 range [2147483648, 4294967295] exceeds maximum object size 2147483647 [-Walloc-size-larger-than=]
3086 | atnums = (int *)inchi_calloc(max_atoms, sizeof(int));
| ^
/usr/include/stdlib.h: In function 'OAD_StructureEdits_Apply.isra':
/usr/include/stdlib.h:556:14: note: in a call to allocation function 'calloc' declared here
556 | extern void *calloc (size_t __nmemb, size_t __size)
| ^
gcc -o ../../../bin/Linux/inchi_main e_0dstereo.o e_ichimain.o e_ichi_io.o e_ichi_parms.o e_inchi_atom.o e_mol2atom.o e_readinch.o e_readmol.o e_readstru.o e_util.o e_ichimain_a.o \
../../../bin/Linux/libinchi.so.1.06.00 -lm
+ popd
~/build/BUILD/INCHI-1-SRC
+ pushd INCHI_EXE/inchi-1/gcc
~/build/BUILD/INCHI-1-SRC/INCHI_EXE/inchi-1/gcc ~/build/BUILD/INCHI-1-SRC
+ /usr/bin/make -O -j2 V=1 VERBOSE=1 'LINKER_OPTIONS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection' 'OPTFLAGS=-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable'
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichi_io.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichicano.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichi_bns.c
../../../INCHI_BASE/src/ichi_bns.c: In function 'ReInitBnStructForAltBns':
../../../INCHI_BASE/src/ichi_bns.c:11800:45: warning: operation on 'pBond->cap' may be undefined [-Wsequence-point]
11800 | pBond->nBondNonStereoAltBns =
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~^
11801 | pBond->nBlockNumberAltBns =
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~
11802 | pBond->nNumAtInBlockAltBns = 0;
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichi_bns.c: In function 'fix_special_bonds':
../../../INCHI_BASE/src/ichi_bns.c:2462:56: warning: 'n2' may be used uninitialized [-Wmaybe-uninitialized]
2462 | if (NULL != memchr( en + ELEM_N_FST, at[n2].el_number, ELEM_N_LEN ))
| ^
../../../INCHI_BASE/src/ichi_bns.c:2196:19: note: 'n2' was declared here
2196 | int i, k, n1, n2, n3, n4, i1, i2, i3, i4, bond_type;
| ^~
../../../INCHI_BASE/src/ichi_bns.c:2482:24: warning: 'i2' may be used uninitialized [-Wmaybe-uninitialized]
2482 | if (i1 != i2)
| ^
../../../INCHI_BASE/src/ichi_bns.c:2196:35: note: 'i2' was declared here
2196 | int i, k, n1, n2, n3, n4, i1, i2, i3, i4, bond_type;
| ^~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichican2.c
../../../INCHI_BASE/src/ichican2.c: In function 'CanonGraph':
../../../INCHI_BASE/src/ichican2.c:4217:21: warning: the address of 'kLeast_rho_fix' will always evaluate as 'true' [-Waddress]
4217 | if (pzb_rho_fix && kLeast_rho_fix && 0 == qzb_rho_fix)
| ^~
../../../INCHI_BASE/src/ichican2.c:4220:13: warning: the comparison will always evaluate as 'true' for the address of 'kLeast_rho_fix' will never be NULL [-Waddress]
4220 | if (kLeast_rho_fix)
| ^~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichican2.c:3762:12: note: 'kLeast_rho_fix' declared here
3762 | kLeast kLeast_rho_fix[MAX_LAYERS];
| ^~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichican2.c:4269:9: warning: the address of 'kLeast_rho' will always evaluate as 'true' [-Waddress]
4269 | if (kLeast_rho)
| ^~~~~~~~~~
In function 'GetUnorderedPartitionMcrNode',
inlined from 'CanonGraph' at ../../../INCHI_BASE/src/ichican2.c:4425:10:
../../../INCHI_BASE/src/ichican2.c:1363:49: warning: 'tvc' may be used uninitialized [-Wmaybe-uninitialized]
1363 | Node ret = (Node) ( 1 + nGetMcr2( p1->equ2, (AT_RANK) ( v - 1 ) ) );
| ^~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichican2.c: In function 'CanonGraph':
../../../INCHI_BASE/src/ichican2.c:3736:10: note: 'tvc' was declared here
3736 | Node tvc, tvh;
| ^~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichierr.c
../../../INCHI_BASE/src/ichierr.c:34: warning: ignoring '#pragma warning ' [-Wunknown-pragmas]
34 | #pragma warning( disable : 4706 4127 4514 4100 4786 4996 4244 4267 )
|
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiisot.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichicans.c
../../../INCHI_BASE/src/ichicans.c: In function 'UnmarkNonStereo':
../../../INCHI_BASE/src/ichicans.c:494:42: warning: 'j' may be used uninitialized [-Wmaybe-uninitialized]
494 | nPrevAtomRank = nRank[j];
| ^
../../../INCHI_BASE/src/ichicans.c:320:20: note: 'j' was declared here
320 | int i, i1, i2, j, k, k1, k2, kn /* neigh*/, val, ic/* center*/, jc, num_implicit_H;
| ^
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichimak2.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichimap1.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichimake.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichimap4.c
../../../INCHI_BASE/src/ichimap4.c: In function 'map_stereo_bonds4':
../../../INCHI_BASE/src/ichimap4.c:995:25: warning: 'at_to_n1' may be used uninitialized [-Wmaybe-uninitialized]
995 | CurTreeRemoveIfLastAtom( cur_tree, at_to_n1 );
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichimap4.c:737:37: note: 'at_to_n1' was declared here
737 | int at_from_n1, at_to_n1, at_no_n1_num_success = 0;
| ^~~~~~~~
../../../INCHI_BASE/src/ichimap4.c:979:37: warning: 'at_to_n2' may be used uninitialized [-Wmaybe-uninitialized]
979 | CurTreeRemoveIfLastAtom( cur_tree, at_to_n2 );
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichimap4.c:810:41: note: 'at_to_n2' was declared here
810 | int at_from_n2, at_to_n2;
| ^~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichinorm.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichimap2.c
../../../INCHI_BASE/src/ichimap2.c: In function 'parity_of_mapped_atom2':
../../../INCHI_BASE/src/ichimap2.c:1233:32: warning: 'neigh_canon_from_min' may be used uninitialized [-Wmaybe-uninitialized]
1233 | r1 = nNeighRankFrom[neigh_canon_from_min];
| ~~~~~~~~~~~~~~^~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichimap2.c:1155:42: note: 'neigh_canon_from_min' was declared here
1155 | int r1, r2, r, r_canon_from_min, neigh_canon_from_min, r_canon_from;
| ^~~~~~~~~~~~~~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiprt2.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiprt1.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiqueu.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiring.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiprt3.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichisort.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichister.c
In function 'Get2DTetrahedralAmbiguity',
inlined from 'set_stereo_atom_parity' at ../../../INCHI_BASE/src/ichister.c:4208:35:
../../../INCHI_BASE/src/ichister.c:549:36: warning: 'cur_first_Up' may be used uninitialized [-Wmaybe-uninitialized]
549 | next2 = ( first_Up + len_Up + i ) % nNumNeigh; /* the 2nd after Up sequence */
| ~~~~~~~~~^~~~~~~~
../../../INCHI_BASE/src/ichister.c: In function 'set_stereo_atom_parity':
../../../INCHI_BASE/src/ichister.c:398:51: note: 'cur_first_Up' was declared here
398 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~~~~~
In function 'Get2DTetrahedralAmbiguity',
inlined from 'set_stereo_atom_parity' at ../../../INCHI_BASE/src/ichister.c:4208:35:
../../../INCHI_BASE/src/ichister.c:590:39: warning: 'first_Up' may be used uninitialized [-Wmaybe-uninitialized]
590 | dAlpha = dBondDirection[nBondOrder[first_Up]];
| ~~~~~~~~~~^~~~~~~~~~
../../../INCHI_BASE/src/ichister.c: In function 'set_stereo_atom_parity':
../../../INCHI_BASE/src/ichister.c:398:73: note: 'first_Up' was declared here
398 | int i, num_Up, num_Dn, bPrev_Up, cur_len_Up, cur_first_Up, len_Up, first_Up;
| ^~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichitaut.c
../../../INCHI_BASE/src/ichitaut.c: In function 'MarkTautomerGroups':
../../../INCHI_BASE/src/ichitaut.c:4352:29: warning: the address of 'DfsPath' will always evaluate as 'true' [-Waddress]
4352 | if (!nDfsPathPos || !DfsPath)
| ^
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiparm.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr1.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichiread.c
../../../INCHI_BASE/src/ichiread.c: In function 'ParseSegmentSp2':
../../../INCHI_BASE/src/ichiread.c:6923:48: warning: the comparison will always evaluate as 'false' for the pointer operand in 'pInChIFrom + ((sizetype)iComponent + (sizetype)i) * 88' must not be NULL [-Waddress]
6923 | if (NULL == pInChIFrom || NULL == pInChIFrom + iComponent + i)
| ^~
../../../INCHI_BASE/src/ichiread.c: In function 'ParseSegmentSp3':
../../../INCHI_BASE/src/ichiread.c:6678:20: warning: 'mpy_component' may be used uninitialized [-Wmaybe-uninitialized]
6678 | iComponent += mpy_component;
| ~~~~~~~~~~~^~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichiread.c:6472:9: note: 'mpy_component' was declared here
6472 | int mpy_component, val;
| ^~~~~~~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr2.c
../../../INCHI_BASE/src/ichirvr2.c: In function 'RestoreAtomConnectionsSetStereo':
../../../INCHI_BASE/src/ichirvr2.c:307:24: warning: operation on 'jv' may be undefined [-Wsequence-point]
307 | at[jv = at[n_vertex].neighbor[0]].valence + at[jv].num_H == 3 &&
| ~~~^~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichirvr2.c:309:24: warning: operation on 'jn' may be undefined [-Wsequence-point]
309 | at[jn = at[n_vertex].neighbor[1]].valence + at[jn].num_H == 3 &&
| ~~~^~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichirvr2.c: In function 'MovePlusFromS2DiaminoCarbon':
../../../INCHI_BASE/src/ichirvr2.c:3778:20: warning: operation on 'pvS' may be undefined [-Wsequence-point]
3778 | ( pvS = pBNS->vert + i )->st_edge.cap == pvS->st_edge.flow &&
| ~~~~~~^~~~~~~~~~~~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr4.c
../../../INCHI_BASE/src/ichirvr4.c: In function 'FixMoreHydrogenInFormula':
../../../INCHI_BASE/src/ichirvr4.c:451:24: warning: operation on 'neigh' may be undefined [-Wsequence-point]
451 | at2[neigh = at2[i].neighbor[0]].chem_bonds_valence > at2[neigh].valence
| ~~~~~~^~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichirvr4.c: In function 'AddRemIsoProtonsInRestrStruct':
../../../INCHI_BASE/src/ichirvr4.c:3865:44: warning: the address of 'num_prot' will always evaluate as 'true' [-Waddress]
3865 | for (iComp = 0; iComp < num_components && num_prot; iComp++)
| ^~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr5.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr3.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr6.c
../../../INCHI_BASE/src/ichirvr6.c: In function 'FixRestoredStructureStereo':
../../../INCHI_BASE/src/ichirvr6.c:241:15: warning: 'pe' may be used uninitialized [-Wmaybe-uninitialized]
241 | pe->flow--; /* new radical on v2 */
| ~~^~~~~~
../../../INCHI_BASE/src/ichirvr6.c:84:17: note: 'pe' was declared here
84 | BNS_EDGE *pe, *peRad;
| ^~
../../../INCHI_BASE/src/ichirvr6.c:1183:23: warning: 'e' may be used uninitialized [-Wmaybe-uninitialized]
1183 | if (ret = AddToEdgeList( &AllChargeEdges, e, INC_ADD_EDGE ))
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/ichirvr6.c:82:22: note: 'e' was declared here
82 | int j12, v1, v2, e, vRad;
| ^
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ikey_base26.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ikey_dll.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/ichirvr7.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/mol_fmt1.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/mol_fmt2.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/mol_fmt3.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/mol_fmt4.c
../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../INCHI_BASE/src/mol_fmt4.c:1258:39: warning: '%3d' directive writing between 3 and 4 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1258 | sprintf( entry, " %3d %3d", i + 1, (int) at[i].charge );
| ^~~
../../../INCHI_BASE/src/mol_fmt4.c:1258:33: note: directive argument in the range [-128, 127]
1258 | sprintf( entry, " %3d %3d", i + 1, (int) at[i].charge );
| ^~~~~~~~~~
In file included from /usr/include/stdio.h:906,
from ../../../INCHI_BASE/src/mode.h:38,
from ../../../INCHI_BASE/src/mol_fmt4.c:41:
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../INCHI_BASE/src/mol_fmt4.c:1258:17:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 15 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../INCHI_BASE/src/mol_fmt4.c:1286:43: warning: '%3d' directive writing 3 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1286 | sprintf( entry, " %3d %3d", i + 1, radical );
| ^~~
../../../INCHI_BASE/src/mol_fmt4.c:1286:37: note: directive argument in the range [1, 3]
1286 | sprintf( entry, " %3d %3d", i + 1, radical );
| ^~~~~~~~~~
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../INCHI_BASE/src/mol_fmt4.c:1286:21:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 14 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
../../../INCHI_BASE/src/mol_fmt4.c: In function 'OrigAtData_WriteToSDfileAdditionalLines':
../../../INCHI_BASE/src/mol_fmt4.c:1347:39: warning: '%3d' directive writing between 3 and 11 bytes into a region of size between 0 and 5 [-Wformat-overflow=]
1347 | sprintf( entry, " %3d %3d", i + 1, iso );
| ^~~
In function 'sprintf',
inlined from 'OrigAtData_WriteToSDfileAdditionalLines' at ../../../INCHI_BASE/src/mol_fmt4.c:1347:17:
/usr/include/bits/stdio2.h:30:10: note: '__sprintf_chk' output between 9 and 22 bytes into a destination of size 10
30 | return __builtin___sprintf_chk (__s, __USE_FORTIFY_LEVEL - 1,
| ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
31 | __glibc_objsize (__s), __fmt,
| ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
32 | __va_arg_pack ());
| ~~~~~~~~~~~~~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/mol2atom.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/readinch.c
../../../INCHI_BASE/src/readinch.c: In function 'InchiToInpAtom':
../../../INCHI_BASE/src/readinch.c:626:17: warning: the address of 'szLine' will always evaluate as 'true' [-Waddress]
626 | if (szLine && strstr( szLine, "/Z:" ))
| ^~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/runichi.c
In file included from ../../../INCHI_BASE/src/runichi.c:48:
In function 'mark_atoms_to_delete_or_renumber',
inlined from 'OAD_StructureEdits_Apply' at ../../../INCHI_BASE/src/runichi.c:2498:16:
../../../INCHI_BASE/src/mode.h:1133:24: warning: argument 1 range [2147483648, 4294967295] exceeds maximum object size 2147483647 [-Walloc-size-larger-than=]
1133 | #define inchi_calloc calloc
In file included from ../../../INCHI_BASE/src/runichi.c:40:
/usr/include/stdlib.h: In function 'OAD_StructureEdits_Apply':
/usr/include/stdlib.h:556:14: note: in a call to allocation function 'calloc' declared here
556 | extern void *calloc (size_t __nmemb, size_t __size)
| ^~~~~~
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/runichi2.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/runichi4.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/sha2.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/runichi3.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/util.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/dispstru.c
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../src/ichimain.c
../src/ichimain.c: In function 'ProcessSingleInputFile':
../src/ichimain.c:612:30: warning: argument to 'sizeof' in 'memset' call is the same expression as the destination; did you mean to dereference it? [-Wsizeof-pointer-memaccess]
612 | memset( strbuf, 0, sizeof(strbuf) );
| ^
gcc -I../src -I../../../INCHI_BASE/src -ansi -DCOMPILE_ANSI_ONLY -DTARGET_EXE_STANDALONE -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -Wno-comment -Wno-parentheses -Wno-unused -Wno-unused-but-set-variable -c ../../../INCHI_BASE/src/strutil.c
gcc -O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -o ../../bin/Linux/inchi-1 ichi_bns.o ichi_io.o ichicano.o ichican2.o ichicans.o ichierr.o ichiisot.o ichimake.o ichimak2.o ichimap1.o ichimap2.o ichimap4.o ichinorm.o ichiprt1.o ichiprt2.o ichiprt3.o ichiqueu.o ichiring.o ichisort.o ichister.o ichitaut.o ichiparm.o ichiread.o ichirvr1.o ichirvr2.o ichirvr3.o ichirvr4.o ichirvr5.o ichirvr6.o ichirvr7.o ikey_base26.o ikey_dll.o mol_fmt1.o mol_fmt2.o mol_fmt3.o mol_fmt4.o mol2atom.o readinch.o runichi.o runichi2.o runichi3.o runichi4.o sha2.o strutil.o util.o dispstru.o ichimain.o -lm
In function 'mark_atoms_to_delete_or_renumber',
inlined from 'OAD_StructureEdits_Apply.isra' at ../../../INCHI_BASE/src/runichi.c:2498:16:
../../../INCHI_BASE/src/runichi.c:3086:25: warning: argument 1 range [2147483648, 4294967295] exceeds maximum object size 2147483647 [-Walloc-size-larger-than=]
3086 | atnums = (int *)inchi_calloc(max_atoms, sizeof(int));
| ^
/usr/include/stdlib.h: In function 'OAD_StructureEdits_Apply.isra':
/usr/include/stdlib.h:556:14: note: in a call to allocation function 'calloc' declared here
556 | extern void *calloc (size_t __nmemb, size_t __size)
| ^
+ popd
~/build/BUILD/INCHI-1-SRC
+ RPM_EC=0
++ jobs -p
+ exit 0
Executing(%install): /bin/sh -e /var/tmp/rpm-tmp.wfcC1t
+ umask 022
+ cd /builddir/build/BUILD
+ '[' /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386 '!=' / ']'
+ rm -rf /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386
++ dirname /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386
+ mkdir -p /builddir/build/BUILDROOT
+ mkdir /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386
+ CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CFLAGS
+ CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CXXFLAGS
+ FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FFLAGS
+ FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FCFLAGS
+ VALAFLAGS=-g
+ export VALAFLAGS
+ LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -specs=/usr/lib/rpm/redhat/redhat-package-notes'
+ export LDFLAGS
+ LT_SYS_LIBRARY_PATH=/usr/lib:
+ export LT_SYS_LIBRARY_PATH
+ CC=gcc
+ export CC
+ CXX=g++
+ export CXX
+ cd INCHI-1-SRC
+ mkdir -p /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/bin /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/lib /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/include/inchi
+ install -pm 755 INCHI_EXE/bin/Linux/inchi-1 /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/bin/
+ install -p INCHI_API/bin/Linux/libinchi.so.1.06.00 /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/lib
+ ln -s libinchi.so.1.06.00 /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/lib/libinchi.so.1
+ ln -s libinchi.so.1 /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/lib/libinchi.so
+ install -pm644 INCHI_BASE/src/ichisize.h INCHI_BASE/src/inchi_api.h INCHI_BASE/src/ixa.h /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/include/inchi
+ /usr/bin/find-debuginfo -j2 --strict-build-id -m -i --build-id-seed 1.0.6-5.fc38 --unique-debug-suffix -1.0.6-5.fc38.i386 --unique-debug-src-base inchi-1.0.6-5.fc38.i386 --run-dwz --dwz-low-mem-die-limit 10000000 --dwz-max-die-limit 50000000 -S debugsourcefiles.list /builddir/build/BUILD/INCHI-1-SRC
extracting debug info from /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/bin/inchi-1
extracting debug info from /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/lib/libinchi.so.1.06.00
original debug info size: 6476kB, size after compression: 5952kB
/usr/bin/sepdebugcrcfix: Updated 2 CRC32s, 0 CRC32s did match.
13977 blocks
+ /usr/lib/rpm/check-buildroot
+ /usr/lib/rpm/redhat/brp-ldconfig
+ /usr/lib/rpm/brp-compress
+ /usr/lib/rpm/redhat/brp-strip-lto /usr/bin/strip
+ /usr/lib/rpm/brp-strip-static-archive /usr/bin/strip
+ /usr/lib/rpm/check-rpaths
+ /usr/lib/rpm/redhat/brp-mangle-shebangs
+ /usr/lib/rpm/brp-remove-la-files
+ /usr/lib/rpm/redhat/brp-python-bytecompile '' 1 0
+ /usr/lib/rpm/redhat/brp-python-hardlink
Executing(%check): /bin/sh -e /var/tmp/rpm-tmp.hPUJnh
+ umask 022
+ cd /builddir/build/BUILD
+ CFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CFLAGS
+ CXXFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection'
+ export CXXFLAGS
+ FFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FFLAGS
+ FCFLAGS='-O2 -flto=auto -ffat-lto-objects -fexceptions -g -grecord-gcc-switches -pipe -Wall -Werror=format-security -Wp,-D_FORTIFY_SOURCE=2 -Wp,-D_GLIBCXX_ASSERTIONS -specs=/usr/lib/rpm/redhat/redhat-hardened-cc1 -fstack-protector-strong -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -m32 -march=i686 -mtune=generic -msse2 -mfpmath=sse -mstackrealign -fasynchronous-unwind-tables -fstack-clash-protection -fcf-protection -I/usr/lib/gfortran/modules'
+ export FCFLAGS
+ VALAFLAGS=-g
+ export VALAFLAGS
+ LDFLAGS='-Wl,-z,relro -Wl,--as-needed -Wl,-z,now -specs=/usr/lib/rpm/redhat/redhat-hardened-ld -specs=/usr/lib/rpm/redhat/redhat-annobin-cc1 -Wl,--build-id=sha1 -specs=/usr/lib/rpm/redhat/redhat-package-notes'
+ export LDFLAGS
+ LT_SYS_LIBRARY_PATH=/usr/lib:
+ export LT_SYS_LIBRARY_PATH
+ CC=gcc
+ export CC
+ CXX=g++
+ export CXX
+ cd INCHI-1-SRC
~/build/BUILD/INCHI-1-SRC/INCHI-1-TEST/test ~/build/BUILD/INCHI-1-SRC
++ pwd
+ export LD_LIBRARY_PATH=/builddir/build/BUILD/INCHI-1-SRC/INCHI_API/bin/Linux/
+ LD_LIBRARY_PATH=/builddir/build/BUILD/INCHI-1-SRC/INCHI_API/bin/Linux/
+ pushd INCHI-1-TEST/test
+ for f in inchify_{InChI_TestSet,zzp}
+ sh ./inchify_InChI_TestSet.sh
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-std-01.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-std-01.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-std-01.inc its-std-01.log /dev/null -AuxNone -OutErrINCHI -NoLabels -Key"
Generating standard InChI
Generating standard InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.61
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-std-02.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-std-02.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-std-02.inc its-std-02.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.27
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-std-03.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-std-03.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-std-03.inc its-std-03.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SNon -Key"
Using specific structure perception features:
Stereo OFF
Generating standard InChI
Generating standard InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.23
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-std-04.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-std-04.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-std-04.inc its-std-04.log /dev/null -AuxNone -OutErrINCHI -NoLabels -DoNotAddH"
Using specific structure perception features:
Do not add H
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Accepted unusual valence(s): C(1); Mn(1); Zn(1); O(1); N(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #106.
Warning (Accepted unusual valence(s): C(1); B(1); Mn(1); Fe(1); Zn(1); Gd(1); O(1); Ac(1); N(1); Ra(1); Be(1); S(1); P(1); Si(1); Al(1); Se(1); As(1); Mg(1); Ge(1); Ga(1); Ca(1); Te(1); Sb(1); Sn(1); In(1); Po(1); Bi(1); Sr(1); Pb(1); Ba(1); Ni(1); Co(1); Pd(1)...) structure #107.
Warning (Accepted unusual valence(s): Ag(3); C(1); H(3); C(3); Fr(3); Si(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ge(3); Sn(3); Se(3); Te(3); Ba(3); Cs(3)...) structure #108.
Warning (Accepted unusual valence(s): C(1); S-1(2); Si-1(2); Al-1(2); Te-1(2); Sn-1(2); B-1(2); O-1(2); C-1(2); Se-1(2); Ge-1(2); Ga-1(2); Po-1(2); Pb-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): C(1); P-2(2); Al-2(2); Sb-2(2); In-2(2); B-2(2); N-2(2); As-2(2); Ga-2(2); Bi-2(2); Tl-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): C(1); Ra+1(2); S+1(2); P+1(2); Si+1(2); Mg+1(2); Te+1(2); Sn+1(2); Sr+1(2); Be+1(2); O+1(2); N+1(2); C+1(2); Se+1(2); As+1(2); Ge+1(2); Ca+1(2); Po+1(2); Pb+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): C(1); Cl+2(2); S+2(2); P+2(2); Al+2(2); I+2(2); Sb+2(2); In+2(2); B+2(2); F+2(2); O+2(2); N+2(2); Br+2(2); Se+2(2); As+2(2); Ga+2(2); At+2(2); Bi+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); C(2); Hg(3); C(1); H(3); Be(3); F(3); O(3); C(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Si(3); Mg(3); Na(3); Se(3); Ge(3); Ca(3); K(3); Te(3); Sn(3); Sr(3); Rb(3); Po(3); Pb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); C(3); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); C(1); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4); As(4); Ga(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); C(1); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4); As(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); C(3); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); C(1); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4)...) structure #116.
Warning (Accepted unusual valence(s): C(2); C(1); B-1(3); O-1(3); N-1(3); P-1(3); Al-1(3); As-1(3); Ga-1(3); Sb-1(3); In-1(3); Bi-1(3); Tl-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): C(2); C(1); N-2(3); C-2(3); Si-2(3); Ge-2(3); Sn-2(3); Pb-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): C(2); C(1); B+1(3); Be+1(3); F+1(3); N+1(3); Ra+1(3); Cl+1(3); P+1(3); Al+1(3); Mg+1(3); Br+1(3); As+1(3); Ca+1(3); I+1(3); Sb+1(3); Sr+1(3); At+1(3); Bi+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): C(2); C(1); B+2(3); O+2(3); C+2(3); S+2(3); Si+2(3); Al+2(3); Se+2(3); Ga+2(3); Te+2(3); In+2(3); Po+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); C(1); Cu(4); Zn(4); Cd(4); C(2); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Br(4); As(4); Ga(4); Ca(4); K(4); I(4); Sb(4); In(4); Sr(4); Rb(4); At(4); Bi(4); Tl(4); Ba(4)) structure #121.
Warning (Accepted unusual valence(s): C(1); C(2); O-1(4); N-1(4); C-1(4); S-1(4); Si-1(4); Se-1(4); Ge-1(4); Te-1(4); Sn-1(4); Po-1(4); Pb-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): C(1); C(2); B-2(4); N-2(4); C-2(4); P-2(4); Si-2(4); Al-2(4); As-2(4); Ga-2(4); Sb-2(4); In-2(4); Bi-2(4); Tl-2(4); Metal was disconnected; Omitted undefined stereo) structure #123.
Warning (Accepted unusual valence(s): C(1); C(2); B+1(4); Be+1(4); F+1(4); O+1(4); C+1(4); S+1(4); Si+1(4); Al+1(4); Mg+1(4); Se+1(4); Ge+1(4); Ca+1(4); Te+1(4); Sn+1(4); Sr+1(4); Po+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): C(1); C(2); B+2(4); F+2(4); N+2(4); C+2(4); Cl+2(4); P+2(4); Si+2(4); Al+2(4); Br+2(4); As+2(4); Ga+2(4); I+2(4); Sb+2(4); In+2(4); At+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); C(1); Cu(5); C(2); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); S(5); Si(5); Al(5); Mg(5); Na(5); Se(5); Ge(5); Ga(5); Ca(5); K(5); Te(5); Sn(5); In(5); Sr(5); Rb(5); Po(5); Pb(5)...) structure #126.
Warning (Accepted unusual valence(s): C(1); C(2); B-1(5); O-1(5); N-1(5); C-1(5); P-1(5); Al-1(5); As-1(5); Ga-1(5); Sb-1(5); In-1(5); Bi-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): C(1); C(2); B-2(5); N-2(5); C-2(5); Si-2(5); Ge-2(5); Sn-2(5); Pb-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): C(1); C(2); B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); Cl+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); Br+1(5); As+1(5); Ge+1(5); Ca+1(5); I+1(5); Sb+1(5); Sn+1(5); Sr+1(5); At+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5)...) structure #129.
Warning (Accepted unusual valence(s): C(1); C(2); B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); C(2); Cu(6); Zn(6); Cd(6); C(3); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); C(1); F(6); O(6); N(6); C(6); Li(6); Cl(6); P(6); Si(6); Al(6); Mg(6); Na(6); Br(6); As(6); Ge(6); Ga(6); Ca(6); K(6); I(6); Sb(6); Sn(6); In(6)) structure #131.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(6); C(1); O-1(6); N-1(6); C-1(6); S-1(6); Si-1(6); Al-1(6); Se-1(6); Ge-1(6); Ga-1(6); Te-1(6); Sn-1(6); In-1(6); Po-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(6); C(1); N-2(6); C-2(6); P-2(6); Si-2(6); Al-2(6); As-2(6); Ga-2(6); Sb-2(6); In-2(6); Bi-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(6); Be+1(6); C(1); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)) structure #134.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(6); C(1); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); C(2); Cu(6); Zn(7); Cd(7); C(3); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); C(1); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7)) structure #136.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(7); C(1); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(7); C(1); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(7); Be+1(7); C(1); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7)) structure #139.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(7); C(1); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); C(2); Cu(8); C(3); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8)) structure #141.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); C(1); Metal was disconnected...) structure #142.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); C(1); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8)...) structure #144.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); C(1); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); O(1); N(1); C(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); N(2); C(2); Si(2); Ge(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); B(2); Fr(2); Ac(2); Rf(2); F(2); Cl(2); Br(2); I(2); At(2); Gd(2)...) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); O(1); N(1); C(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #148.
Warning (Accepted unusual valence(s): N-1(1); C-1(1); Si-1(1); Ge-1(1); Sn-1(1); Pb-1(1); B-1(1); Bi-1(1); Sb-1(1); As-1(1); P-1(1); Al-1(1); Ga-1(1); In-1(1); Tl-1(1); Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Accepted unusual valence(s): C-2(1); Si-2(1); Ge-2(1); Sn-2(1); Pb-2(1); B-2(1); Al-2(1); Ga-2(1); In-2(1); Tl-2(1); Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Accepted unusual valence(s): O+1(1); N+1(1); C+1(1); S+1(1); Si+1(1); Se+1(1); Ge+1(1); Te+1(1); Sn+1(1); Po+1(1); Pb+1(1); B+1(1); F+1(1); Cl+1(1); Br+1(1); I+1(1); At+1(1); Bi+1(1); Sb+1(1); As+1(1); P+1(1); Al+1(1); Metal was disconnected) structure #152.
Warning (Accepted unusual valence(s): O+2(1); N+2(1); C+2(1); S+2(1); Si+2(1); Se+2(1); Te+2(1); Po+2(1); F+2(1); Cl+2(1); Br+2(1); I+2(1); At+2(1); Bi+2(1); Sb+2(1); As+2(1); P+2(1); Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Proton(s) added/removed) structure #155.
Warning (Proton(s) added/removed) structure #158.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C,d(1); C(2); Omitted undefined stereo) structure #169.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(1); S(1); Se(1); Te(1); P(1); N-1(1); P-1(1); N+1(3); C(2); P+1(3); Omitted undefined stereo) structure #170.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); C(2); Te(1); N(1); S(1); Se(1); N-1(1); Metal was disconnected; Omitted undefined stereo) structure #171.
Warning (Accepted unusual valence(s): C(2); C(3); C,d(1)) structure #172.
Warning (Accepted unusual valence(s): C(3)) structure #173.
Warning (Accepted unusual valence(s): C(3)) structure #174.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #175.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #176.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #177.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #178.
Warning (Accepted unusual valence(s): C(1)) structure #179.
Warning (Accepted unusual valence(s): C(1)) structure #180.
Warning (Accepted unusual valence(s): C(1)) structure #181.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #182.
Warning (Accepted unusual valence(s): C(1); N(2); C(2); Proton(s) added/removed) structure #186.
Warning (Accepted unusual valence(s): C(1); N(2); N(1); Proton(s) added/removed) structure #187.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(1); N(2); Omitted undefined stereo; Proton(s) added/removed) structure #188.
Warning (Accepted unusual valence(s): O(1); C(2); C(3); C(1); Proton(s) added/removed) structure #189.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); S(1); O+1(1); Proton(s) added/removed) structure #190.
Warning (Accepted unusual valence(s): C(3); O(1); S(1); Omitted undefined stereo) structure #191.
Warning (Accepted unusual valence(s): C(3)) structure #192.
Warning (Accepted unusual valence(s): N(2); C(3); N(1)) structure #193.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #194.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #195.
Warning (Accepted unusual valence(s): N(2); C(1); C(3)) structure #196.
Warning (Accepted unusual valence(s): C(1); O(1); C(3); N(2)) structure #197.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1); Proton(s) added/removed) structure #198.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); N+1(3)) structure #199.
Warning (Accepted unusual valence(s): C(3)) structure #200.
Warning (Accepted unusual valence(s): N(1)) structure #202.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #203.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #204.
Warning (Accepted unusual valence(s): O(1); C(1); S(1); C(2)) structure #205.
Warning (Accepted unusual valence(s): O(1); C(1); Omitted undefined stereo) structure #206.
Warning (Accepted unusual valence(s): O(1); C(1); Omitted undefined stereo) structure #207.
Warning (Accepted unusual valence(s): O(1); C(1); Omitted undefined stereo) structure #208.
Warning (Accepted unusual valence(s): S(1); C(1); C(2); Omitted undefined stereo) structure #209.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #210.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #211.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #212.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #213.
Warning (Accepted unusual valence(s): O(1); C(1); S(1); C(2); Omitted undefined stereo) structure #214.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(1)) structure #215.
Warning (Accepted unusual valence(s): C(1); C,d(2); C(3); C(2)) structure #216.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(1)) structure #217.
Warning (Accepted unusual valence(s): C(2); C(3); C,d(2); C(1)) structure #218.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(1); C,d(2); C(2)) structure #219.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #220.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(2)) structure #221.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #222.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(2)) structure #223.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1); C,d(2)) structure #224.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #225.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #226.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #227.
Warning (Accepted unusual valence(s): O(1)) structure #228.
Warning (Accepted unusual valence(s): O(1)) structure #229.
Warning (Accepted unusual valence(s): O(1)) structure #230.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #231.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #232.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #233.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #234.
Warning (Accepted unusual valence(s): C(1); O(1); Omitted undefined stereo) structure #235.
Warning (Accepted unusual valence(s): O(1); C(1); Omitted undefined stereo) structure #236.
Warning (Accepted unusual valence(s): C(1); O(1); Omitted undefined stereo) structure #237.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #238.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #239.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #240.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #241.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #242.
Warning (Accepted unusual valence(s): C(2); S(1)) structure #243.
Warning (Accepted unusual valence(s): O(1); C(3)) structure #244.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); C(1); O(1); N(2)) structure #245.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #246.
Warning (Accepted unusual valence(s): N+1(3); C(3); C(1); N-1(1); Omitted undefined stereo) structure #247.
Warning (Accepted unusual valence(s): N-1(1); N+1(2)) structure #248.
Warning (Accepted unusual valence(s): N-1(1); N+1(2)) structure #249.
Warning (Accepted unusual valence(s): P-1(1); As+1(2); As-1(1); P+1(2)) structure #250.
Warning (Accepted unusual valence(s): Sb-1(1); Cl-1(6); O+1(2); Metal was disconnected) structure #251.
Warning (Accepted unusual valence(s): V(6); Te+1(2); Se+1(2); Metal was disconnected) structure #252.
Warning (Accepted unusual valence(s): Si-1(1); V(6); Ge+1(2); Ge-1(1); Si+1(2); Metal was disconnected) structure #253.
Warning (Accepted unusual valence(s): C(1); C(3); O+1(2)) structure #254.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #255.
Warning (Accepted unusual valence(s): P-1(1); O+1(2); N+1(2); Omitted undefined stereo) structure #256.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(3); N-1(1); N+1(2); P-1(1); As+1(2); As-1(1); P+1(2); Sb-1(1); Cl-1(6); O+1(2); V(6); Te+1(2); Se+1(2); Si-1(1); Ge+1(2); Ge-1(1); Si+1(2); C(2); Metal was disconnected; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4); C(2); Metal was disconnected) structure #259.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #260.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #261.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); C(1)) structure #262.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #264.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #265.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #266.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #267.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #268.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #269.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #270.
Warning (Accepted unusual valence(s): C(1)) structure #271.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #272.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #273.
Warning (Accepted unusual valence(s): C(1)) structure #274.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #275.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #276.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #277.
Warning (Accepted unusual valence(s): C(1)) structure #278.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #279.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #280.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); C(1)) structure #281.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #284.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #285.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #286.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #287.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #288.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #289.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #290.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #291.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #292.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #293.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #294.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #295.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #296.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #297.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #298.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #299.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #300.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #301.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #302.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #303.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #304.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #305.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #306.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #307.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #308.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #309.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #310.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #311.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #312.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #313.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #314.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #315.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); Metal was disconnected) structure #316.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #317.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #318.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #319.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #320.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #321.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #322.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #323.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #324.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #325.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #326.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #327.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #328.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #329.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); O(4); C(3); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #332.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #333.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #334.
Warning (Accepted unusual valence(s): C(1)) structure #335.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1); C(2)) structure #337.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #338.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #339.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #340.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #341.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #342.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #343.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #344.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #345.
Warning (Accepted unusual valence(s): C(1)) structure #346.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #347.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #348.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #349.
Warning (Accepted unusual valence(s): C(1)) structure #350.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #351.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #352.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #353.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #354.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #355.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #356.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #357.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #358.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #359.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #360.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #361.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #362.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #363.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #364.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #365.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #366.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #367.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #368.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #369.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #370.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #371.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #372.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #373.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1); Metal was disconnected) structure #374.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1); Metal was disconnected) structure #375.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #376.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #377.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #378.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #379.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #380.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #381.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #382.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #383.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #384.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #385.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #386.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #387.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #388.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #389.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1); C(2); C-1(2); C+1(2); C(3); C-1(1); C+1(1); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2); C(1)) structure #392.
Warning (Accepted unusual valence(s): C(1)) structure #393.
Warning (Accepted unusual valence(s): C(1)) structure #394.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #395.
Warning (Accepted unusual valence(s): C(1)) structure #396.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #397.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #398.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #399.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #400.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #401.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #402.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(1); C(2); Metal was disconnected; Proton(s) added/removed) structure #404.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); C(1); C(3); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #405.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); C(3); N(2); S(1)) structure #406.
Warning (Accepted unusual valence(s): C(3); C(1); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); N(2); C(2); Metal was disconnected; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); N(1); N-1(1); P-1(1); Omitted undefined stereo) structure #409.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); Metal was disconnected; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1); P(1); N(1); N(2); P(2); As(2); N(4); As(4); Omitted undefined stereo) structure #411.
Warning (Accepted unusual valence(s): O(1); C(3); C(1); C(2); N(2); S(8); Se(8); Te(8); Omitted undefined stereo; Proton(s) added/removed) structure #412.
Warning (Accepted unusual valence(s): O(1); N(2); C(3); S(1); C(1); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #413.
Warning (Accepted unusual valence(s): O(1); N(1); S(1); Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1); Metal was disconnected; Omitted undefined stereo) structure #415.
Warning (Accepted unusual valence(s): S(8); O(1); N(2); C(3); Se(8); Te(8); Po(8); S(1); C(1); Metal was disconnected; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); O(1); N(1); Se(8); Te(8); Po(8); S(1); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); N(1); N(2); C(3); Se(8); Te(8); Po(8); C(1); Metal was disconnected) structure #418.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); O(1); S(1); Se(1); Te(1); C(1); P(2); N-1(1); Metal was disconnected; Omitted undefined stereo) structure #419.
Warning (Accepted unusual valence(s): C(1)) structure #420.
Warning (Accepted unusual valence(s): C(1)) structure #421.
Warning (Accepted unusual valence(s): C(1); N(1)) structure #422.
Warning (Accepted unusual valence(s): C(1); N(2); O(1)) structure #423.
Warning (Accepted unusual valence(s): C(1); N(1); N(2); O(1)) structure #424.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #425.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #426.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #427.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #428.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #429.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #430.
Warning (Accepted unusual valence(s): C(1)) structure #431.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #432.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #433.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #434.
Warning (Accepted unusual valence(s): C(1)) structure #435.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #436.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #437.
Warning (Accepted unusual valence(s): C(1)) structure #438.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #439.
Warning (Accepted unusual valence(s): C(1)) structure #440.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #441.
Warning (Accepted unusual valence(s): C(1)) structure #442.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #443.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #444.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); N(2); Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); N(2); Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Accepted unusual valence(s): C(1)) structure #447.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #448.
Warning (Accepted unusual valence(s): C(1)) structure #449.
Warning (Accepted unusual valence(s): C(1)) structure #450.
Warning (Accepted unusual valence(s): C(1)) structure #451.
Warning (Accepted unusual valence(s): C(1)) structure #452.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #456.
Warning (Accepted unusual valence(s): C(1)) structure #457.
Warning (Accepted unusual valence(s): C(1)) structure #458.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #460.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #461.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #462.
Warning (Accepted unusual valence(s): C(1)) structure #463.
Warning (Accepted unusual valence(s): C(1)) structure #464.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #465.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #466.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #468.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Accepted unusual valence(s): C(3)) structure #470.
Warning (Accepted unusual valence(s): C(1); C(3); Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #472.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #473.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #474.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #475.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #476.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #477.
Warning (Accepted unusual valence(s): C(1)) structure #478.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Accepted unusual valence(s): C(1)) structure #480.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #484.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #485.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #486.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #487.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #488.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #489.
Warning (Accepted unusual valence(s): C(1)) structure #490.
Warning (Accepted unusual valence(s): C(1)) structure #491.
Warning (Accepted unusual valence(s): C(1)) structure #492.
Warning (Accepted unusual valence(s): C(1)) structure #493.
Warning (Accepted unusual valence(s): C(1)) structure #494.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #497.
Warning (Accepted unusual valence(s): C(1); C(3); N(1)) structure #498.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #499.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #500.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #501.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #502.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); C(2); C(1)) structure #503.
Warning (Accepted unusual valence(s): C(3); C(5); C,d(1)) structure #504.
Warning (Accepted unusual valence(s): C(3); N(2); C(2); Omitted undefined stereo) structure #505.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #506.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #507.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #508.
Warning (Accepted unusual valence(s): C(3); N(2); C(2)) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #511.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #512.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4)) structure #513.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #514.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #515.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #516.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #517.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #518.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #519.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #520.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed; Omitted undefined stereo) structure #521.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed; Omitted undefined stereo) structure #522.
Warning (Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #524.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #525.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #526.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); Omitted undefined stereo) structure #527.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #528.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); C(2); C(1); Omitted undefined stereo) structure #529.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #530.
Warning (Accepted unusual valence(s): C(1)) structure #532.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #533.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #534.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #535.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #538.
Warning (Accepted unusual valence(s): C(3); Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); C(3); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #543.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #544.
Warning (Accepted unusual valence(s): C(3); C,d(2); Omitted undefined stereo) structure #545.
Warning (Accepted unusual valence(s): C(1)) structure #546.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #547.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); Omitted undefined stereo) structure #548.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #549.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); C(2)) structure #550.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #551.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #552.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1); Omitted undefined stereo) structure #553.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #554.
Warning (Accepted unusual valence(s): C(3)) structure #555.
Warning (Accepted unusual valence(s): C(3)) structure #556.
Warning (Accepted unusual valence(s): C(3)) structure #557.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #559.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #560.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #561.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #562.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #564.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #565.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #566.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #567.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #568.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #569.
Warning (Accepted unusual valence(s): C(3); C(2); Si(3)) structure #570.
Warning (Accepted unusual valence(s): C(3); C(2); Si(3)) structure #571.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #574.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #575.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #577.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #579.
Warning (Accepted unusual valence(s): N(1); C(1)) structure #580.
Warning (Accepted unusual valence(s): O(1); C(3); C(1); N(2); N(1)) structure #582.
Warning (Accepted unusual valence(s): O(1); C(3); C(2); C(1); Omitted undefined stereo) structure #583.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #584.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1); Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Accepted unusual valence(s): C(3); C(2); N(1)) structure #589.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #590.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1)) structure #591.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); C(1); Omitted undefined stereo) structure #592.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1)) structure #593.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1); Proton(s) added/removed) structure #594.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #595.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); O(1); C(1)) structure #596.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1)) structure #597.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1); O(1); Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Accepted unusual valence(s): C(3); N+1(2); C,d(1); N(1); Omitted undefined stereo) structure #600.
Warning (Accepted unusual valence(s): C(2); C(1); C(3); Omitted undefined stereo) structure #601.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #602.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #603.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #604.
Warning (Accepted unusual valence(s): C(2); O(1)) structure #605.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #606.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1); Proton(s) added/removed) structure #607.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(1)) structure #608.
Warning (Accepted unusual valence(s): C(3); N(1); C(2); O(1)) structure #609.
Warning (Accepted unusual valence(s): C(3); N(1); N+1(1); C(2); Proton(s) added/removed) structure #610.
Warning (Accepted unusual valence(s): C(3); N+1(1); N(1); C(2); Proton(s) added/removed) structure #611.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1)) structure #612.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(1); Proton(s) added/removed) structure #613.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #614.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #615.
Warning (Accepted unusual valence(s): C(2); O(1)) structure #616.
Warning (Accepted unusual valence(s): C(2); O(1); C(1); C(3); N+1(1); N(1); Proton(s) added/removed) structure #617.
Warning (Accepted unusual valence(s): N+1(1); C(1); Proton(s) added/removed) structure #618.
Warning (Accepted unusual valence(s): N+1(1); Proton(s) added/removed) structure #619.
Warning (Accepted unusual valence(s): C(3); N+1(1); C(2); Proton(s) added/removed) structure #620.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #621.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(1); Proton(s) added/removed) structure #622.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #623.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #624.
Warning (Accepted unusual valence(s): N+1(1); C(3); N+1(3); N(2); Proton(s) added/removed) structure #625.
Warning (Accepted unusual valence(s): N+1(1); C(2); S(1); Proton(s) added/removed) structure #626.
Warning (Accepted unusual valence(s): N+1(1); C(2); Proton(s) added/removed) structure #627.
Warning (Accepted unusual valence(s): C(3); N+1(1); C(2); O(1); Proton(s) added/removed) structure #628.
Warning (Accepted unusual valence(s): N+1(1); C(2); N(2); N+1(2); N(1); Proton(s) added/removed) structure #629.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(3); C(1); Proton(s) added/removed) structure #630.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); C(1); Proton(s) added/removed) structure #631.
Warning (Accepted unusual valence(s): C(3); N+1(1); N(2); Proton(s) added/removed) structure #632.
Warning (Accepted unusual valence(s): N+1(2); C(2); Proton(s) added/removed) structure #633.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(1); Proton(s) added/removed) structure #634.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(1); O(1); Proton(s) added/removed) structure #635.
Warning (Accepted unusual valence(s): N+1(1); C(2); N(1); Proton(s) added/removed) structure #636.
Warning (Accepted unusual valence(s): C(2); N(1); N+1(1); Proton(s) added/removed) structure #637.
Warning (Accepted unusual valence(s): N+1(1); C(1); C(3); C(2); O(1); N+1(3); N(2); S(1); N+1(2); N(1); Proton(s) added/removed) structure #638.
Warning (Accepted unusual valence(s): C(1); C-1(2)) structure #639.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #640.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #641.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #644.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); N(1); S(1)) structure #645.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #646.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): C(3)) structure #648.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Accepted unusual valence(s): C(3)) structure #650.
Warning (Accepted unusual valence(s): C(3); Proton(s) added/removed) structure #651.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #652.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #653.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #654.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #655.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #656.
Warning (Accepted unusual valence(s): C(2)) structure #657.
Warning (Accepted unusual valence(s): C(2)) structure #658.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1); Omitted undefined stereo) structure #659.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Accepted unusual valence(s): C(1); C(3); Ambiguous stereo: bond(s); center(s); Omitted undefined stereo) structure #661.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #662.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #663.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #664.
Warning (Accepted unusual valence(s): C(3)) structure #666.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #668.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #669.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #670.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #671.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(1)) structure #674.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C(5)) structure #675.
Warning (Accepted unusual valence(s): C(3)) structure #676.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #677.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1); N(2)) structure #678.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C(1); C+1(2)) structure #680.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Accepted unusual valence(s): C(3)) structure #683.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #684.
Warning (Accepted unusual valence(s): C(3)) structure #685.
Warning (Accepted unusual valence(s): C(3)) structure #686.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); Omitted undefined stereo; Proton(s) added/removed) structure #687.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); N(1)) structure #688.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N(1)) structure #689.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); N(2)) structure #690.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(3); O(1); N(2)) structure #691.
Warning (Accepted unusual valence(s): C(3); N+1(3); O(1); N(2)) structure #692.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); N+1(3)) structure #693.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); N(2)) structure #694.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); N+1(3)) structure #695.
Warning (Accepted unusual valence(s): C(3); C(2); N+1(3); N(2)) structure #696.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #697.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); C(3); O(1); Omitted undefined stereo) structure #698.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); C(3); O(1)) structure #699.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N+1(2)) structure #700.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); N+1(2)) structure #701.
Warning (Accepted unusual valence(s): N+1(3); C(3); O(1); N(1)) structure #702.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(2); N(1)) structure #703.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); N(1)) structure #704.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); O(1)) structure #705.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N+1(2); N+1(3); N(1)) structure #706.
Warning (Accepted unusual valence(s): C(2)) structure #708.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); N(2); O(1); N+1(3); Omitted undefined stereo) structure #711.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1); Omitted undefined stereo) structure #712.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #713.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #714.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #715.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #716.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #717.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #718.
Warning (Accepted unusual valence(s): C(3); N+1(2); N(1)) structure #719.
Warning (Accepted unusual valence(s): C(3); N(1); N+1(2)) structure #720.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #721.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #722.
Warning (Accepted unusual valence(s): C(3); C(2); N(1)) structure #723.
Warning (Accepted unusual valence(s): C(2); C(3); N(1)) structure #724.
Warning (Accepted unusual valence(s): C(3); N+1(2); N(1); C(2)) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected; Omitted undefined stereo) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected; Omitted undefined stereo) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected; Omitted undefined stereo) structure #731.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #732.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #733.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(3); S(1); C(1)) structure #735.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); C(1); Omitted undefined stereo) structure #736.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #737.
Warning (Accepted unusual valence(s): C(5); C(3); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): C(3); B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Accepted unusual valence(s): O(1); Metal was disconnected) structure #740.
Warning (Accepted unusual valence(s): C(3); N(2); C(2); Omitted undefined stereo) structure #741.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #742.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #743.
Warning (Accepted unusual valence(s): N(2); C(3); S(5); Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2); N-1(1)) structure #745.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2); N-1(1)) structure #746.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #747.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #748.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #749.
Warning (Accepted unusual valence(s): O(1); C(3); C(5); N(2)) structure #750.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O(1)) structure #751.
Warning (Accepted unusual valence(s): O(1); C(3); C(5); N(2)) structure #752.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O(1)) structure #753.
Warning (Accepted unusual valence(s): C(3)) structure #754.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #755.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #756.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #757.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #758.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #759.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #760.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C(2)) structure #768.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C(1); C(3); Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #772.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #776.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #777.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #778.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #779.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #780.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #781.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #782.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #783.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #784.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #785.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #786.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #787.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #788.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #789.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #790.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #791.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #792.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #793.
Warning (Accepted unusual valence(s): C(1)) structure #794.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #795.
Warning (Accepted unusual valence(s): C(1); N(4); O(1)) structure #796.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #797.
Warning (Accepted unusual valence(s): C(1); O(1); N(4)) structure #798.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #799.
Warning (Accepted unusual valence(s): O(1); C(2); C(3)) structure #800.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1)) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Accepted unusual valence(s): C,d(1)) structure #811.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(1); N(2); N+1(2); Omitted undefined stereo) structure #812.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(2); O(1); N+1(3); N(1); Omitted undefined stereo) structure #813.
Warning (Accepted unusual valence(s): C(3); N+1(3); N(1); N(2); N+1(2); Omitted undefined stereo) structure #814.
Warning (Accepted unusual valence(s): O(1); C(3); N+1(2); Proton(s) added/removed) structure #815.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #816.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #817.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): C(2)) structure #821.
Warning (Accepted unusual valence(s): C(2)) structure #824.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #826.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Accepted unusual valence(s): C(1)) structure #828.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1)) structure #829.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1); Proton(s) added/removed) structure #830.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #831.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); O(1); C(1)) structure #832.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1)) structure #833.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2)) structure #834.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1); O(1); Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(3); C(2); C(5); C(1)) structure #837.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); Omitted undefined stereo; Not chiral) structure #839.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); C(2); Omitted undefined stereo; Not chiral) structure #840.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); C(2); Omitted undefined stereo; Not chiral) structure #841.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); Omitted undefined stereo; Not chiral) structure #842.
Warning (Accepted unusual valence(s): C(3); N+1(3); N(2); C(1); N+1(2); N(1); Omitted undefined stereo) structure #843.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Omitted undefined stereo) structure #845.
Warning (Accepted unusual valence(s): C(1); N+1(2); N(1); Proton(s) added/removed) structure #846.
Warning (Accepted unusual valence(s): C(1); N(1); N(2); N+1(2); N+1(3); Omitted undefined stereo) structure #847.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #849.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #853.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #854.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #855.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); C(5)) structure #856.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); O(3)) structure #857.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1)) structure #858.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #860.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #861.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #862.
Warning (Accepted unusual valence(s): C(3); S(3); N(2); Omitted undefined stereo) structure #863.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); S(3); Omitted undefined stereo) structure #864.
Warning (Accepted unusual valence(s): N(1); C(3)) structure #865.
Warning (Accepted unusual valence(s): N(1); C(3)) structure #866.
Warning (Accepted unusual valence(s): S(3); C(3); C(1); N(2)) structure #867.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #868.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #869.
Warning (Accepted unusual valence(s): N(1); C(3); S(3); C(1); N(2)) structure #870.
Warning (Accepted unusual valence(s): C(1); N+1(3); C(3); Omitted undefined stereo) structure #871.
Warning (Accepted unusual valence(s): C(1); N+1(3); C(3); Omitted undefined stereo) structure #872.
Warning (Accepted unusual valence(s): N(2); C(3); N(1); Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); C(1); C(2); C(3); Metal was disconnected; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #875.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #876.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #878.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #879.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo; Not chiral) structure #881.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #882.
Warning (Accepted unusual valence(s): C+1(1); C(3); N(2); C(1); S(1); Omitted undefined stereo) structure #883.
Warning (Accepted unusual valence(s): C(2); N(1); N(2)) structure #884.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #885.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #886.
Warning (Accepted unusual valence(s): C(3); C(1); C,d(1); O(1)) structure #887.
Warning (Accepted unusual valence(s): N(2); O(1); C(2)) structure #888.
Warning (Accepted unusual valence(s): C(3); C(1); Not chiral) structure #889.
Warning (Accepted unusual valence(s): C(3)) structure #890.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #891.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #892.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #893.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #894.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #895.
Warning (Accepted unusual valence(s): C-1(1); C(3); N(2); C(1); S(1); Omitted undefined stereo) structure #896.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #897.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #898.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #899.
Warning (Accepted unusual valence(s): C-1(1); N(2); C(3); C(1); S(1); Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Accepted unusual valence(s): C-1(1); N(2); C(3); C(1); S(1); Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #909.
Warning (Accepted unusual valence(s): C,d(2)) structure #911.
Warning (Accepted unusual valence(s): C,d(2); C-1(2)) structure #912.
Warning (Accepted unusual valence(s): C(3); C(2); Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): C(3); Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): C(3); Fe(10); C(1); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): N(2); C(3); C(2); C(1)) structure #917.
Warning (Accepted unusual valence(s): N(2); C(3); C(2); C(1)) structure #918.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #919.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #920.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2)) structure #921.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1); Omitted undefined stereo) structure #922.
Warning (Accepted unusual valence(s): C(1); O(1); Omitted undefined stereo) structure #923.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #924.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2); O(1); Omitted undefined stereo) structure #925.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #926.
Warning (Accepted unusual valence(s): O(1); C(3)) structure #927.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #928.
Warning (Accepted unusual valence(s): O(1); C(3); N(2)) structure #929.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #930.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #931.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(2)) structure #932.
Warning (Accepted unusual valence(s): C(1); O(1); Omitted undefined stereo) structure #933.
Warning (Accepted unusual valence(s): C(1); N(2); Omitted undefined stereo) structure #934.
Warning (Accepted unusual valence(s): C(1); N(2); O(1)) structure #935.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #936.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); O(1); Omitted undefined stereo) structure #937.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #938.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #939.
Warning (Accepted unusual valence(s): C(1); O(1); N(2); C(3); Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); C(2); N(2); C(1); N(4); O(1)) structure #941.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3); Omitted undefined stereo) structure #942.
Warning (Accepted unusual valence(s): N(2); C(2); S(1); C(3); Omitted undefined stereo) structure #943.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3); Omitted undefined stereo) structure #944.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3); Omitted undefined stereo) structure #945.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #946.
Warning (Accepted unusual valence(s): C(1); O(1); Omitted undefined stereo) structure #947.
Warning (Accepted unusual valence(s): C(1); N(2); O(1); Omitted undefined stereo) structure #948.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #949.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #950.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #951.
Warning (Accepted unusual valence(s): O(1); C(3); C(1); Omitted undefined stereo) structure #952.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #953.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1); Omitted undefined stereo) structure #954.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #955.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #956.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #957.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #958.
Warning (Accepted unusual valence(s): C(1); O(1); C(2)) structure #959.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(1)) structure #960.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); O(1); Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): N(2); N(1); C(3)) structure #962.
Warning (Accepted unusual valence(s): N(2); N(1); C(3)) structure #963.
Warning (Accepted unusual valence(s): C(1); C(2); B(4); H(2)) structure #965.
Warning (Accepted unusual valence(s): O(1)) structure #968.
Warning (Accepted unusual valence(s): C(2); N(2); C(1); O(1); C(3); Proton(s) added/removed) structure #971.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(2)) structure #972.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); N(2); Omitted undefined stereo) structure #973.
Warning (Accepted unusual valence(s): C(1); N(2); N(1); O(1)) structure #974.
Warning (Accepted unusual valence(s): C(1); N(2); N(1)) structure #975.
Warning (Accepted unusual valence(s): N(2); N(1); C(3); C(1); Omitted undefined stereo) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(2); O(1); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Accepted unusual valence(s): O(1)) structure #982.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1)) structure #983.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); Proton(s) added/removed) structure #984.
Warning (Accepted unusual valence(s): I(2)) structure #985.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #986.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #987.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #988.
Warning (Charges were rearranged) structure #989.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #990.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(1); P+1(1); Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #996.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #997.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #998.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #999.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1000.
Warning (Accepted unusual valence(s): C(2); N(1); Omitted undefined stereo) structure #1002.
Warning (Accepted unusual valence(s): C(2); N(1); Omitted undefined stereo) structure #1003.
Warning (Accepted unusual valence(s): C(2); N(1)) structure #1004.
Warning (Accepted unusual valence(s): C(1)) structure #1005.
Warning (Accepted unusual valence(s): C(1)) structure #1006.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1007.
Warning (Accepted unusual valence(s): O(1); N(2); C(3)) structure #1008.
Warning (Accepted unusual valence(s): O(1)) structure #1009.
Warning (Accepted unusual valence(s): O(1); C(2); C(3); N(1)) structure #1010.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #1011.
Warning (Accepted unusual valence(s): C(2); C(1); C(3); Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1014.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(2)) structure #1015.
Warning (Accepted unusual valence(s): N(4); C(3); N(2); C(1); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1087.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1088.
Warning (Accepted unusual valence(s): C(3); N-1(1)) structure #1089.
Warning (Accepted unusual valence(s): C(3); N(2); N-1(1); Proton(s) added/removed) structure #1090.
Warning (Accepted unusual valence(s): N(2); O(1)) structure #1091.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1092.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1093.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1094.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1095.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #1096.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #1097.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1098.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); C(1)) structure #1099.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1100.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1101.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1102.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1103.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1104.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); C(1)) structure #1105.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1106.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1107.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1108.
Warning (Accepted unusual valence(s): N(4); C(3); C(1); Metal was disconnected; Omitted undefined stereo) structure #1109.
Warning (Accepted unusual valence(s): N(1)) structure #1110.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #1111.
Warning (Accepted unusual valence(s): C(3)) structure #1112.
Warning (Accepted unusual valence(s): H(2); C(3); C(2)) structure #1114.
Warning (Accepted unusual valence(s): P+1(2); N(1); C(3); P(1); N+1(2); C(1); Omitted undefined stereo) structure #1115.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1116.
Warning (Accepted unusual valence(s): C(2); N(1); O(1); Proton(s) added/removed) structure #1117.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1118.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Accepted unusual valence(s): C(2); N(1); O(1); Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): C(3); Fe(10); O(1); Ni(10); Metal was disconnected) structure #1122.
Warning (Accepted unusual valence(s): C(3); O(1); C(2); C(1); Omitted undefined stereo) structure #1123.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2); Omitted undefined stereo) structure #1124.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1125.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1126.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2); Omitted undefined stereo) structure #1127.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2)) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #1130.
Warning (Accepted unusual valence(s): C(2); O(1); Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1133.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1134.
Warning (Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1135.
Warning (Accepted unusual valence(s): C(3)) structure #1136.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); N(1); C(1); Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1159.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); O(1); Omitted undefined stereo) structure #1160.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1161.
Warning (Accepted unusual valence(s): N+1(3); N+1(1); C(3); C(2); Omitted undefined stereo) structure #1162.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1165.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #1166.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1167.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1168.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1169.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1170.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1171.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1172.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1173.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1174.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1175.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1176.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1177.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1178.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1179.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1180.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1181.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1182.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1183.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1184.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1185.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1186.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1187.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1188.
Warning (Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1189.
Warning (Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1190.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(1)) structure #1191.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1192.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); N+1(1); Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #1196.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #1197.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #1198.
Warning (Accepted unusual valence(s): C(3); N(1); C(1); O(1)) structure #1199.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1200.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1201.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1202.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1203.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1204.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1205.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1206.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1207.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1208.
Warning (Accepted unusual valence(s): N(2)) structure #1209.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1210.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1211.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2)) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1216.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); C(3)) structure #1217.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1218.
Warning (Accepted unusual valence(s): Se(1); C(1); S(1)) structure #1219.
Warning (Proton(s) added/removed) structure #1220.
Warning (Accepted unusual valence(s): C(2); O+1(2); C(1)) structure #1221.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1222.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1227.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1228.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1229.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1230.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1231.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1232.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1233.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1234.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1235.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1236.
Warning (Accepted unusual valence(s): C(1); N-1(4)) structure #1237.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Metal was disconnected; Omitted undefined stereo) structure #1238.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Proton(s) added/removed) structure #1239.
Warning (Accepted unusual valence(s): N(2); C+1(2); O(1)) structure #1240.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1241.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1242.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #1244.
Warning (Accepted unusual valence(s): C(1); C(3); P(1); N(1); Omitted undefined stereo) structure #1245.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Accepted unusual valence(s): P(4)) structure #1249.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1); Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1); Omitted undefined stereo) structure #1257.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); C(1); C(2); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): O(1); C(1); C(2); C(3)) structure #1264.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); N(2); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(2); N(2)) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(1); N(1)) structure #1281.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1284.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1285.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1286.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1287.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1288.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); N(2); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); C(3); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(3)) structure #1296.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1298.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1299.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1300.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1301.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1302.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1303.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1304.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1305.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1306.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Accepted unusual valence(s): N(2); C(1); C(2)) structure #1313.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); C(3); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Sb(4); Mo(9); C(3); Metal was disconnected) structure #1322.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Accepted unusual valence(s): P(4)) structure #1334.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Accepted unusual valence(s): C(2)) structure #1339.
Warning (Metal was disconnected) structure #1340.
Warning (Accepted unusual valence(s): O(1); C(3); Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #1343.
Warning (Accepted unusual valence(s): N(2); C(1); C(3); O(1)) structure #1344.
Warning (Accepted unusual valence(s): N(2); C(1); C(3); Proton(s) added/removed) structure #1345.
Warning (Accepted unusual valence(s): I(2); C(3)) structure #1347.
Warning (Charges were rearranged) structure #1348.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); Omitted undefined stereo) structure #1350.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1351.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): P(4); Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(1); Ambiguous stereo: bond(s)) structure #1356.
Warning (Accepted unusual valence(s): O(1); N(2)) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); N(2); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1366.
Warning (Accepted unusual valence(s): P(4)) structure #1367.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): O(1); Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1377.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(2); C(1); N(2)) structure #1380.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(1)) structure #1382.
Warning (Accepted unusual valence(s): C(3); N-1(1)) structure #1385.
Warning (Accepted unusual valence(s): N(2); C(3); C(1); O(1)) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Accepted unusual valence(s): N(1); C(3); C(1); C(2); N(2)) structure #1391.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Accepted unusual valence(s): N(1); N+1(3); N(2); Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C(3); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Accepted unusual valence(s): C(3); N(2); C(2); C(1); O(1); N(1); Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1404.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1); Omitted undefined stereo) structure #1419.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1421.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1422.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1423.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1424.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1425.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1426.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1427.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1428.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1429.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1430.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1432.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): N(1); C(2); N(2); O(1)) structure #1436.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); C(1)) structure #1437.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); N(2); C(1)) structure #1438.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1439.
Warning (Accepted unusual valence(s): C(5); Fe(10); C(3); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); C(2); C(3); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1447.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1448.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); C(1)) structure #1449.
Warning (Accepted unusual valence(s): C(2); O(1); C(3)) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2)) structure #1455.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Proton(s) added/removed) structure #1456.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); S+1(1); C(3); Metal was disconnected; Omitted undefined stereo) structure #1463.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2)) structure #1464.
Warning (Accepted unusual valence(s): O(1); C(3); C(2)) structure #1465.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(1); C(3)) structure #1466.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): O(1); C(1); N(1); N(2)) structure #1469.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1470.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); C(1); Metal was disconnected) structure #1473.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2); N(1)) structure #1476.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Not chiral) structure #1477.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1478.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1479.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1480.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1481.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1482.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); O(1)) structure #1483.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #1485.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1489.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); O(1); Omitted undefined stereo) structure #1490.
Warning (Accepted unusual valence(s): N(1); C(3); N(2); O(1)) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected) structure #1494.
Warning (Accepted unusual valence(s): C(3); C+1(1); Proton(s) added/removed; Omitted undefined stereo) structure #1495.
Warning (Accepted unusual valence(s): C(3); C-1(1)) structure #1496.
Warning (Accepted unusual valence(s): C(3); C+1(1); C-1(1); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1501.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1508.
Warning (Accepted unusual valence(s): C(3)) structure #1509.
Warning (Accepted unusual valence(s): O(1)) structure #1510.
Warning (Accepted unusual valence(s): N(2); C(1); Proton(s) added/removed) structure #1511.
Warning (Accepted unusual valence(s): N-1(1); C(1)) structure #1512.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); Omitted undefined stereo) structure #1515.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #1516.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1519.
Warning (Accepted unusual valence(s): C(3)) structure #1520.
Warning (Accepted unusual valence(s): C(3)) structure #1521.
Warning (Accepted unusual valence(s): C(3)) structure #1522.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1523.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1524.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1525.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1526.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1527.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1528.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1529.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1530.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); N(2); C(1)) structure #1531.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1532.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1533.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1534.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1535.
Warning (Accepted unusual valence(s): C(3); S(1)) structure #1537.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1538.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1539.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1540.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1541.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1)) structure #1542.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1543.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1544.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N(1)) structure #1545.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1546.
Warning (Accepted unusual valence(s): C(3); N(1); N(2)) structure #1547.
Warning (Accepted unusual valence(s): C(1)) structure #1548.
Warning (Accepted unusual valence(s): C(1); S(1)) structure #1549.
Warning (Accepted unusual valence(s): N(1)) structure #1550.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1551.
Warning (Accepted unusual valence(s): C(3); S(1); N(1)) structure #1552.
Warning (Accepted unusual valence(s): S(1); N(1)) structure #1553.
Warning (Accepted unusual valence(s): S(1); C(1)) structure #1554.
Warning (Accepted unusual valence(s): N(1)) structure #1555.
Warning (Accepted unusual valence(s): C(3)) structure #1556.
Warning (Accepted unusual valence(s): C(3)) structure #1557.
Warning (Accepted unusual valence(s): C(3)) structure #1558.
Warning (Accepted unusual valence(s): C(3)) structure #1559.
Warning (Accepted unusual valence(s): C(3)) structure #1560.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1561.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1562.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1563.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #1564.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1565.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1566.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1567.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1568.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1569.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1570.
Warning (Accepted unusual valence(s): C(3); C(5); C,d(1); C(1); Proton(s) added/removed) structure #1571.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1572.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1)) structure #1573.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1); C(2); Proton(s) added/removed) structure #1574.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1); Proton(s) added/removed) structure #1575.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(2); O(1)) structure #1576.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1577.
Warning (Accepted unusual valence(s): C(1); C,d(2)) structure #1578.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1579.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1580.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1581.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1582.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1583.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Ambiguous stereo: center(s)) structure #1584.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1585.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1586.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1587.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #1588.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #1589.
Warning (Accepted unusual valence(s): C(3); N+1(1)) structure #1590.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); Omitted undefined stereo) structure #1591.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2)) structure #1592.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2); Proton(s) added/removed) structure #1593.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2); Proton(s) added/removed) structure #1594.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1595.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N+1(1)) structure #1596.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo; Not chiral) structure #1597.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo; Not chiral) structure #1598.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1599.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1600.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo; Not chiral) structure #1601.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo; Not chiral) structure #1602.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1603.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1604.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #1605.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1606.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2); C(2); C(1); S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2); C(2); C(1); Proton(s) added/removed) structure #1609.
Warning (Accepted unusual valence(s): O(1); N(2)) structure #1610.
Warning (Accepted unusual valence(s): C-1(2); C(3)) structure #1611.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #1612.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1613.
Warning (Accepted unusual valence(s): N(2); N(1); C(1)) structure #1614.
Warning (Accepted unusual valence(s): N(1); N(2); S(8); C(1)) structure #1615.
Warning (Accepted unusual valence(s): C(3); N-1,t(2)) structure #1616.
Warning (Accepted unusual valence(s): C(3)) structure #1617.
Warning (Accepted unusual valence(s): C(2); C(3); O(1)) structure #1618.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1619.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Omitted undefined stereo) structure #1620.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1621.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1622.
Warning (Accepted unusual valence(s): C(1); C(3); Metal was disconnected) structure #1623.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); C(1); Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Accepted unusual valence(s): O(1); C(2); Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1632.
Warning (Accepted unusual valence(s): C(3)) structure #1633.
Warning (Accepted unusual valence(s): C(1); S(1); Proton(s) added/removed) structure #1634.
Warning (Accepted unusual valence(s): C(1)) structure #1635.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1636.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #1637.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1638.
Warning (Accepted unusual valence(s): C(3); O(1); S(1)) structure #1639.
Warning (Accepted unusual valence(s): O(1); S(1)) structure #1640.
Warning (Accepted unusual valence(s): O(1); S(1)) structure #1641.
Warning (Accepted unusual valence(s): C(3); O(1); S(1)) structure #1642.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1644.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1645.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1646.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1647.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1648.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1649.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1650.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1651.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1652.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1653.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1654.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1655.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1656.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1657.
Warning (Accepted unusual valence(s): N(1); C(1); S(1)) structure #1658.
Warning (Accepted unusual valence(s): C(1); N(1); C(2)) structure #1659.
Warning (Accepted unusual valence(s): N(2); C(3); C(1); Omitted undefined stereo) structure #1660.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1661.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1662.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1663.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1664.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1665.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1666.
Warning (Accepted unusual valence(s): C(1); C(3); Metal was disconnected; Omitted undefined stereo) structure #1667.
Warning (Accepted unusual valence(s): N(1); C(1); Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1670.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #1671.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1672.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1673.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1674.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1675.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1676.
Warning (Accepted unusual valence(s): C(2); La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): C(2); La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): C(2); Ambiguous stereo: center(s)) structure #1679.
Warning (Accepted unusual valence(s): C(2)) structure #1680.
Warning (Accepted unusual valence(s): C(2); C(1); Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1682.
Warning (Accepted unusual valence(s): C(2); N(2)) structure #1683.
Warning (Accepted unusual valence(s): C(2)) structure #1684.
Warning (Accepted unusual valence(s): N(2); C(2); C(1); La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1686.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1688.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1689.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1690.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1691.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1692.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1693.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1694.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1695.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1696.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1697.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1698.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); La(4); C(3); Metal was disconnected) structure #1699.
Warning (Accepted unusual valence(s): C(2); C(1); C(3); Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1701.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1702.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1703.
Warning (Accepted unusual valence(s): C(2); C(1); Omitted undefined stereo) structure #1704.
Warning (Accepted unusual valence(s): C(2); C(1); Omitted undefined stereo) structure #1705.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1706.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1707.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1708.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1709.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1710.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1711.
Warning (Accepted unusual valence(s): C(2); C(1); Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Accepted unusual valence(s): C(2); C(1); C(3); Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Accepted unusual valence(s): C(2); Ambiguous stereo: center(s)) structure #1715.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1716.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1717.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1718.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1719.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1720.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1721.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1722.
Warning (Accepted unusual valence(s): C(1)) structure #1723.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1724.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #1725.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C,t(1); N+2(1)) structure #1726.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C-1(1); Proton(s) added/removed; Omitted undefined stereo) structure #1727.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #1728.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1729.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1730.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1731.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1732.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1733.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1734.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1735.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1736.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1737.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1738.
Warning (Accepted unusual valence(s): C(3)) structure #1739.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1740.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1741.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1742.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1743.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #1744.
Warning (Accepted unusual valence(s): O(1); C(3); N(1); N(2)) structure #1745.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1746.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1747.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1748.
Warning (Accepted unusual valence(s): C(3); O(1); Omitted undefined stereo) structure #1749.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1750.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); Ambiguous stereo: center(s)) structure #1751.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1752.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Ambiguous stereo: center(s)) structure #1753.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); Ambiguous stereo: center(s)) structure #1754.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1755.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Ambiguous stereo: center(s)) structure #1756.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1757.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Ambiguous stereo: center(s)) structure #1758.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Ambiguous stereo: center(s)) structure #1759.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1760.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1761.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1762.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1763.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1764.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1765.
Warning (Accepted unusual valence(s): C(2)) structure #1766.
Warning (Accepted unusual valence(s): C(2)) structure #1767.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1768.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1769.
Warning (Accepted unusual valence(s): Si(3); C(1)) structure #1770.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1771.
Warning (Accepted unusual valence(s): C(1); O(1); N(2); C(3); Omitted undefined stereo) structure #1772.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #1773.
Warning (Accepted unusual valence(s): C(1); N(1)) structure #1774.
Warning (Accepted unusual valence(s): C(1); C(3); N(1); N+1(2); N(2); N+1(1); N+1(3); Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1779.
Warning (Accepted unusual valence(s): C(1)) structure #1780.
Warning (Accepted unusual valence(s): C(1); C(3); Proton(s) added/removed) structure #1781.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1782.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #1783.
Warning (Accepted unusual valence(s): C(2); N+1(3); Proton(s) added/removed; Omitted undefined stereo) structure #1784.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); N+1(3); Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); Omitted undefined stereo) structure #1786.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); Omitted undefined stereo) structure #1787.
Warning (Accepted unusual valence(s): C(3); N+1(1); Omitted undefined stereo) structure #1788.
Warning (Accepted unusual valence(s): C(3); N+1(1); Omitted undefined stereo) structure #1789.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N+1(1); Omitted undefined stereo) structure #1790.
Warning (Accepted unusual valence(s): C(3)) structure #1791.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); N(2); Omitted undefined stereo) structure #1794.
Warning (Accepted unusual valence(s): C(1); C(3); N(1)) structure #1795.
Warning (Accepted unusual valence(s): C(3)) structure #1796.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(3); C(1); N(2); C(2); Omitted undefined stereo) structure #1797.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1798.
Warning (Accepted unusual valence(s): C(1); C(3); N(1); Omitted undefined stereo) structure #1799.
Warning (Accepted unusual valence(s): C(3)) structure #1800.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #1801.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1802.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1803.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #1804.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1805.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1806.
Warning (Accepted unusual valence(s): C(1); C(3); N(1); N(2)) structure #1807.
Warning (Accepted unusual valence(s): N(2); C(3); N(1)) structure #1808.
Warning (Accepted unusual valence(s): N(1); N+1(1)) structure #1809.
Warning (Accepted unusual valence(s): C(1); Omitted undefined stereo) structure #1810.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1811.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1819.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1820.
Warning (Accepted unusual valence(s): C(3)) structure #1821.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1823.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1825.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1826.
Warning (Accepted unusual valence(s): O(1); Metal was disconnected) structure #1827.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1828.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1829.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1830.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1831.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); P(2); C(5)) structure #1832.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1833.
Warning (Accepted unusual valence(s): C,d(2); C(3)) structure #1834.
Warning (Accepted unusual valence(s): N+1(5); C(1); C,d(1); C(3); N,d(3)) structure #1835.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1836.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1837.
Warning (Accepted unusual valence(s): C(2); N(2); N(1); C(1); Omitted undefined stereo; Not chiral) structure #1838.
Warning (Accepted unusual valence(s): C(1); O+1(2); C(2); N-1(1)) structure #1839.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); C(1)) structure #1840.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1841.
Warning (Charges were rearranged; Accepted unusual valence(s): N-1(1); N(2)) structure #1842.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1843.
Warning (Accepted unusual valence(s): N(1); N(2); C(2); O(1)) structure #1844.
Warning (Accepted unusual valence(s): N(1); C(3); O(1)) structure #1845.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1846.
Warning (Accepted unusual valence(s): C(3); O(1); N-1(1)) structure #1847.
Warning (Accepted unusual valence(s): N(1); O(1)) structure #1848.
Warning (Accepted unusual valence(s): N-1(1); C(3); O(1); Omitted undefined stereo) structure #1849.
Warning (Accepted unusual valence(s): N(2); C(3); O(1)) structure #1850.
Warning (Accepted unusual valence(s): N-1(1); C(3); Omitted undefined stereo) structure #1851.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #1852.
Warning (Accepted unusual valence(s): C(3); N(1); O(1)) structure #1853.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1854.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1855.
Warning (Accepted unusual valence(s): C(3); N(1); C,d(1); N+1(2)) structure #1856.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1)) structure #1857.
Warning (Accepted unusual valence(s): C(3); C,t(1); C,d(1)) structure #1858.
Warning (Accepted unusual valence(s): C(3); S(1)) structure #1860.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1861.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1862.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1863.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #1864.
Warning (Accepted unusual valence(s): C(3); C,d(2)) structure #1865.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1866.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1)) structure #1867.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1868.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1869.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N(1)) structure #1870.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1871.
Warning (Accepted unusual valence(s): C(3); N(1); N(2)) structure #1872.
Warning (Accepted unusual valence(s): C(1)) structure #1873.
Warning (Accepted unusual valence(s): C(1); S(1)) structure #1874.
Warning (Accepted unusual valence(s): N(1)) structure #1875.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1876.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1878.
Warning (Accepted unusual valence(s): C(3); O(1); N(2); C(2)) structure #1879.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1880.
Warning (Accepted unusual valence(s): C(3); S(1); N(1)) structure #1881.
Warning (Accepted unusual valence(s): S(1); N(1)) structure #1882.
Warning (Accepted unusual valence(s): S(1); C(1)) structure #1883.
Warning (Accepted unusual valence(s): N(1)) structure #1884.
Warning (Accepted unusual valence(s): C(3)) structure #1885.
Warning (Accepted unusual valence(s): C(3)) structure #1886.
Warning (Accepted unusual valence(s): C(3)) structure #1887.
Warning (Accepted unusual valence(s): C(3)) structure #1888.
Warning (Accepted unusual valence(s): C(3)) structure #1889.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1890.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1891.
Warning (Accepted unusual valence(s): N(4); C(10); C,d(1); Omitted undefined stereo) structure #1892.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1893.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #1894.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1895.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1896.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1897.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1898.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1899.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1900.
Warning (Accepted unusual valence(s): C(3); N,d(3); C(1); C,d(1); Omitted undefined stereo) structure #1901.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1902.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1903.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1904.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1905.
Warning (Accepted unusual valence(s): S(5); C(3); C,t(1)) structure #1906.
Warning (Accepted unusual valence(s): S(5); C(3)) structure #1907.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1908.
Warning (Accepted unusual valence(s): C,d(1); C(3)) structure #1909.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(2); C(1); Omitted undefined stereo) structure #1910.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1911.
Warning (Accepted unusual valence(s): N+1(5); C(3); C(2); N,d(3); C(1); C,d(1)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5); C(3); C(2); C(1)) structure #1913.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1914.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1915.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1916.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N(1); Omitted undefined stereo) structure #1917.
Warning (Accepted unusual valence(s): N(2); C(3); N(1); C(1); Proton(s) added/removed; Omitted undefined stereo) structure #1918.
Warning (Accepted unusual valence(s): N+1(3); N(2); C(1); Proton(s) added/removed) structure #1919.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(1)) structure #1920.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); C(2); Proton(s) added/removed) structure #1921.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1922.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #1923.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1924.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1925.
Warning (Accepted unusual valence(s): C(3); N+1(2); C(1); Proton(s) added/removed) structure #1926.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1927.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1928.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1929.
Warning (Accepted unusual valence(s): N(2)) structure #1930.
Warning (Accepted unusual valence(s): N(2)) structure #1931.
Warning (Accepted unusual valence(s): N(2)) structure #1932.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1933.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1934.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1935.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #1936.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #1937.
Warning (Accepted unusual valence(s): C(3); N(2); Omitted undefined stereo) structure #1938.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(2); N(1); N(2); Omitted undefined stereo; Proton(s) added/removed) structure #1939.
Warning (Accepted unusual valence(s): N(1); O(1); C(2); Proton(s) added/removed) structure #1940.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); O(1); Proton(s) added/removed) structure #1941.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); C(2); Omitted undefined stereo) structure #1942.
Warning (Accepted unusual valence(s): N(1); C(3); N(2); O(1); C(1); C(2); Omitted undefined stereo) structure #1943.
Warning (Accepted unusual valence(s): C,d(1); N(2)) structure #1944.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); C(1); Proton(s) added/removed) structure #1945.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); Proton(s) added/removed) structure #1946.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); C(1); Proton(s) added/removed; Omitted undefined stereo) structure #1947.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C,d(1)) structure #1948.
Warning (Accepted unusual valence(s): C,d(1); C(2)) structure #1949.
Warning (Accepted unusual valence(s): C,d(2); C(3); C(1); O(1)) structure #1950.
Warning (Accepted unusual valence(s): O(1); C(1); C(3); C(2); Proton(s) added/removed) structure #1951.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #1952.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Omitted undefined stereo) structure #1953.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1954.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1956.
Warning (Accepted unusual valence(s): N(2); N(1); C(3); C(1); Omitted undefined stereo) structure #1957.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1)) structure #1958.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); N(2); O(1)) structure #1959.
Warning (Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1(1); C-1(2); C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1(1); C-1(2); C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3); C(1); C,d(1)) structure #1965.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3); C(1); C,d(1)) structure #1966.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); Omitted undefined stereo) structure #1967.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1)) structure #1968.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1969.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1970.
Warning (Accepted unusual valence(s): C,d(2); C(2); C(1); C(3); C,d(1); Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); C(2); C(1); C(3); C,t(1); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1973.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1974.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1975.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1976.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1977.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1978.
Warning (Accepted unusual valence(s): C(3); N(2); N(1)) structure #1979.
Warning (Accepted unusual valence(s): C(3); N(2); N(1); N-1(1)) structure #1980.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1981.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1982.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1983.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1984.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1985.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #1986.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); N-1(1); Omitted undefined stereo) structure #1987.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); Omitted undefined stereo) structure #1988.
Warning (Accepted unusual valence(s): C(2); O(1); C(1); C(3); N(1); Omitted undefined stereo) structure #1989.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1990.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1994.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); N(2); Proton(s) added/removed) structure #1995.
Warning (Accepted unusual valence(s): C(2)) structure #1996.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1997.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1998.
Warning (Accepted unusual valence(s): C,d(1); C(3); Omitted undefined stereo) structure #1999.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1); Omitted undefined stereo) structure #2000.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); C(2); O(1)) structure #2001.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1); C(2); Se(1)) structure #2002.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1); Se(1); Proton(s) added/removed) structure #2003.
Warning (Accepted unusual valence(s): N-1(1); N(2); C(2); C(1); S(1)) structure #2004.
Warning (Accepted unusual valence(s): N-1(1); N(2); C(2); S(1)) structure #2005.
Warning (Accepted unusual valence(s): N(1); N(2); C(2); S(1)) structure #2006.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2007.
Warning (Accepted unusual valence(s): C(3); N+1(3); C(1); Omitted undefined stereo) structure #2008.
Warning (Accepted unusual valence(s): C(3); N+1(3); C(1); C(2); Omitted undefined stereo) structure #2009.
Warning (Accepted unusual valence(s): O(1); C(2); N-1(1); N(2)) structure #2010.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1)) structure #2011.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1); Omitted undefined stereo) structure #2012.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1); C(1); Omitted undefined stereo) structure #2013.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); N(1); C(1); Omitted undefined stereo) structure #2014.
Warning (Accepted unusual valence(s): C(1); N+1(3)) structure #2015.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(1); Omitted undefined stereo) structure #2016.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2017.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); N+1(3); C-1(2); O+1(2); O(4); N-1(1); C+1(1); C+1(2); C-1(1); C,t(1)) structure #2018.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1)) structure #2019.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); Omitted undefined stereo) structure #2020.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1)) structure #2021.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); N(2); Proton(s) added/removed) structure #2022.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Not chiral) structure #2023.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #2024.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2025.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #2026.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(2)) structure #2027.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2028.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2029.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(2)) structure #2030.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); O(1)) structure #2031.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); O(1)) structure #2032.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Not chiral) structure #2033.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); N(2); C(1); N+1(1)) structure #2034.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #2035.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); Omitted undefined stereo) structure #2036.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #2037.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2038.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2039.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); C+1(1); N(2); Proton(s) added/removed) structure #2040.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); O(1); C(2); C(1); Proton(s) added/removed; Omitted undefined stereo) structure #2041.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2042.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2043.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2044.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2045.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2046.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2047.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(2); C(2); S(1); Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); C+1(1); N(2); Proton(s) added/removed) structure #2049.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #2050.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2051.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2052.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2053.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2054.
Warning (Accepted unusual valence(s): C(3); O(1); N(2); Omitted undefined stereo) structure #2055.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(2); Omitted undefined stereo) structure #2056.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); N(1); Omitted undefined stereo; Proton(s) added/removed) structure #2057.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #2058.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); N(1); Proton(s) added/removed; Omitted undefined stereo) structure #2059.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); Omitted undefined stereo) structure #2060.
Warning (Accepted unusual valence(s): C(1); C(3); Omitted undefined stereo) structure #2061.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #2062.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2063.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2064.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2065.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2066.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2067.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2068.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2069.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2070.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2071.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2072.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2073.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2074.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2075.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2076.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2077.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2078.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2079.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2080.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2081.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2082.
Warning (Accepted unusual valence(s): C(1); Ambiguous stereo: center(s)) structure #2083.
Warning (Accepted unusual valence(s): C(3)) structure #2084.
Warning (Accepted unusual valence(s): C(3)) structure #2085.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): C(3); Omitted undefined stereo) structure #2088.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2089.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2090.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2091.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2092.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2093.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4); O(1); C(3); C,d(1)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2097.
Warning (Accepted unusual valence(s): C(2)) structure #2098.
Warning (Accepted unusual valence(s): C(3); O(1); Charges neutralized) structure #2099.
Warning (Accepted unusual valence(s): C(3); N+1(3); Proton(s) added/removed) structure #2100.
Warning (Accepted unusual valence(s): C(3); N+1(3); Proton(s) added/removed) structure #2101.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #2102.
Warning (Accepted unusual valence(s): C(3); O(1); N+1(3); Charges neutralized; Proton(s) added/removed) structure #2103.
Warning (Accepted unusual valence(s): C(3); Charges neutralized) structure #2104.
Warning (Accepted unusual valence(s): C(1)) structure #2105.
Warning (Accepted unusual valence(s): C(1)) structure #2106.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #2107.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Not chiral) structure #2108.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #2109.
Warning (Accepted unusual valence(s): C(2)) structure #2110.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1); Not chiral) structure #2111.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(3)) structure #2132.
Warning (Accepted unusual valence(s): C(1); C(5)) structure #2133.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); N(2)) structure #2134.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); C(1); O(1); Proton(s) added/removed) structure #2135.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); O(1); C(1); N(1); Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1); Omitted undefined stereo) structure #2137.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #2138.
Warning (Accepted unusual valence(s): S(1); C(1); C(2); Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged; Accepted unusual valence(s): N(1)) structure #2140.
Warning (Accepted unusual valence(s): N(1)) structure #2141.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(2); C(1); S(1)) structure #2142.
Warning (Accepted unusual valence(s): N(2); C(2); C(1); S(1)) structure #2143.
Warning (Charges were rearranged; Accepted unusual valence(s): S(1); C(1); C(2); N(1); N(2); Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2145.
Warning (Accepted unusual valence(s): C(3); C(1); Omitted undefined stereo) structure #2146.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2147.
Warning (Accepted unusual valence(s): C-1(2); C(1); C(3)) structure #2148.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #2149.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #2150.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); Omitted undefined stereo) structure #2151.
Warning (Accepted unusual valence(s): C-1(2); C(1); C(2); C(3); Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C-1(2); C(2); Omitted undefined stereo) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2157.
Warning (Accepted unusual valence(s): C(1)) structure #2158.
Warning (Accepted unusual valence(s): C(1)) structure #2159.
Warning (Accepted unusual valence(s): C(1)) structure #2160.
Warning (Accepted unusual valence(s): C-1(1); C(3)) structure #2161.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #2162.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2163.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #2164.
Warning (Accepted unusual valence(s): C(1); C-1(2); C(3)) structure #2165.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2166.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2167.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2168.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2169.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2170.
Warning (Accepted unusual valence(s): C(1); N+1(3)) structure #2171.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #2172.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4); C-1(1); C(3); C(2); C-1(2); N+1(3); Proton(s) added/removed) structure #2173.
Warning (Accepted unusual valence(s): C(1); N-1(1)) structure #2174.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2175.
Warning (Accepted unusual valence(s): C(1)) structure #2176.
Warning (Accepted unusual valence(s): C(1)) structure #2177.
Warning (Accepted unusual valence(s): O(1); C(1); Proton(s) added/removed) structure #2178.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1)) structure #2179.
Warning (Accepted unusual valence(s): C(2); C-1(1)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): N+1(3); C(1); N-1(1); C(3); C-1(2); C(2); C+1(2); B-1(2); N+1(2); N(2); O(1); C-1(1); Proton(s) added/removed; Omitted undefined stereo) structure #2181.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #2182.
Warning (Accepted unusual valence(s): C(3)) structure #2183.
Warning (Accepted unusual valence(s): C(3); O+1(1); Proton(s) added/removed) structure #2184.
Warning (Accepted unusual valence(s): C(3)) structure #2185.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C-1(2); C(1); C(3); O(1); O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.24
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-std-05.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-std-05.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-std-05.inc its-std-05.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SNon -DoNotAddH"
Using specific structure perception features:
Stereo OFF
Do not add H
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Accepted unusual valence(s): C(1); Mn(1); Zn(1); O(1); N(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #106.
Warning (Accepted unusual valence(s): C(1); B(1); Mn(1); Fe(1); Zn(1); Gd(1); O(1); Ac(1); N(1); Ra(1); Be(1); S(1); P(1); Si(1); Al(1); Se(1); As(1); Mg(1); Ge(1); Ga(1); Ca(1); Te(1); Sb(1); Sn(1); In(1); Po(1); Bi(1); Sr(1); Pb(1); Ba(1); Ni(1); Co(1); Pd(1)...) structure #107.
Warning (Accepted unusual valence(s): Ag(3); C(1); H(3); C(3); Fr(3); Si(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ge(3); Sn(3); Se(3); Te(3); Ba(3); Cs(3)...) structure #108.
Warning (Accepted unusual valence(s): C(1); S-1(2); Si-1(2); Al-1(2); Te-1(2); Sn-1(2); B-1(2); O-1(2); C-1(2); Se-1(2); Ge-1(2); Ga-1(2); Po-1(2); Pb-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): C(1); P-2(2); Al-2(2); Sb-2(2); In-2(2); B-2(2); N-2(2); As-2(2); Ga-2(2); Bi-2(2); Tl-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): C(1); Ra+1(2); S+1(2); P+1(2); Si+1(2); Mg+1(2); Te+1(2); Sn+1(2); Sr+1(2); Be+1(2); O+1(2); N+1(2); C+1(2); Se+1(2); As+1(2); Ge+1(2); Ca+1(2); Po+1(2); Pb+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): C(1); Cl+2(2); S+2(2); P+2(2); Al+2(2); I+2(2); Sb+2(2); In+2(2); B+2(2); F+2(2); O+2(2); N+2(2); Br+2(2); Se+2(2); As+2(2); Ga+2(2); At+2(2); Bi+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); C(2); Hg(3); C(1); H(3); Be(3); F(3); O(3); C(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Si(3); Mg(3); Na(3); Se(3); Ge(3); Ca(3); K(3); Te(3); Sn(3); Sr(3); Rb(3); Po(3); Pb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); C(3); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); C(1); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4); As(4); Ga(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); C(1); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4); As(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); C(3); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); C(1); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Kr(4); Br(4)...) structure #116.
Warning (Accepted unusual valence(s): C(2); C(1); B-1(3); O-1(3); N-1(3); P-1(3); Al-1(3); As-1(3); Ga-1(3); Sb-1(3); In-1(3); Bi-1(3); Tl-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): C(2); C(1); N-2(3); C-2(3); Si-2(3); Ge-2(3); Sn-2(3); Pb-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): C(2); C(1); B+1(3); Be+1(3); F+1(3); N+1(3); Ra+1(3); Cl+1(3); P+1(3); Al+1(3); Mg+1(3); Br+1(3); As+1(3); Ca+1(3); I+1(3); Sb+1(3); Sr+1(3); At+1(3); Bi+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): C(2); C(1); B+2(3); O+2(3); C+2(3); S+2(3); Si+2(3); Al+2(3); Se+2(3); Ga+2(3); Te+2(3); In+2(3); Po+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); C(1); Cu(4); Zn(4); Cd(4); C(2); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Cl(4); P(4); Al(4); Mg(4); Na(4); Br(4); As(4); Ga(4); Ca(4); K(4); I(4); Sb(4); In(4); Sr(4); Rb(4); At(4); Bi(4); Tl(4); Ba(4)) structure #121.
Warning (Accepted unusual valence(s): C(1); C(2); O-1(4); N-1(4); C-1(4); S-1(4); Si-1(4); Se-1(4); Ge-1(4); Te-1(4); Sn-1(4); Po-1(4); Pb-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): C(1); C(2); B-2(4); N-2(4); C-2(4); P-2(4); Si-2(4); Al-2(4); As-2(4); Ga-2(4); Sb-2(4); In-2(4); Bi-2(4); Tl-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): C(1); C(2); B+1(4); Be+1(4); F+1(4); O+1(4); C+1(4); S+1(4); Si+1(4); Al+1(4); Mg+1(4); Se+1(4); Ge+1(4); Ca+1(4); Te+1(4); Sn+1(4); Sr+1(4); Po+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): C(1); C(2); B+2(4); F+2(4); N+2(4); C+2(4); Cl+2(4); P+2(4); Si+2(4); Al+2(4); Br+2(4); As+2(4); Ga+2(4); I+2(4); Sb+2(4); In+2(4); At+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); C(1); Cu(5); C(2); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); S(5); Si(5); Al(5); Mg(5); Na(5); Se(5); Ge(5); Ga(5); Ca(5); K(5); Te(5); Sn(5); In(5); Sr(5); Rb(5); Po(5); Pb(5)...) structure #126.
Warning (Accepted unusual valence(s): C(1); C(2); B-1(5); O-1(5); N-1(5); C-1(5); P-1(5); Al-1(5); As-1(5); Ga-1(5); Sb-1(5); In-1(5); Bi-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): C(1); C(2); B-2(5); N-2(5); C-2(5); Si-2(5); Ge-2(5); Sn-2(5); Pb-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): C(1); C(2); B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); Cl+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); Br+1(5); As+1(5); Ge+1(5); Ca+1(5); I+1(5); Sb+1(5); Sn+1(5); Sr+1(5); At+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5)...) structure #129.
Warning (Accepted unusual valence(s): C(1); C(2); B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); C(2); Cu(6); Zn(6); Cd(6); C(3); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); C(1); F(6); O(6); N(6); C(6); Li(6); Cl(6); P(6); Si(6); Al(6); Mg(6); Na(6); Br(6); As(6); Ge(6); Ga(6); Ca(6); K(6); I(6); Sb(6); Sn(6); In(6)) structure #131.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(6); C(1); O-1(6); N-1(6); C-1(6); S-1(6); Si-1(6); Al-1(6); Se-1(6); Ge-1(6); Ga-1(6); Te-1(6); Sn-1(6); In-1(6); Po-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(6); C(1); N-2(6); C-2(6); P-2(6); Si-2(6); Al-2(6); As-2(6); Ga-2(6); Sb-2(6); In-2(6); Bi-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(6); Be+1(6); C(1); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)) structure #134.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(6); C(1); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); C(2); Cu(6); Zn(7); Cd(7); C(3); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); C(1); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7)) structure #136.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(7); C(1); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(7); C(1); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(7); Be+1(7); C(1); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7)) structure #139.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(7); C(1); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); C(2); Cu(8); C(3); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8)) structure #141.
Warning (Accepted unusual valence(s): C(2); C(3); B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); C(1); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): C(2); C(3); B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); C(1); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): C(2); C(3); B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8)...) structure #144.
Warning (Accepted unusual valence(s): C(2); C(3); B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); C(1); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); O(1); N(1); C(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); N(2); C(2); Si(2); Ge(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); B(2); Fr(2); Ac(2); Rf(2); F(2); Cl(2); Br(2); I(2); At(2); Gd(2)...) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); O(1); N(1); C(1); Be(1); S(1); Si(1); Se(1); Mg(1); Ge(1); Ca(1); Te(1); Sn(1); Po(1); Sr(1); Pb(1); Ba(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1)) structure #148.
Warning (Accepted unusual valence(s): N-1(1); C-1(1); Si-1(1); Ge-1(1); Sn-1(1); Pb-1(1); B-1(1); Bi-1(1); Sb-1(1); As-1(1); P-1(1); Al-1(1); Ga-1(1); In-1(1); Tl-1(1); Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Accepted unusual valence(s): C-2(1); Si-2(1); Ge-2(1); Sn-2(1); Pb-2(1); B-2(1); Al-2(1); Ga-2(1); In-2(1); Tl-2(1); Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Accepted unusual valence(s): O+1(1); N+1(1); C+1(1); S+1(1); Si+1(1); Se+1(1); Ge+1(1); Te+1(1); Sn+1(1); Po+1(1); Pb+1(1); B+1(1); F+1(1); Cl+1(1); Br+1(1); I+1(1); At+1(1); Bi+1(1); Sb+1(1); As+1(1); P+1(1); Al+1(1); Metal was disconnected) structure #152.
Warning (Accepted unusual valence(s): O+2(1); N+2(1); C+2(1); S+2(1); Si+2(1); Se+2(1); Te+2(1); Po+2(1); F+2(1); Cl+2(1); Br+2(1); I+2(1); At+2(1); Bi+2(1); Sb+2(1); As+2(1); P+2(1); Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Proton(s) added/removed) structure #155.
Warning (Proton(s) added/removed) structure #158.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C,d(1); C(2)) structure #169.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(1); S(1); Se(1); Te(1); P(1); N-1(1); P-1(1); N+1(3); C(2); P+1(3)) structure #170.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); C(2); Te(1); N(1); S(1); Se(1); N-1(1); Metal was disconnected) structure #171.
Warning (Accepted unusual valence(s): C(2); C(3); C,d(1)) structure #172.
Warning (Accepted unusual valence(s): C(3)) structure #173.
Warning (Accepted unusual valence(s): C(3)) structure #174.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #175.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #176.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #177.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #178.
Warning (Accepted unusual valence(s): C(1)) structure #179.
Warning (Accepted unusual valence(s): C(1)) structure #180.
Warning (Accepted unusual valence(s): C(1)) structure #181.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #182.
Warning (Accepted unusual valence(s): C(1); N(2); C(2); Proton(s) added/removed) structure #186.
Warning (Accepted unusual valence(s): C(1); N(2); N(1); Proton(s) added/removed) structure #187.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(1); N(2); Proton(s) added/removed) structure #188.
Warning (Accepted unusual valence(s): O(1); C(2); C(3); C(1); Proton(s) added/removed) structure #189.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); S(1); O+1(1); Proton(s) added/removed) structure #190.
Warning (Accepted unusual valence(s): C(3); O(1); S(1)) structure #191.
Warning (Accepted unusual valence(s): C(3)) structure #192.
Warning (Accepted unusual valence(s): N(2); C(3); N(1)) structure #193.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #194.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #195.
Warning (Accepted unusual valence(s): N(2); C(1); C(3)) structure #196.
Warning (Accepted unusual valence(s): C(1); O(1); C(3); N(2)) structure #197.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1); Proton(s) added/removed) structure #198.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); N+1(3)) structure #199.
Warning (Accepted unusual valence(s): C(3)) structure #200.
Warning (Accepted unusual valence(s): N(1)) structure #202.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #203.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #204.
Warning (Accepted unusual valence(s): O(1); C(1); S(1); C(2)) structure #205.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #206.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #207.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #208.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #209.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #210.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #211.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #212.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #213.
Warning (Accepted unusual valence(s): O(1); C(1); S(1); C(2)) structure #214.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(1)) structure #215.
Warning (Accepted unusual valence(s): C(1); C,d(2); C(3); C(2)) structure #216.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(1)) structure #217.
Warning (Accepted unusual valence(s): C(2); C(3); C,d(2); C(1)) structure #218.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(1); C,d(2); C(2)) structure #219.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #220.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(2)) structure #221.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #222.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(2)) structure #223.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1); C,d(2)) structure #224.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #225.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #226.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #227.
Warning (Accepted unusual valence(s): O(1)) structure #228.
Warning (Accepted unusual valence(s): O(1)) structure #229.
Warning (Accepted unusual valence(s): O(1)) structure #230.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #231.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #232.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #233.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #234.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #235.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #236.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #237.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #238.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #239.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #240.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #241.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #242.
Warning (Accepted unusual valence(s): C(2); S(1)) structure #243.
Warning (Accepted unusual valence(s): O(1); C(3)) structure #244.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); C(1); O(1); N(2)) structure #245.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #246.
Warning (Accepted unusual valence(s): N+1(3); C(3); C(1); N-1(1)) structure #247.
Warning (Accepted unusual valence(s): N-1(1); N+1(2)) structure #248.
Warning (Accepted unusual valence(s): N-1(1); N+1(2)) structure #249.
Warning (Accepted unusual valence(s): P-1(1); As+1(2); As-1(1); P+1(2)) structure #250.
Warning (Accepted unusual valence(s): Sb-1(1); Cl-1(6); O+1(2); Metal was disconnected) structure #251.
Warning (Accepted unusual valence(s): V(6); Te+1(2); Se+1(2); Metal was disconnected) structure #252.
Warning (Accepted unusual valence(s): Si-1(1); V(6); Ge+1(2); Ge-1(1); Si+1(2); Metal was disconnected) structure #253.
Warning (Accepted unusual valence(s): C(1); C(3); O+1(2)) structure #254.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #255.
Warning (Accepted unusual valence(s): P-1(1); O+1(2); N+1(2)) structure #256.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(3); N-1(1); N+1(2); P-1(1); As+1(2); As-1(1); P+1(2); Sb-1(1); Cl-1(6); O+1(2); V(6); Te+1(2); Se+1(2); Si-1(1); Ge+1(2); Ge-1(1); Si+1(2); C(2); Metal was disconnected) structure #257.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4); C(2); Metal was disconnected) structure #259.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #260.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #261.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); C(1)) structure #262.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #264.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #265.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #266.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #267.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #268.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #269.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #270.
Warning (Accepted unusual valence(s): C(1)) structure #271.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #272.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #273.
Warning (Accepted unusual valence(s): C(1)) structure #274.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #275.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #276.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #277.
Warning (Accepted unusual valence(s): C(1)) structure #278.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #279.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #280.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); C(1)) structure #281.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #284.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #285.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #286.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #287.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #288.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #289.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #290.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #291.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #292.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #293.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #294.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #295.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #296.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #297.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #298.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #299.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #300.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #301.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #302.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #303.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #304.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #305.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #306.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #307.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #308.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #309.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #310.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #311.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #312.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #313.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #314.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #315.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); Metal was disconnected) structure #316.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #317.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #318.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #319.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #320.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #321.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #322.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #323.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #324.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #325.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #326.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #327.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #328.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #329.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); O(4); C(3); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1)) structure #332.
Warning (Accepted unusual valence(s): O(4); C(1)) structure #333.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #334.
Warning (Accepted unusual valence(s): C(1)) structure #335.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1); C(2)) structure #337.
Warning (Accepted unusual valence(s): O(4); C(2); C(1)) structure #338.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #339.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #340.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #341.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #342.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #343.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #344.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #345.
Warning (Accepted unusual valence(s): C(1)) structure #346.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #347.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #348.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #349.
Warning (Accepted unusual valence(s): C(1)) structure #350.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #351.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #352.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #353.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #354.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #355.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #356.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #357.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #358.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #359.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #360.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #361.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #362.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #363.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #364.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #365.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1)) structure #366.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1)) structure #367.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #368.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #369.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #370.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #371.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #372.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #373.
Warning (Accepted unusual valence(s): C-1(2); C+1(2); C(1); Metal was disconnected) structure #374.
Warning (Accepted unusual valence(s): C-1(1); C+1(1); C(1); Metal was disconnected) structure #375.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #376.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #377.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Metal was disconnected) structure #378.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #379.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #380.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #381.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #382.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #383.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #384.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #385.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #386.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #387.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #388.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #389.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(1); C(2); C-1(2); C+1(2); C(3); C-1(1); C+1(1); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2); C(1)) structure #392.
Warning (Accepted unusual valence(s): C(1)) structure #393.
Warning (Accepted unusual valence(s): C(1)) structure #394.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #395.
Warning (Accepted unusual valence(s): C(1)) structure #396.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #397.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #398.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #399.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #400.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #401.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #402.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(1); C(2); Metal was disconnected; Proton(s) added/removed) structure #404.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); C(1); C(3); Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); C(3); N(2); S(1)) structure #406.
Warning (Accepted unusual valence(s): C(3); C(1); Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); N(2); C(2); Metal was disconnected) structure #408.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); N(1); N-1(1); P-1(1)) structure #409.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); Metal was disconnected) structure #410.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1); P(1); N(1); N(2); P(2); As(2); N(4); As(4)) structure #411.
Warning (Accepted unusual valence(s): O(1); C(3); C(1); C(2); N(2); S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Accepted unusual valence(s): O(1); N(2); C(3); S(1); C(1); Metal was disconnected; Proton(s) added/removed) structure #413.
Warning (Accepted unusual valence(s): O(1); N(1); S(1); Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1); Metal was disconnected) structure #415.
Warning (Accepted unusual valence(s): S(8); O(1); N(2); C(3); Se(8); Te(8); Po(8); S(1); C(1); Metal was disconnected; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); O(1); N(1); Se(8); Te(8); Po(8); S(1); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); N(1); N(2); C(3); Se(8); Te(8); Po(8); C(1); Metal was disconnected) structure #418.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); O(1); S(1); Se(1); Te(1); C(1); P(2); N-1(1); Metal was disconnected) structure #419.
Warning (Accepted unusual valence(s): C(1)) structure #420.
Warning (Accepted unusual valence(s): C(1)) structure #421.
Warning (Accepted unusual valence(s): C(1); N(1)) structure #422.
Warning (Accepted unusual valence(s): C(1); N(2); O(1)) structure #423.
Warning (Accepted unusual valence(s): C(1); N(1); N(2); O(1)) structure #424.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #425.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #426.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #427.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #428.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #429.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #430.
Warning (Accepted unusual valence(s): C(1)) structure #431.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #432.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #433.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #434.
Warning (Accepted unusual valence(s): C(1)) structure #435.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #436.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #437.
Warning (Accepted unusual valence(s): C(1)) structure #438.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #439.
Warning (Accepted unusual valence(s): C(1)) structure #440.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #441.
Warning (Accepted unusual valence(s): C(1)) structure #442.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #443.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #444.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); N(2); Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); N(2); Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Accepted unusual valence(s): C(1)) structure #447.
Warning (Accepted unusual valence(s): C(1)) structure #448.
Warning (Accepted unusual valence(s): C(1)) structure #449.
Warning (Accepted unusual valence(s): C(1)) structure #450.
Warning (Accepted unusual valence(s): C(1)) structure #451.
Warning (Accepted unusual valence(s): C(1)) structure #452.
Warning (Accepted unusual valence(s): C(1)) structure #453.
Warning (Accepted unusual valence(s): C(1)) structure #454.
Warning (Accepted unusual valence(s): C(1)) structure #455.
Warning (Accepted unusual valence(s): C(1)) structure #456.
Warning (Accepted unusual valence(s): C(1)) structure #457.
Warning (Accepted unusual valence(s): C(1)) structure #458.
Warning (Accepted unusual valence(s): C(1)) structure #459.
Warning (Accepted unusual valence(s): C(1)) structure #460.
Warning (Accepted unusual valence(s): C(1)) structure #461.
Warning (Accepted unusual valence(s): C(1)) structure #462.
Warning (Accepted unusual valence(s): C(1)) structure #463.
Warning (Accepted unusual valence(s): C(1)) structure #464.
Warning (Accepted unusual valence(s): C(1)) structure #465.
Warning (Accepted unusual valence(s): C(1)) structure #466.
Warning (Accepted unusual valence(s): C(1)) structure #468.
Warning (Accepted unusual valence(s): C(1)) structure #469.
Warning (Accepted unusual valence(s): C(3)) structure #470.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #471.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #472.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #473.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #474.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #475.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #476.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #477.
Warning (Accepted unusual valence(s): C(1)) structure #478.
Warning (Accepted unusual valence(s): C(1)) structure #479.
Warning (Accepted unusual valence(s): C(1)) structure #480.
Warning (Accepted unusual valence(s): C(1)) structure #481.
Warning (Accepted unusual valence(s): C(1)) structure #482.
Warning (Accepted unusual valence(s): C(1)) structure #483.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #484.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #485.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #486.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #487.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #488.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #489.
Warning (Accepted unusual valence(s): C(1)) structure #490.
Warning (Accepted unusual valence(s): C(1)) structure #491.
Warning (Accepted unusual valence(s): C(1)) structure #492.
Warning (Accepted unusual valence(s): C(1)) structure #493.
Warning (Accepted unusual valence(s): C(1)) structure #494.
Warning (Accepted unusual valence(s): C(1)) structure #495.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #496.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #497.
Warning (Accepted unusual valence(s): C(1); C(3); N(1)) structure #498.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #499.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #500.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #501.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #502.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(1); C(2); C(1)) structure #503.
Warning (Accepted unusual valence(s): C(3); C(5); C,d(1)) structure #504.
Warning (Accepted unusual valence(s): C(3); N(2); C(2)) structure #505.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #506.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #507.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #508.
Warning (Accepted unusual valence(s): C(3); N(2); C(2)) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #511.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #512.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4)) structure #513.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #514.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #515.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #516.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #517.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #518.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #519.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #520.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #521.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #522.
Warning (Accepted unusual valence(s): C(3); C(1); Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #524.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #525.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); C(2)) structure #526.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #527.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #528.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); C(2); C(1)) structure #529.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #530.
Warning (Accepted unusual valence(s): C(1)) structure #532.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #533.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #534.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #535.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #536.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #538.
Warning (Accepted unusual valence(s): C(3); Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); C(3); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #543.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #544.
Warning (Accepted unusual valence(s): C(3); C,d(2)) structure #545.
Warning (Accepted unusual valence(s): C(1)) structure #546.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #547.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #548.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #549.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); C(2)) structure #550.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #551.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #552.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #553.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #554.
Warning (Accepted unusual valence(s): C(3)) structure #555.
Warning (Accepted unusual valence(s): C(3)) structure #556.
Warning (Accepted unusual valence(s): C(3)) structure #557.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #559.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #560.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #561.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #562.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #564.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #565.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #566.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #567.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #568.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #569.
Warning (Accepted unusual valence(s): C(3); C(2); Si(3)) structure #570.
Warning (Accepted unusual valence(s): C(3); C(2); Si(3)) structure #571.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #574.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #575.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #577.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #579.
Warning (Accepted unusual valence(s): N(1); C(1)) structure #580.
Warning (Accepted unusual valence(s): O(1); C(3); C(1); N(2); N(1)) structure #582.
Warning (Accepted unusual valence(s): O(1); C(3); C(2); C(1)) structure #583.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #584.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Accepted unusual valence(s): C(3); C(2); N(1)) structure #589.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #590.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1)) structure #591.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); C(1)) structure #592.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1)) structure #593.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1); Proton(s) added/removed) structure #594.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #595.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); O(1); C(1)) structure #596.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1)) structure #597.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1); O(1); Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Accepted unusual valence(s): C(3); N+1(2); C,d(1); N(1)) structure #600.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #601.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #602.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #603.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #604.
Warning (Accepted unusual valence(s): C(2); O(1)) structure #605.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #606.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1); Proton(s) added/removed) structure #607.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(1)) structure #608.
Warning (Accepted unusual valence(s): C(3); N(1); C(2); O(1)) structure #609.
Warning (Accepted unusual valence(s): C(3); N(1); N+1(1); C(2); Proton(s) added/removed) structure #610.
Warning (Accepted unusual valence(s): C(3); N+1(1); N(1); C(2); Proton(s) added/removed) structure #611.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1)) structure #612.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(1); Proton(s) added/removed) structure #613.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #614.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #615.
Warning (Accepted unusual valence(s): C(2); O(1)) structure #616.
Warning (Accepted unusual valence(s): C(2); O(1); C(1); C(3); N+1(1); N(1); Proton(s) added/removed) structure #617.
Warning (Accepted unusual valence(s): N+1(1); C(1); Proton(s) added/removed) structure #618.
Warning (Accepted unusual valence(s): N+1(1); Proton(s) added/removed) structure #619.
Warning (Accepted unusual valence(s): C(3); N+1(1); C(2); Proton(s) added/removed) structure #620.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #621.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(1); Proton(s) added/removed) structure #622.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #623.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #624.
Warning (Accepted unusual valence(s): N+1(1); C(3); N+1(3); N(2); Proton(s) added/removed) structure #625.
Warning (Accepted unusual valence(s): N+1(1); C(2); S(1); Proton(s) added/removed) structure #626.
Warning (Accepted unusual valence(s): N+1(1); C(2); Proton(s) added/removed) structure #627.
Warning (Accepted unusual valence(s): C(3); N+1(1); C(2); O(1); Proton(s) added/removed) structure #628.
Warning (Accepted unusual valence(s): N+1(1); C(2); N(2); N+1(2); N(1); Proton(s) added/removed) structure #629.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(3); C(1); Proton(s) added/removed) structure #630.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); C(1); Proton(s) added/removed) structure #631.
Warning (Accepted unusual valence(s): C(3); N+1(1); N(2); Proton(s) added/removed) structure #632.
Warning (Accepted unusual valence(s): N+1(2); C(2); Proton(s) added/removed) structure #633.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(1); Proton(s) added/removed) structure #634.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(1); O(1); Proton(s) added/removed) structure #635.
Warning (Accepted unusual valence(s): N+1(1); C(2); N(1); Proton(s) added/removed) structure #636.
Warning (Accepted unusual valence(s): C(2); N(1); N+1(1); Proton(s) added/removed) structure #637.
Warning (Accepted unusual valence(s): N+1(1); C(1); C(3); C(2); O(1); N+1(3); N(2); S(1); N+1(2); N(1); Proton(s) added/removed) structure #638.
Warning (Accepted unusual valence(s): C(1); C-1(2)) structure #639.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #640.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #641.
Warning (Accepted unusual valence(s): C(3)) structure #644.
Warning (Accepted unusual valence(s): C(3); C(1); C(2); N(1); S(1)) structure #645.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #646.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): C(3)) structure #648.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Accepted unusual valence(s): C(3)) structure #650.
Warning (Accepted unusual valence(s): C(3); Proton(s) added/removed) structure #651.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #652.
Warning (Accepted unusual valence(s): C(3)) structure #653.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #654.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #655.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #656.
Warning (Accepted unusual valence(s): C(2)) structure #657.
Warning (Accepted unusual valence(s): C(2)) structure #658.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #659.
Warning (Accepted unusual valence(s): C(1)) structure #660.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #661.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #662.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1)) structure #663.
Warning (Accepted unusual valence(s): C(1); O(1); C(3)) structure #664.
Warning (Accepted unusual valence(s): C(3)) structure #666.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #668.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #669.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #670.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #671.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(1)) structure #674.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C(5)) structure #675.
Warning (Accepted unusual valence(s): C(3)) structure #676.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #677.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1); N(2)) structure #678.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C(1); C+1(2)) structure #680.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Accepted unusual valence(s): C(3)) structure #683.
Warning (Accepted unusual valence(s): C(1)) structure #684.
Warning (Accepted unusual valence(s): C(3)) structure #685.
Warning (Accepted unusual valence(s): C(3)) structure #686.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); Proton(s) added/removed) structure #687.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); N(1)) structure #688.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N(1)) structure #689.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); N(2)) structure #690.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(3); O(1); N(2)) structure #691.
Warning (Accepted unusual valence(s): C(3); N+1(3); O(1); N(2)) structure #692.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); N+1(3)) structure #693.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); N(2)) structure #694.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); N+1(3)) structure #695.
Warning (Accepted unusual valence(s): C(3); C(2); N+1(3); N(2)) structure #696.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #697.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); C(3); O(1)) structure #698.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); C(3); O(1)) structure #699.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N+1(2)) structure #700.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); N+1(2)) structure #701.
Warning (Accepted unusual valence(s): N+1(3); C(3); O(1); N(1)) structure #702.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(2); N(1)) structure #703.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); N(1)) structure #704.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(3); O(1)) structure #705.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N+1(2); N+1(3); N(1)) structure #706.
Warning (Accepted unusual valence(s): C(2)) structure #708.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); N(2); O(1); N+1(3)) structure #711.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1)) structure #712.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #713.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #714.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #715.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #716.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #717.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #718.
Warning (Accepted unusual valence(s): C(3); N+1(2); N(1)) structure #719.
Warning (Accepted unusual valence(s): C(3); N(1); N+1(2)) structure #720.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #721.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #722.
Warning (Accepted unusual valence(s): C(3); C(2); N(1)) structure #723.
Warning (Accepted unusual valence(s): C(2); C(3); N(1)) structure #724.
Warning (Accepted unusual valence(s): C(3); N+1(2); N(1); C(2)) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); C(2); C(3); C(1); O(1); N(1); N(2); Metal was disconnected) structure #731.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #732.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #733.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(3); S(1); C(1)) structure #735.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); C(1)) structure #736.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #737.
Warning (Accepted unusual valence(s): C(5); C(3); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): C(3); B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Accepted unusual valence(s): O(1); Metal was disconnected) structure #740.
Warning (Accepted unusual valence(s): C(3); N(2); C(2)) structure #741.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #742.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #743.
Warning (Accepted unusual valence(s): N(2); C(3); S(5)) structure #744.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2); N-1(1)) structure #745.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2); N-1(1)) structure #746.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #747.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #748.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1)) structure #749.
Warning (Accepted unusual valence(s): O(1); C(3); C(5); N(2)) structure #750.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O(1)) structure #751.
Warning (Accepted unusual valence(s): O(1); C(3); C(5); N(2)) structure #752.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); N(1); O(1)) structure #753.
Warning (Accepted unusual valence(s): C(3)) structure #754.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #755.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #756.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #757.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #758.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #759.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #760.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(1); Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C(2)) structure #768.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #770.
Warning (Accepted unusual valence(s): C(1); C-1(4); C(3); N-1(3); N(4)) structure #771.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #772.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #776.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #777.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #778.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #779.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #780.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #781.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #782.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #783.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #784.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #785.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #786.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #787.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #788.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #789.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #790.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #791.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #792.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #793.
Warning (Accepted unusual valence(s): C(1)) structure #794.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #795.
Warning (Accepted unusual valence(s): C(1); N(4); O(1)) structure #796.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #797.
Warning (Accepted unusual valence(s): C(1); O(1); N(4)) structure #798.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #799.
Warning (Accepted unusual valence(s): O(1); C(2); C(3)) structure #800.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1)) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Accepted unusual valence(s): C,d(1)) structure #811.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(1); N(2); N+1(2)) structure #812.
Warning (Accepted unusual valence(s): N(2); C(3); N+1(2); O(1); N+1(3); N(1)) structure #813.
Warning (Accepted unusual valence(s): C(3); N+1(3); N(1); N(2); N+1(2)) structure #814.
Warning (Accepted unusual valence(s): O(1); C(3); N+1(2); Proton(s) added/removed) structure #815.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #816.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #817.
Warning (Accepted unusual valence(s): C(3); N+1(2); O(1); Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): C(2)) structure #821.
Warning (Accepted unusual valence(s): C(2)) structure #824.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #825.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #826.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Accepted unusual valence(s): C(1)) structure #828.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1)) structure #829.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1); Proton(s) added/removed) structure #830.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #831.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); O(1); C(1)) structure #832.
Warning (Accepted unusual valence(s): C(2); N(2); C(3); C(1)) structure #833.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2)) structure #834.
Warning (Accepted unusual valence(s): C(2); C(3); N(2); C(1); O(1); Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(3); C(2); C(5); C(1)) structure #837.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3)) structure #839.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); C(2)) structure #840.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3); C(2)) structure #841.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N+1(3)) structure #842.
Warning (Accepted unusual valence(s): C(3); N+1(3); N(2); C(1); N+1(2); N(1)) structure #843.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #845.
Warning (Accepted unusual valence(s): C(1); N+1(2); N(1); Proton(s) added/removed) structure #846.
Warning (Accepted unusual valence(s): C(1); N(1); N(2); N+1(2); N+1(3)) structure #847.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #849.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #853.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #854.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #855.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); C(5)) structure #856.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); O(3)) structure #857.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1)) structure #858.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #860.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #861.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #862.
Warning (Accepted unusual valence(s): C(3); S(3); N(2)) structure #863.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); S(3)) structure #864.
Warning (Accepted unusual valence(s): N(1); C(3)) structure #865.
Warning (Accepted unusual valence(s): N(1); C(3)) structure #866.
Warning (Accepted unusual valence(s): S(3); C(3); C(1); N(2)) structure #867.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #868.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #869.
Warning (Accepted unusual valence(s): N(1); C(3); S(3); C(1); N(2)) structure #870.
Warning (Accepted unusual valence(s): C(1); N+1(3); C(3)) structure #871.
Warning (Accepted unusual valence(s): C(1); N+1(3); C(3)) structure #872.
Warning (Accepted unusual valence(s): N(2); C(3); N(1); Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); C(1); C(2); C(3); Metal was disconnected; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #875.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #876.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #878.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #879.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #881.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #882.
Warning (Accepted unusual valence(s): C+1(1); C(3); N(2); C(1); S(1)) structure #883.
Warning (Accepted unusual valence(s): C(2); N(1); N(2)) structure #884.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #885.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #886.
Warning (Accepted unusual valence(s): C(3); C(1); C,d(1); O(1)) structure #887.
Warning (Accepted unusual valence(s): N(2); O(1); C(2)) structure #888.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #889.
Warning (Accepted unusual valence(s): C(3)) structure #890.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #891.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #892.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #893.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #894.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #895.
Warning (Accepted unusual valence(s): C-1(1); C(3); N(2); C(1); S(1)) structure #896.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #897.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #898.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #899.
Warning (Accepted unusual valence(s): C-1(1); N(2); C(3); C(1); S(1); Metal was disconnected) structure #900.
Warning (Accepted unusual valence(s): C-1(1); N(2); C(3); C(1); S(1); Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #909.
Warning (Accepted unusual valence(s): C,d(2)) structure #911.
Warning (Accepted unusual valence(s): C,d(2); C-1(2)) structure #912.
Warning (Accepted unusual valence(s): C(3); C(2); Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): C(3); Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): C(3); Fe(10); C(1); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): N(2); C(3); C(2); C(1)) structure #917.
Warning (Accepted unusual valence(s): N(2); C(3); C(2); C(1)) structure #918.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #919.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #920.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2)) structure #921.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #922.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #923.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #924.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); N(2); O(1)) structure #925.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #926.
Warning (Accepted unusual valence(s): O(1); C(3)) structure #927.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #928.
Warning (Accepted unusual valence(s): O(1); C(3); N(2)) structure #929.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #930.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #931.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(2)) structure #932.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #933.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #934.
Warning (Accepted unusual valence(s): C(1); N(2); O(1)) structure #935.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #936.
Warning (Accepted unusual valence(s): C(1); N(2); C(3); O(1)) structure #937.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #938.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #939.
Warning (Accepted unusual valence(s): C(1); O(1); N(2); C(3)) structure #940.
Warning (Accepted unusual valence(s): S(7); C(2); N(2); C(1); N(4); O(1)) structure #941.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3)) structure #942.
Warning (Accepted unusual valence(s): N(2); C(2); S(1); C(3)) structure #943.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3)) structure #944.
Warning (Accepted unusual valence(s): N(2); O(1); C(2); S(1); C(3)) structure #945.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #946.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #947.
Warning (Accepted unusual valence(s): C(1); N(2); O(1)) structure #948.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #949.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #950.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #951.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #952.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #953.
Warning (Accepted unusual valence(s): N(1); N(2); C(3); C(1)) structure #954.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #955.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #956.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #957.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #958.
Warning (Accepted unusual valence(s): C(1); O(1); C(2)) structure #959.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(1)) structure #960.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); O(1); Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): N(2); N(1); C(3)) structure #962.
Warning (Accepted unusual valence(s): N(2); N(1); C(3)) structure #963.
Warning (Accepted unusual valence(s): C(1); C(2); B(4); H(2)) structure #965.
Warning (Accepted unusual valence(s): O(1)) structure #968.
Warning (Accepted unusual valence(s): C(2); N(2); C(1); O(1); C(3); Proton(s) added/removed) structure #971.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(2)) structure #972.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); N(2)) structure #973.
Warning (Accepted unusual valence(s): C(1); N(2); N(1); O(1)) structure #974.
Warning (Accepted unusual valence(s): C(1); N(2); N(1)) structure #975.
Warning (Accepted unusual valence(s): N(2); N(1); C(3); C(1)) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(2); O(1); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Accepted unusual valence(s): O(1)) structure #982.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1)) structure #983.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); Proton(s) added/removed) structure #984.
Warning (Accepted unusual valence(s): I(2)) structure #985.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #986.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #987.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #988.
Warning (Charges were rearranged) structure #989.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #990.
Warning (Accepted unusual valence(s): C(2); C(3); N+1(1); P+1(1); Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #996.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #997.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #998.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #999.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1000.
Warning (Accepted unusual valence(s): C(2); N(1)) structure #1002.
Warning (Accepted unusual valence(s): C(2); N(1)) structure #1003.
Warning (Accepted unusual valence(s): C(2); N(1)) structure #1004.
Warning (Accepted unusual valence(s): C(1)) structure #1005.
Warning (Accepted unusual valence(s): C(1)) structure #1006.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1007.
Warning (Accepted unusual valence(s): O(1); N(2); C(3)) structure #1008.
Warning (Accepted unusual valence(s): O(1)) structure #1009.
Warning (Accepted unusual valence(s): O(1); C(2); C(3); N(1)) structure #1010.
Warning (Accepted unusual valence(s): C(3); Ni(7); Metal was disconnected) structure #1011.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #1012.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1014.
Warning (Accepted unusual valence(s): C(3); C(1); O(1); N(2)) structure #1015.
Warning (Accepted unusual valence(s): N(4); C(3); N(2); C(1); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1087.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1088.
Warning (Accepted unusual valence(s): C(3); N-1(1)) structure #1089.
Warning (Accepted unusual valence(s): C(3); N(2); N-1(1); Proton(s) added/removed) structure #1090.
Warning (Accepted unusual valence(s): N(2); O(1)) structure #1091.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1092.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1093.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1094.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1095.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #1096.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #1097.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1098.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); C(1)) structure #1099.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); O(1)) structure #1100.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1101.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1102.
Warning (Accepted unusual valence(s): C(3); N(2); Proton(s) added/removed) structure #1103.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1104.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); C(1)) structure #1105.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1106.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1107.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1108.
Warning (Accepted unusual valence(s): N(4); C(3); C(1); Metal was disconnected) structure #1109.
Warning (Accepted unusual valence(s): N(1)) structure #1110.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #1111.
Warning (Accepted unusual valence(s): C(3)) structure #1112.
Warning (Accepted unusual valence(s): H(2); C(3); C(2)) structure #1114.
Warning (Accepted unusual valence(s): P+1(2); N(1); C(3); P(1); N+1(2); C(1)) structure #1115.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1116.
Warning (Accepted unusual valence(s): C(2); N(1); O(1); Proton(s) added/removed) structure #1117.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1118.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Accepted unusual valence(s): C(2); N(1); O(1); Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): C(3); Fe(10); O(1); Ni(10); Metal was disconnected) structure #1122.
Warning (Accepted unusual valence(s): C(3); O(1); C(2); C(1)) structure #1123.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1124.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1125.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1126.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); C(2)) structure #1127.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2)) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #1130.
Warning (Accepted unusual valence(s): C(2); O(1); Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1133.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1134.
Warning (Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1135.
Warning (Accepted unusual valence(s): C(3)) structure #1136.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); N(1); C(1)) structure #1137.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1159.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); O(1)) structure #1160.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1161.
Warning (Accepted unusual valence(s): N+1(3); N+1(1); C(3); C(2)) structure #1162.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); Proton(s) added/removed) structure #1163.
Warning (Accepted unusual valence(s): N+1(1); C(3); C(2); Proton(s) added/removed) structure #1164.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1165.
Warning (Accepted unusual valence(s): C(2); C(1); Metal was disconnected) structure #1166.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1167.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1168.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1169.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1170.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1171.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1172.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1173.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1174.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1175.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1176.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1177.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1178.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1179.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2)) structure #1180.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1181.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1182.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1183.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1184.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1185.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1186.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1187.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1188.
Warning (Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1189.
Warning (Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1190.
Warning (Accepted unusual valence(s): N+1(1); C(2); C(1)) structure #1191.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1192.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1); Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); N+1(1); Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1196.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1197.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1198.
Warning (Accepted unusual valence(s): C(3); N(1); C(1); O(1)) structure #1199.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1200.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1201.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1202.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1203.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1204.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1205.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1206.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1207.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1208.
Warning (Accepted unusual valence(s): N(2)) structure #1209.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1210.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1211.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2)) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1216.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); C(3)) structure #1217.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1218.
Warning (Accepted unusual valence(s): Se(1); C(1); S(1)) structure #1219.
Warning (Proton(s) added/removed) structure #1220.
Warning (Accepted unusual valence(s): C(2); O+1(2); C(1)) structure #1221.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1222.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1227.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1228.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1229.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1230.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1231.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1232.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1233.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1234.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1235.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1236.
Warning (Accepted unusual valence(s): C(1); N-1(4)) structure #1237.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Metal was disconnected) structure #1238.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); Proton(s) added/removed) structure #1239.
Warning (Accepted unusual valence(s): N(2); C+1(2); O(1)) structure #1240.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1241.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1242.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #1244.
Warning (Accepted unusual valence(s): C(1); C(3); P(1); N(1)) structure #1245.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Accepted unusual valence(s): P(4)) structure #1249.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1)) structure #1256.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1)) structure #1257.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); C(1); C(2); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): O(1); C(1); C(2); C(3)) structure #1264.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); N(2); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(2); N(2)) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(1); N(1)) structure #1281.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1284.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1285.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1286.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1287.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1288.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); N(2); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); C(3); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(3)) structure #1296.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1298.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1299.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1300.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1301.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1302.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1303.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1304.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1305.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1306.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Accepted unusual valence(s): N(2); C(1); C(2)) structure #1313.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); C(3); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Sb(4); Mo(9); C(3); Metal was disconnected) structure #1322.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected) structure #1323.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): C(2); C(1); Rh(9); C(3); Metal was disconnected) structure #1329.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Accepted unusual valence(s): P(4)) structure #1334.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Accepted unusual valence(s): C(2)) structure #1339.
Warning (Metal was disconnected) structure #1340.
Warning (Accepted unusual valence(s): O(1); C(3); Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #1343.
Warning (Accepted unusual valence(s): N(2); C(1); C(3); O(1)) structure #1344.
Warning (Accepted unusual valence(s): N(2); C(1); C(3); Proton(s) added/removed) structure #1345.
Warning (Accepted unusual valence(s): I(2); C(3)) structure #1347.
Warning (Charges were rearranged) structure #1348.
Warning (Accepted unusual valence(s): C(3); C(1); O(1)) structure #1350.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1351.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): P(4)) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(1)) structure #1356.
Warning (Accepted unusual valence(s): O(1); N(2)) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); N(2); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #1366.
Warning (Accepted unusual valence(s): P(4)) structure #1367.
Warning (Accepted unusual valence(s): O(1); Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1377.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); O(1); C(2); C(1); N(2)) structure #1380.
Warning (Accepted unusual valence(s): C(3); O(1); C(1); N(1)) structure #1382.
Warning (Accepted unusual valence(s): C(3); N-1(1)) structure #1385.
Warning (Accepted unusual valence(s): N(2); C(3); C(1); O(1)) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Accepted unusual valence(s): N(1); C(3); C(1); C(2); N(2)) structure #1391.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Accepted unusual valence(s): N(1); N+1(3); N(2); Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Accepted unusual valence(s): C(3); N(2); C(1)) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C(3); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Accepted unusual valence(s): C(3); N(2); C(2); C(1); O(1); N(1); Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1404.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C(3); O(1); C(2)) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); O(1)) structure #1419.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1421.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1422.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1423.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1424.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1425.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1426.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1427.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1428.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1429.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1430.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1432.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): N(1); C(2); N(2); O(1)) structure #1436.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); C(1)) structure #1437.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); N(2); C(1)) structure #1438.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1439.
Warning (Accepted unusual valence(s): C(5); Fe(10); C(3); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); C(2); C(3); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1447.
Warning (Accepted unusual valence(s): C(3); C(2); O(1); C(1)) structure #1448.
Warning (Accepted unusual valence(s): C(2); O(1); C(3); C(1)) structure #1449.
Warning (Accepted unusual valence(s): C(2); O(1); C(3)) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2)) structure #1455.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); Proton(s) added/removed) structure #1456.
Warning (Accepted unusual valence(s): C(1); Metal was disconnected) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); S+1(1); C(3); Metal was disconnected) structure #1463.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2)) structure #1464.
Warning (Accepted unusual valence(s): O(1); C(3); C(2)) structure #1465.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(1); C(3)) structure #1466.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): C(1)) structure #1468.
Warning (Accepted unusual valence(s): O(1); C(1); N(1); N(2)) structure #1469.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1470.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); C,d(1)) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); C(1); Metal was disconnected) structure #1473.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1474.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(2); N(1)) structure #1476.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1477.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1478.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1479.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1480.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1481.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3)) structure #1482.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); O(1)) structure #1483.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #1485.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #1487.
Warning (Accepted unusual valence(s): C(1); C(2); Metal was disconnected) structure #1488.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(1)) structure #1489.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #1490.
Warning (Accepted unusual valence(s): N(1); C(3); N(2); O(1)) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Accepted unusual valence(s): C(3); Metal was disconnected) structure #1494.
Warning (Accepted unusual valence(s): C(3); C+1(1); Proton(s) added/removed) structure #1495.
Warning (Accepted unusual valence(s): C(3); C-1(1)) structure #1496.
Warning (Accepted unusual valence(s): C(3); C+1(1); C-1(1); Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1501.
Warning (Charges neutralized) structure #1503.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1508.
Warning (Accepted unusual valence(s): C(3)) structure #1509.
Warning (Accepted unusual valence(s): O(1)) structure #1510.
Warning (Accepted unusual valence(s): N(2); C(1); Proton(s) added/removed) structure #1511.
Warning (Accepted unusual valence(s): N-1(1); C(1)) structure #1512.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1514.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1515.
Warning (Accepted unusual valence(s): C(3)) structure #1516.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1519.
Warning (Accepted unusual valence(s): C(3)) structure #1520.
Warning (Accepted unusual valence(s): C(3)) structure #1521.
Warning (Accepted unusual valence(s): C(3)) structure #1522.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1523.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1524.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1525.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1526.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1527.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1528.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1529.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1530.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); N(2); C(1)) structure #1531.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1532.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1533.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1534.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1535.
Warning (Accepted unusual valence(s): C(3); S(1)) structure #1537.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1538.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1539.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1540.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1541.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1)) structure #1542.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1543.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1544.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N(1)) structure #1545.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1546.
Warning (Accepted unusual valence(s): C(3); N(1); N(2)) structure #1547.
Warning (Accepted unusual valence(s): C(1)) structure #1548.
Warning (Accepted unusual valence(s): C(1); S(1)) structure #1549.
Warning (Accepted unusual valence(s): N(1)) structure #1550.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1551.
Warning (Accepted unusual valence(s): C(3); S(1); N(1)) structure #1552.
Warning (Accepted unusual valence(s): S(1); N(1)) structure #1553.
Warning (Accepted unusual valence(s): S(1); C(1)) structure #1554.
Warning (Accepted unusual valence(s): N(1)) structure #1555.
Warning (Accepted unusual valence(s): C(3)) structure #1556.
Warning (Accepted unusual valence(s): C(3)) structure #1557.
Warning (Accepted unusual valence(s): C(3)) structure #1558.
Warning (Accepted unusual valence(s): C(3)) structure #1559.
Warning (Accepted unusual valence(s): C(3)) structure #1560.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1561.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1562.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1563.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #1564.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1565.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1566.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1567.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1568.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1569.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1570.
Warning (Accepted unusual valence(s): C(3); C(5); C,d(1); C(1); Proton(s) added/removed) structure #1571.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1572.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1)) structure #1573.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1); C(2); Proton(s) added/removed) structure #1574.
Warning (Accepted unusual valence(s): C(3); C,d(1); C(1); Proton(s) added/removed) structure #1575.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(2); O(1)) structure #1576.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1577.
Warning (Accepted unusual valence(s): C(1); C,d(2)) structure #1578.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1579.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1580.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1581.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1582.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1583.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1584.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1585.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1586.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1587.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #1588.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C(1)) structure #1589.
Warning (Accepted unusual valence(s): C(3); N+1(1)) structure #1590.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1591.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2)) structure #1592.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2); Proton(s) added/removed) structure #1593.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N(2); Proton(s) added/removed) structure #1594.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1595.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N+1(1)) structure #1596.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1597.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1598.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1599.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1600.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1601.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1602.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1603.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1604.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1605.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1606.
Warning (Accepted unusual valence(s): N+1(1); C(2); O(1); Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2); C(2); C(1); S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); N(2); C(2); C(1); Proton(s) added/removed) structure #1609.
Warning (Accepted unusual valence(s): O(1); N(2)) structure #1610.
Warning (Accepted unusual valence(s): C-1(2); C(3)) structure #1611.
Warning (Accepted unusual valence(s): C(3)) structure #1612.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1613.
Warning (Accepted unusual valence(s): N(2); N(1); C(1)) structure #1614.
Warning (Accepted unusual valence(s): N(1); N(2); S(8); C(1)) structure #1615.
Warning (Accepted unusual valence(s): C(3); N-1,t(2)) structure #1616.
Warning (Accepted unusual valence(s): C(3)) structure #1617.
Warning (Accepted unusual valence(s): C(2); C(3); O(1)) structure #1618.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1619.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1620.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1621.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1622.
Warning (Accepted unusual valence(s): C(1); C(3); Metal was disconnected) structure #1623.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); C(1); Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Accepted unusual valence(s): O(1); C(2); Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1632.
Warning (Accepted unusual valence(s): C(3)) structure #1633.
Warning (Accepted unusual valence(s): C(1); S(1); Proton(s) added/removed) structure #1634.
Warning (Accepted unusual valence(s): C(1)) structure #1635.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1636.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #1637.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1638.
Warning (Accepted unusual valence(s): C(3); O(1); S(1)) structure #1639.
Warning (Accepted unusual valence(s): O(1); S(1)) structure #1640.
Warning (Accepted unusual valence(s): O(1); S(1)) structure #1641.
Warning (Accepted unusual valence(s): C(3); O(1); S(1)) structure #1642.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1644.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1645.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1646.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1647.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1648.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1649.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1650.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1651.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1652.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1653.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1654.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1655.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1656.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1657.
Warning (Accepted unusual valence(s): N(1); C(1); S(1)) structure #1658.
Warning (Accepted unusual valence(s): C(1); N(1); C(2)) structure #1659.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1660.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1661.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1662.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1663.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1664.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1665.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1666.
Warning (Accepted unusual valence(s): C(1); C(3); Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N(1); C(1)) structure #1668.
Warning (Accepted unusual valence(s): C(1); N+1(2); C(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1670.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1671.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1672.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1673.
Warning (Accepted unusual valence(s): N(2); C(2)) structure #1674.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1675.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1676.
Warning (Accepted unusual valence(s): C(2); La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): C(2); La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): C(2)) structure #1679.
Warning (Accepted unusual valence(s): C(2)) structure #1680.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1681.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1682.
Warning (Accepted unusual valence(s): C(2); N(2)) structure #1683.
Warning (Accepted unusual valence(s): C(2)) structure #1684.
Warning (Accepted unusual valence(s): N(2); C(2); C(1); La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1686.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1688.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1689.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1690.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1691.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1692.
Warning (Accepted unusual valence(s): C(2); N(1); C(1)) structure #1693.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1694.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1695.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1696.
Warning (Accepted unusual valence(s): N(1); C(1); C(2)) structure #1697.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); C(3)) structure #1698.
Warning (Accepted unusual valence(s): N(1); C(1); C(2); La(4); C(3); Metal was disconnected) structure #1699.
Warning (Accepted unusual valence(s): C(2); C(1); C(3); Metal was disconnected) structure #1700.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1701.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1702.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1703.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1704.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1705.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1706.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1707.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1708.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1709.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1710.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1711.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1712.
Warning (Accepted unusual valence(s): C(2); C(1); C(3)) structure #1714.
Warning (Accepted unusual valence(s): C(2)) structure #1715.
Warning (Accepted unusual valence(s): C(1)) structure #1716.
Warning (Accepted unusual valence(s): C(1)) structure #1717.
Warning (Accepted unusual valence(s): C(1)) structure #1718.
Warning (Accepted unusual valence(s): C(1)) structure #1719.
Warning (Accepted unusual valence(s): C(1)) structure #1720.
Warning (Accepted unusual valence(s): C(1)) structure #1721.
Warning (Accepted unusual valence(s): C(1)) structure #1722.
Warning (Accepted unusual valence(s): C(1)) structure #1723.
Warning (Accepted unusual valence(s): C(1)) structure #1724.
Warning (Accepted unusual valence(s): C(1)) structure #1725.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C,t(1); N+2(1)) structure #1726.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); C-1(1); Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1728.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1729.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1730.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1731.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1732.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1733.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1734.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1735.
Warning (Accepted unusual valence(s): N(2); C(1)) structure #1736.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1737.
Warning (Accepted unusual valence(s): C(1); N(2)) structure #1738.
Warning (Accepted unusual valence(s): C(3)) structure #1739.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1740.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1741.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1742.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1743.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #1744.
Warning (Accepted unusual valence(s): O(1); C(3); N(1); N(2)) structure #1745.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1746.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1747.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1748.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1749.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1750.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1751.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1752.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1753.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1754.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1755.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1756.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1757.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1758.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1759.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1760.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1761.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1762.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1763.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1764.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1765.
Warning (Accepted unusual valence(s): C(2)) structure #1766.
Warning (Accepted unusual valence(s): C(2)) structure #1767.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #1768.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1769.
Warning (Accepted unusual valence(s): Si(3); C(1)) structure #1770.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1771.
Warning (Accepted unusual valence(s): C(1); O(1); N(2); C(3)) structure #1772.
Warning (Accepted unusual valence(s): C(3); C(1); N(2)) structure #1773.
Warning (Accepted unusual valence(s): C(1); N(1)) structure #1774.
Warning (Accepted unusual valence(s): C(1); C(3); N(1); N+1(2); N(2); N+1(1); N+1(3)) structure #1775.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1779.
Warning (Accepted unusual valence(s): C(1)) structure #1780.
Warning (Accepted unusual valence(s): C(1); C(3); Proton(s) added/removed) structure #1781.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1782.
Warning (Accepted unusual valence(s): C(2); Proton(s) added/removed) structure #1783.
Warning (Accepted unusual valence(s): C(2); N+1(3); Proton(s) added/removed) structure #1784.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); N+1(3); Proton(s) added/removed) structure #1785.
Warning (Accepted unusual valence(s): C(3); O(1); N(1)) structure #1786.
Warning (Accepted unusual valence(s): C(3); O(1); N(1)) structure #1787.
Warning (Accepted unusual valence(s): C(3); N+1(1)) structure #1788.
Warning (Accepted unusual valence(s): C(3); N+1(1)) structure #1789.
Warning (Accepted unusual valence(s): C(3); O(1); N(1); N+1(1)) structure #1790.
Warning (Accepted unusual valence(s): C(3)) structure #1791.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(3); N(2)) structure #1794.
Warning (Accepted unusual valence(s): C(1); C(3); N(1)) structure #1795.
Warning (Accepted unusual valence(s): C(3)) structure #1796.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(3); C(1); N(2); C(2)) structure #1797.
Warning (Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1798.
Warning (Accepted unusual valence(s): C(1); C(3); N(1)) structure #1799.
Warning (Accepted unusual valence(s): C(3)) structure #1800.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #1801.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #1802.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1803.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1804.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1805.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1806.
Warning (Accepted unusual valence(s): C(1); C(3); N(1); N(2)) structure #1807.
Warning (Accepted unusual valence(s): N(2); C(3); N(1)) structure #1808.
Warning (Accepted unusual valence(s): N(1); N+1(1)) structure #1809.
Warning (Accepted unusual valence(s): C(1)) structure #1810.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1811.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); Proton(s) added/removed) structure #1819.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); O(1)) structure #1820.
Warning (Accepted unusual valence(s): C(3)) structure #1821.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1823.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1825.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #1826.
Warning (Accepted unusual valence(s): O(1); Metal was disconnected) structure #1827.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1828.
Warning (Accepted unusual valence(s): C(3); N(2); O(1)) structure #1829.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1830.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1831.
Warning (Accepted unusual valence(s): C(3); N(2); O(1); P(2); C(5)) structure #1832.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1833.
Warning (Accepted unusual valence(s): C,d(2); C(3)) structure #1834.
Warning (Accepted unusual valence(s): N+1(5); C(1); C,d(1); C(3); N,d(3)) structure #1835.
Warning (Accepted unusual valence(s): N(2); C(3); C(1)) structure #1836.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1837.
Warning (Accepted unusual valence(s): C(2); N(2); N(1); C(1)) structure #1838.
Warning (Accepted unusual valence(s): C(1); O+1(2); C(2); N-1(1)) structure #1839.
Warning (Accepted unusual valence(s): C(3); C(5); N(2); C(1)) structure #1840.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1841.
Warning (Charges were rearranged; Accepted unusual valence(s): N-1(1); N(2)) structure #1842.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1843.
Warning (Accepted unusual valence(s): N(1); N(2); C(2); O(1)) structure #1844.
Warning (Accepted unusual valence(s): N(1); C(3); O(1)) structure #1845.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #1846.
Warning (Accepted unusual valence(s): C(3); O(1); N-1(1)) structure #1847.
Warning (Accepted unusual valence(s): N(1); O(1)) structure #1848.
Warning (Accepted unusual valence(s): N-1(1); C(3); O(1)) structure #1849.
Warning (Accepted unusual valence(s): N(2); C(3); O(1)) structure #1850.
Warning (Accepted unusual valence(s): N-1(1); C(3)) structure #1851.
Warning (Accepted unusual valence(s): C(3)) structure #1852.
Warning (Accepted unusual valence(s): C(3); N(1); O(1)) structure #1853.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1854.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1855.
Warning (Accepted unusual valence(s): C(3); N(1); C,d(1); N+1(2)) structure #1856.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1)) structure #1857.
Warning (Accepted unusual valence(s): C(3); C,t(1); C,d(1)) structure #1858.
Warning (Accepted unusual valence(s): C(3); S(1)) structure #1860.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1861.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1862.
Warning (Accepted unusual valence(s): C(3); O(1); C(1)) structure #1863.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #1864.
Warning (Accepted unusual valence(s): C(3); C,d(2)) structure #1865.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1866.
Warning (Accepted unusual valence(s): C(3); C(2); C(1); N(1)) structure #1867.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1868.
Warning (Accepted unusual valence(s): C(3); C(2); O(1)) structure #1869.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); N(1)) structure #1870.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1871.
Warning (Accepted unusual valence(s): C(3); N(1); N(2)) structure #1872.
Warning (Accepted unusual valence(s): C(1)) structure #1873.
Warning (Accepted unusual valence(s): C(1); S(1)) structure #1874.
Warning (Accepted unusual valence(s): N(1)) structure #1875.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1876.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): O(1); C(3); C(1)) structure #1878.
Warning (Accepted unusual valence(s): C(3); O(1); N(2); C(2)) structure #1879.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1880.
Warning (Accepted unusual valence(s): C(3); S(1); N(1)) structure #1881.
Warning (Accepted unusual valence(s): S(1); N(1)) structure #1882.
Warning (Accepted unusual valence(s): S(1); C(1)) structure #1883.
Warning (Accepted unusual valence(s): N(1)) structure #1884.
Warning (Accepted unusual valence(s): C(3)) structure #1885.
Warning (Accepted unusual valence(s): C(3)) structure #1886.
Warning (Accepted unusual valence(s): C(3)) structure #1887.
Warning (Accepted unusual valence(s): C(3)) structure #1888.
Warning (Accepted unusual valence(s): C(3)) structure #1889.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1890.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1891.
Warning (Accepted unusual valence(s): N(4); C(10); C,d(1)) structure #1892.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1893.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #1894.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1895.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1896.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1897.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1898.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1899.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1900.
Warning (Accepted unusual valence(s): C(3); N,d(3); C(1); C,d(1)) structure #1901.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1902.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1903.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1904.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1905.
Warning (Accepted unusual valence(s): S(5); C(3); C,t(1)) structure #1906.
Warning (Accepted unusual valence(s): S(5); C(3)) structure #1907.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1908.
Warning (Accepted unusual valence(s): C,d(1); C(3)) structure #1909.
Warning (Accepted unusual valence(s): C,d(1); C(3); C(2); C(1)) structure #1910.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1911.
Warning (Accepted unusual valence(s): N+1(5); C(3); C(2); N,d(3); C(1); C,d(1)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5); C(3); C(2); C(1)) structure #1913.
Warning (Accepted unusual valence(s): C(3); N(1)) structure #1914.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1915.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #1916.
Warning (Accepted unusual valence(s): N(2); C(3); O(1); N(1)) structure #1917.
Warning (Accepted unusual valence(s): N(2); C(3); N(1); C(1); Proton(s) added/removed) structure #1918.
Warning (Accepted unusual valence(s): N+1(3); N(2); C(1); Proton(s) added/removed) structure #1919.
Warning (Accepted unusual valence(s): N+1(3); C(3); N(1)) structure #1920.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1); C(2); Proton(s) added/removed) structure #1921.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1922.
Warning (Accepted unusual valence(s): C(1); O(1); N(2)) structure #1923.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1924.
Warning (Accepted unusual valence(s): C(3); C(1); Proton(s) added/removed) structure #1925.
Warning (Accepted unusual valence(s): C(3); N+1(2); C(1); Proton(s) added/removed) structure #1926.
Warning (Accepted unusual valence(s): C(3); N(1); C(1)) structure #1927.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1928.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1929.
Warning (Accepted unusual valence(s): N(2)) structure #1930.
Warning (Accepted unusual valence(s): N(2)) structure #1931.
Warning (Accepted unusual valence(s): N(2)) structure #1932.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1933.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1934.
Warning (Accepted unusual valence(s): N(2); C(3)) structure #1935.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1936.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1937.
Warning (Accepted unusual valence(s): C(3); N(2)) structure #1938.
Warning (Accepted unusual valence(s): C(3); C(1); N+1(2); N(1); N(2); Proton(s) added/removed) structure #1939.
Warning (Accepted unusual valence(s): N(1); O(1); C(2); Proton(s) added/removed) structure #1940.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); O(1); Proton(s) added/removed) structure #1941.
Warning (Accepted unusual valence(s): C(3); N(2); C(1); C(2)) structure #1942.
Warning (Accepted unusual valence(s): N(1); C(3); N(2); O(1); C(1); C(2)) structure #1943.
Warning (Accepted unusual valence(s): C,d(1); N(2)) structure #1944.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); C(1); Proton(s) added/removed) structure #1945.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); Proton(s) added/removed) structure #1946.
Warning (Accepted unusual valence(s): N(2); C(3); C,d(1); C(1); Proton(s) added/removed) structure #1947.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); C,d(1)) structure #1948.
Warning (Accepted unusual valence(s): C,d(1); C(2)) structure #1949.
Warning (Accepted unusual valence(s): C,d(2); C(3); C(1); O(1)) structure #1950.
Warning (Accepted unusual valence(s): O(1); C(1); C(3); C(2); Proton(s) added/removed) structure #1951.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #1952.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #1953.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1954.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1955.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #1956.
Warning (Accepted unusual valence(s): N(2); N(1); C(3); C(1)) structure #1957.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1)) structure #1958.
Warning (Accepted unusual valence(s): C(1); C(3); C(2); N(2); O(1)) structure #1959.
Warning (Accepted unusual valence(s): C(3); O(1); Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1(1); C-1(2); C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1(1); C-1(2); C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3); C(1); C,d(1)) structure #1965.
Warning (Accepted unusual valence(s): C+1(1); C(5); C-1(2); C+1,t(2); C-1,t(3); C(1); C,d(1)) structure #1966.
Warning (Accepted unusual valence(s): C(2); C(3); O(1)) structure #1967.
Warning (Accepted unusual valence(s): C(1); C(3); N+1(1)) structure #1968.
Warning (Accepted unusual valence(s): C(3); C(2)) structure #1969.
Warning (Accepted unusual valence(s): N(2); C(2); Proton(s) added/removed) structure #1970.
Warning (Accepted unusual valence(s): C,d(2); C(2); C(1); C(3); C,d(1); Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); C(2); C(1); C(3); C,t(1); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #1973.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1974.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1975.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1976.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1977.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1978.
Warning (Accepted unusual valence(s): C(3); N(2); N(1)) structure #1979.
Warning (Accepted unusual valence(s): C(3); N(2); N(1); N-1(1)) structure #1980.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1981.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1982.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1983.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1984.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1985.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #1986.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1); N-1(1)) structure #1987.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #1988.
Warning (Accepted unusual valence(s): C(2); O(1); C(1); C(3); N(1)) structure #1989.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #1990.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #1994.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); N(2); Proton(s) added/removed) structure #1995.
Warning (Accepted unusual valence(s): C(2)) structure #1996.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1997.
Warning (Accepted unusual valence(s): C(3); C,d(1)) structure #1998.
Warning (Accepted unusual valence(s): C,d(1); C(3)) structure #1999.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1)) structure #2000.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); C(2); O(1)) structure #2001.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1); C(2); Se(1)) structure #2002.
Warning (Accepted unusual valence(s): C(1); N(1); C(3); O(1); Se(1); Proton(s) added/removed) structure #2003.
Warning (Accepted unusual valence(s): N-1(1); N(2); C(2); C(1); S(1)) structure #2004.
Warning (Accepted unusual valence(s): N-1(1); N(2); C(2); S(1)) structure #2005.
Warning (Accepted unusual valence(s): N(1); N(2); C(2); S(1)) structure #2006.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2007.
Warning (Accepted unusual valence(s): C(3); N+1(3); C(1)) structure #2008.
Warning (Accepted unusual valence(s): C(3); N+1(3); C(1); C(2)) structure #2009.
Warning (Accepted unusual valence(s): O(1); C(2); N-1(1); N(2)) structure #2010.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1)) structure #2011.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1)) structure #2012.
Warning (Accepted unusual valence(s): O(1); C(3); N-1(1); N(2); N(1); C(1)) structure #2013.
Warning (Accepted unusual valence(s): O(1); C(3); N(2); N(1); C(1)) structure #2014.
Warning (Accepted unusual valence(s): C(1); N+1(3)) structure #2015.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(1)) structure #2016.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2017.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); C(2); N+1(3); C-1(2); O+1(2); O(4); N-1(1); C+1(1); C+1(2); C-1(1); C,t(1)) structure #2018.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1)) structure #2019.
Warning (Accepted unusual valence(s): C(1); C(3); O(1)) structure #2020.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); C(1)) structure #2021.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); N(2); Proton(s) added/removed) structure #2022.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #2023.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #2024.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2025.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #2026.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(2)) structure #2027.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2028.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2029.
Warning (Accepted unusual valence(s): C(1); C(3); C,d(2)) structure #2030.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); O(1)) structure #2031.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); O(1)) structure #2032.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #2033.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(2); N(2); C(1); N+1(1)) structure #2034.
Warning (Accepted unusual valence(s): C(3); C(2); C(1)) structure #2035.
Warning (Accepted unusual valence(s): C(3); C(1); N(2); N(1)) structure #2036.
Warning (Accepted unusual valence(s): C(1); O(1)) structure #2037.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2038.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2039.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); C+1(1); N(2); Proton(s) added/removed) structure #2040.
Warning (Salt was disconnected; Accepted unusual valence(s): C(3); O(1); C(2); C(1); Proton(s) added/removed) structure #2041.
Warning (Accepted unusual valence(s): C(2); C(1)) structure #2042.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2043.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2044.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2045.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2046.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2047.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(2); C(2); S(1)) structure #2048.
Warning (Salt was disconnected; Accepted unusual valence(s): C(1); C(3); C+1(1); N(2); Proton(s) added/removed) structure #2049.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #2050.
Warning (Accepted unusual valence(s): C(2); C(3); C(1)) structure #2051.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2052.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2053.
Warning (Accepted unusual valence(s): C(1); C(2); C(3)) structure #2054.
Warning (Accepted unusual valence(s): C(3); O(1); N(2)) structure #2055.
Warning (Accepted unusual valence(s): C(1); C(3); O(1); N(2)) structure #2056.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); N(1); Proton(s) added/removed) structure #2057.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #2058.
Warning (Accepted unusual valence(s): N(2); O(1); C(3); N(1); Proton(s) added/removed) structure #2059.
Warning (Accepted unusual valence(s): C(1); N(2); C(3)) structure #2060.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #2061.
Warning (Accepted unusual valence(s): O(1); C(1)) structure #2062.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2063.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2064.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2065.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2066.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2067.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2068.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2069.
Warning (Accepted unusual valence(s): C(1)) structure #2070.
Warning (Accepted unusual valence(s): C(1)) structure #2071.
Warning (Accepted unusual valence(s): C(1)) structure #2072.
Warning (Accepted unusual valence(s): C(1)) structure #2073.
Warning (Accepted unusual valence(s): C(1)) structure #2074.
Warning (Accepted unusual valence(s): C(1)) structure #2075.
Warning (Accepted unusual valence(s): C(1)) structure #2076.
Warning (Accepted unusual valence(s): C(1)) structure #2077.
Warning (Accepted unusual valence(s): C(1)) structure #2078.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2079.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2080.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2081.
Warning (Accepted unusual valence(s): C(1); C(2)) structure #2082.
Warning (Accepted unusual valence(s): C(1)) structure #2083.
Warning (Accepted unusual valence(s): C(3)) structure #2084.
Warning (Accepted unusual valence(s): C(3)) structure #2085.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): C(3)) structure #2088.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2089.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2090.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2091.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2092.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2093.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2094.
Warning (Accepted unusual valence(s): N(4); O(1); C(3); C,d(1)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2097.
Warning (Accepted unusual valence(s): C(2)) structure #2098.
Warning (Accepted unusual valence(s): C(3); O(1); Charges neutralized) structure #2099.
Warning (Accepted unusual valence(s): C(3); N+1(3); Proton(s) added/removed) structure #2100.
Warning (Accepted unusual valence(s): C(3); N+1(3); Proton(s) added/removed) structure #2101.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #2102.
Warning (Accepted unusual valence(s): C(3); O(1); N+1(3); Charges neutralized; Proton(s) added/removed) structure #2103.
Warning (Accepted unusual valence(s): C(3); Charges neutralized) structure #2104.
Warning (Accepted unusual valence(s): C(1)) structure #2105.
Warning (Accepted unusual valence(s): C(1)) structure #2106.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #2107.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #2108.
Warning (Accepted unusual valence(s): C(1); C(3); C(2)) structure #2109.
Warning (Accepted unusual valence(s): C(2)) structure #2110.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); C(1); N(1); O(1)) structure #2111.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(3)) structure #2132.
Warning (Accepted unusual valence(s): C(1); C(5)) structure #2133.
Warning (Accepted unusual valence(s): C(1); C(2); C(3); N(2)) structure #2134.
Warning (Accepted unusual valence(s): C(3); C(2); N(1); C(1); O(1); Proton(s) added/removed) structure #2135.
Warning (Accepted unusual valence(s): C(3); C(2); N(2); O(1); C(1); N(1); Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Accepted unusual valence(s): C(2); C(3); C(1); O(1)) structure #2137.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #2138.
Warning (Accepted unusual valence(s): S(1); C(1); C(2)) structure #2139.
Warning (Charges were rearranged; Accepted unusual valence(s): N(1)) structure #2140.
Warning (Accepted unusual valence(s): N(1)) structure #2141.
Warning (Charges were rearranged; Accepted unusual valence(s): N(2); C(2); C(1); S(1)) structure #2142.
Warning (Accepted unusual valence(s): N(2); C(2); C(1); S(1)) structure #2143.
Warning (Charges were rearranged; Accepted unusual valence(s): S(1); C(1); C(2); N(1); N(2)) structure #2144.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1)) structure #2145.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2146.
Warning (Accepted unusual valence(s): C(3); C(1)) structure #2147.
Warning (Accepted unusual valence(s): C-1(2); C(1); C(3)) structure #2148.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C(2)) structure #2149.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #2150.
Warning (Accepted unusual valence(s): C(3); C(1); C(2)) structure #2151.
Warning (Accepted unusual valence(s): C-1(2); C(1); C(2); C(3)) structure #2152.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3); C(1); C-1(2); C(2)) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4)) structure #2157.
Warning (Accepted unusual valence(s): C(1)) structure #2158.
Warning (Accepted unusual valence(s): C(1)) structure #2159.
Warning (Accepted unusual valence(s): C(1)) structure #2160.
Warning (Accepted unusual valence(s): C-1(1); C(3)) structure #2161.
Warning (Accepted unusual valence(s): C(2); C(3)) structure #2162.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2163.
Warning (Accepted unusual valence(s): C(1); C(3)) structure #2164.
Warning (Accepted unusual valence(s): C(1); C-1(2); C(3)) structure #2165.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2166.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2167.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2168.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2169.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2170.
Warning (Accepted unusual valence(s): C(1); N+1(3)) structure #2171.
Warning (Accepted unusual valence(s): C(1); C(2); Proton(s) added/removed) structure #2172.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1); O(4); C-1(1); C(3); C(2); C-1(2); N+1(3); Proton(s) added/removed) structure #2173.
Warning (Accepted unusual valence(s): C(1); N-1(1)) structure #2174.
Warning (Charges were rearranged; Accepted unusual valence(s): C(1)) structure #2175.
Warning (Accepted unusual valence(s): C(1)) structure #2176.
Warning (Accepted unusual valence(s): C(1)) structure #2177.
Warning (Accepted unusual valence(s): O(1); C(1); Proton(s) added/removed) structure #2178.
Warning (Charges were rearranged; Accepted unusual valence(s): O(1); C(1)) structure #2179.
Warning (Accepted unusual valence(s): C(2); C-1(1)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): N+1(3); C(1); N-1(1); C(3); C-1(2); C(2); C+1(2); B-1(2); N+1(2); N(2); O(1); C-1(1); Proton(s) added/removed) structure #2181.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #2182.
Warning (Accepted unusual valence(s): C(3)) structure #2183.
Warning (Accepted unusual valence(s): C(3); O+1(1); Proton(s) added/removed) structure #2184.
Warning (Accepted unusual valence(s): C(3)) structure #2185.
Warning (Charges were rearranged; Accepted unusual valence(s): C(2); C-1(2); C(1); C(3); O(1); O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.20
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-01.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-01.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-01.inc its-non-std-01.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SUU -SLUUD"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Include undefined/unknown stereogenic centers and bonds
Make labels for unknown and undefined stereo different
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Ambiguous stereo: center(s)) structure #453.
Warning (Ambiguous stereo: center(s)) structure #454.
Warning (Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s)) structure #471.
Warning (Ambiguous stereo: center(s)) structure #473.
Warning (Ambiguous stereo: center(s)) structure #475.
Warning (Ambiguous stereo: center(s)) structure #476.
Warning (Ambiguous stereo: center(s)) structure #477.
Warning (Ambiguous stereo: center(s)) structure #479.
Warning (Ambiguous stereo: center(s)) structure #481.
Warning (Ambiguous stereo: center(s)) structure #482.
Warning (Ambiguous stereo: center(s)) structure #483.
Warning (Ambiguous stereo: center(s)) structure #489.
Warning (Ambiguous stereo: center(s)) structure #495.
Warning (Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s)) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Not chiral) structure #1022.
Warning (Proton(s) added/removed; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Not chiral) structure #1037.
Warning (Not chiral) structure #1039.
Warning (Proton(s) added/removed; Not chiral) structure #1044.
Warning (Not chiral) structure #1045.
Warning (Proton(s) added/removed; Not chiral) structure #1047.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Not chiral) structure #1052.
Warning (Not chiral) structure #1053.
Warning (Proton(s) added/removed; Not chiral) structure #1054.
Warning (Not chiral) structure #1055.
Warning (Not chiral) structure #1056.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1058.
Warning (Not chiral) structure #1059.
Warning (Not chiral) structure #1060.
Warning (Proton(s) added/removed; Not chiral) structure #1062.
Warning (Not chiral) structure #1064.
Warning (Not chiral) structure #1065.
Warning (Not chiral) structure #1066.
Warning (Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Not chiral) structure #1081.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Not chiral) structure #1085.
Warning (Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Ambiguous stereo: center(s)) structure #1359.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Not chiral) structure #1498.
Warning (Proton(s) added/removed; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s)) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Not chiral) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.60
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-02.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-02.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-02.inc its-non-std-02.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SRel -Key"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.61
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-03.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-03.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-03.inc its-non-std-03.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SRac"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Racemic Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.61
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-04.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-04.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-04.inc its-non-std-04.log /dev/null -AuxNone -OutErrINCHI -NoLabels -SUU -SLUUD -SUCF"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Chiral Flag Stereo ON
Include undefined/unknown stereogenic centers and bonds
Make labels for unknown and undefined stereo different
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Ambiguous stereo: center(s)) structure #453.
Warning (Ambiguous stereo: center(s)) structure #454.
Warning (Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s)) structure #471.
Warning (Ambiguous stereo: center(s)) structure #473.
Warning (Ambiguous stereo: center(s)) structure #475.
Warning (Ambiguous stereo: center(s)) structure #476.
Warning (Ambiguous stereo: center(s)) structure #477.
Warning (Ambiguous stereo: center(s)) structure #479.
Warning (Ambiguous stereo: center(s)) structure #481.
Warning (Ambiguous stereo: center(s)) structure #482.
Warning (Ambiguous stereo: center(s)) structure #483.
Warning (Ambiguous stereo: center(s)) structure #489.
Warning (Ambiguous stereo: center(s)) structure #495.
Warning (Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s)) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Not chiral) structure #1022.
Warning (Proton(s) added/removed; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Not chiral) structure #1037.
Warning (Not chiral) structure #1039.
Warning (Proton(s) added/removed; Not chiral) structure #1044.
Warning (Not chiral) structure #1045.
Warning (Proton(s) added/removed; Not chiral) structure #1047.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Not chiral) structure #1052.
Warning (Not chiral) structure #1053.
Warning (Proton(s) added/removed; Not chiral) structure #1054.
Warning (Not chiral) structure #1055.
Warning (Not chiral) structure #1056.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1058.
Warning (Not chiral) structure #1059.
Warning (Not chiral) structure #1060.
Warning (Proton(s) added/removed; Not chiral) structure #1062.
Warning (Not chiral) structure #1064.
Warning (Not chiral) structure #1065.
Warning (Not chiral) structure #1066.
Warning (Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Not chiral) structure #1081.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Not chiral) structure #1085.
Warning (Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Ambiguous stereo: center(s)) structure #1359.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Not chiral) structure #1498.
Warning (Proton(s) added/removed; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s)) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Not chiral) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.60
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-05.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-05.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-05.inc its-non-std-05.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -SRel"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.27
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-06.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-06.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-06.inc its-non-std-06.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -SRac"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Racemic Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.28
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-07.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-07.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-07.inc its-non-std-07.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -SLUUD -SUCF"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Chiral Flag Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Make labels for unknown and undefined stereo different
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.27
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-08.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-08.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-08.inc its-non-std-08.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -Key"
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Omitted undefined stereo; Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.68
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-09.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-09.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-09.inc its-non-std-09.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -FixedH"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Omitted undefined stereo; Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.33
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-10.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-10.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-10.inc its-non-std-10.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -SNon"
Using specific structure perception features:
Stereo OFF
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Do not reconnect metals (omit RecMet layer)
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.28
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-11.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-11.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-11.inc its-non-std-11.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -SRel"
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Do not reconnect metals (omit RecMet layer)
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Omitted undefined stereo) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.67
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-12.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-12.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-12.inc its-non-std-12.log /dev/null -AuxNone -OutErrINCHI -NoLabels -RecMet -Key"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Include bonds to metals
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected; Omitted undefined stereo) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:01.49
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-13.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-13.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-13.inc its-non-std-13.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -RecMet"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Include bonds to metals
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected; Ambiguous stereo: center(s)) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.39
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-14.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-14.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-14.inc its-non-std-14.log /dev/null -AuxNone -OutErrINCHI -NoLabels -RecMet -SNon"
Using specific structure perception features:
Stereo OFF
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Include bonds to metals
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.26
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-15.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-15.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-15.inc its-non-std-15.log /dev/null -AuxNone -OutErrINCHI -NoLabels -RecMet -SRel"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Include bonds to metals
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected; Omitted undefined stereo) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:01.50
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-16.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-16.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-16.inc its-non-std-16.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -RecMet -Key"
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Include bonds to metals
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected; Omitted undefined stereo) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Omitted undefined stereo; Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:01.55
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-17.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-17.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-17.inc its-non-std-17.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -FixedH -RecMet"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Include bonds to metals
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected; Ambiguous stereo: center(s)) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Omitted undefined stereo; Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.45
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-18.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-18.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-18.inc its-non-std-18.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -RecMet -SNon"
Using specific structure perception features:
Stereo OFF
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Include bonds to metals
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.30
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-19.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-19.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-19.inc its-non-std-19.log /dev/null -AuxNone -OutErrINCHI -NoLabels -FixedH -RecMet -SRel"
Generating non-standard InChI with the options:
Mobile H Perception OFF (include FixedH layer)
Include bonds to metals
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected; Omitted undefined stereo) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected; Omitted undefined stereo) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected...) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Omitted undefined stereo) structure #423.
Warning (Omitted undefined stereo) structure #424.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected; Omitted undefined stereo) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #705.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected; Omitted undefined stereo) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #750.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #751.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #752.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected; Omitted undefined stereo) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected; Omitted undefined stereo) structure #916.
Warning (Omitted undefined stereo) structure #921.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #930.
Warning (Omitted undefined stereo) structure #932.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #935.
Warning (Omitted undefined stereo) structure #937.
Warning (Omitted undefined stereo) structure #939.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #946.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Omitted undefined stereo) structure #1046.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected; Omitted undefined stereo) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Omitted undefined stereo) structure #1207.
Warning (Omitted undefined stereo) structure #1208.
Warning (Omitted undefined stereo) structure #1210.
Warning (Omitted undefined stereo) structure #1212.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected; Omitted undefined stereo) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected; Omitted undefined stereo) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Omitted undefined stereo) structure #1491.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Omitted undefined stereo; Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Omitted undefined stereo) structure #1807.
Warning (Omitted undefined stereo) structure #1808.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Omitted undefined stereo) structure #1829.
Warning (Omitted undefined stereo) structure #1831.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1840.
Warning (Omitted undefined stereo) structure #1850.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Omitted undefined stereo) structure #2004.
Warning (Omitted undefined stereo) structure #2005.
Warning (Omitted undefined stereo) structure #2006.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2111.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2116.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Omitted undefined stereo) structure #2119.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2120.
Warning (Omitted undefined stereo) structure #2121.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2122.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Omitted undefined stereo) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:01.54
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-20.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-20.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-20.inc its-non-std-20.log /dev/null -AuxNone -OutErrINCHI -NoLabels -KET -Key"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo; Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.64
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-21.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-21.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-21.inc its-non-std-21.log /dev/null -AuxNone -OutErrINCHI -NoLabels -KET -SNon"
Using specific structure perception features:
Stereo OFF
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.25
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-22.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-22.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-22.inc its-non-std-22.log /dev/null -AuxNone -OutErrINCHI -NoLabels -KET -SRel"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Account for keto-enol tautomerism
Do not account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s); Omitted undefined stereo) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Omitted undefined stereo) structure #1333.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Omitted undefined stereo) structure #1387.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Omitted undefined stereo) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Omitted undefined stereo) structure #2129.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.64
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-23.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-23.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-23.inc its-non-std-23.log /dev/null -AuxNone -OutErrINCHI -NoLabels -15T -Key"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.61
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-24.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-24.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-24.inc its-non-std-24.log /dev/null -AuxNone -OutErrINCHI -NoLabels -15T -SNon"
Using specific structure perception features:
Stereo OFF
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Do not account for keto-enol tautomerism
Account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Charges were rearranged) structure #663.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Metal was disconnected) structure #1013.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Proton(s) added/removed) structure #1027.
Warning (Proton(s) added/removed) structure #1028.
Warning (Proton(s) added/removed) structure #1029.
Warning (Proton(s) added/removed) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Proton(s) added/removed) structure #1044.
Warning (Proton(s) added/removed) structure #1047.
Warning (Proton(s) added/removed) structure #1049.
Warning (Proton(s) added/removed) structure #1050.
Warning (Proton(s) added/removed) structure #1051.
Warning (Proton(s) added/removed) structure #1052.
Warning (Proton(s) added/removed) structure #1054.
Warning (Charges were rearranged) structure #1057.
Warning (Charges were rearranged) structure #1058.
Warning (Proton(s) added/removed) structure #1062.
Warning (Proton(s) added/removed) structure #1070.
Warning (Proton(s) added/removed) structure #1083.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Proton(s) added/removed) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Metal was disconnected) structure #1667.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Proton(s) added/removed) structure #1727.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Proton(s) added/removed) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.23
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-25.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-25.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-25.inc its-non-std-25.log /dev/null -AuxNone -OutErrINCHI -NoLabels -15T -SRel"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Relative Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Do not account for keto-enol tautomerism
Account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #206.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo; Ambiguous stereo: bond(s)) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo) structure #1037.
Warning (Omitted undefined stereo) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1044.
Warning (Omitted undefined stereo) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1052.
Warning (Omitted undefined stereo) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1054.
Warning (Omitted undefined stereo) structure #1055.
Warning (Omitted undefined stereo) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo) structure #1059.
Warning (Omitted undefined stereo) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1062.
Warning (Omitted undefined stereo) structure #1064.
Warning (Omitted undefined stereo) structure #1065.
Warning (Omitted undefined stereo) structure #1066.
Warning (Omitted undefined stereo) structure #1067.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo) structure #1085.
Warning (Omitted undefined stereo) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Omitted undefined stereo) structure #1272.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4); Omitted undefined stereo) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Omitted undefined stereo) structure #1592.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1593.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed; Omitted undefined stereo) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Omitted undefined stereo) structure #1979.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1980.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Omitted undefined stereo) structure #2026.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2035.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo) structure #2125.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.60
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-26.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-26.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-26.inc its-non-std-26.log /dev/null -AuxNone -OutErrINCHI -NoLabels -KET -15T"
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Account for keto-enol tautomerism
Account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Omitted undefined stereo) structure #640.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Omitted undefined stereo) structure #668.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Ambiguous stereo: center(s)) structure #764.
Warning (Omitted undefined stereo) structure #765.
Warning (Ambiguous stereo: center(s)) structure #767.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Omitted undefined stereo) structure #850.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #875.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Omitted undefined stereo) structure #1186.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Omitted undefined stereo) structure #1437.
Warning (Omitted undefined stereo) structure #1438.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Omitted undefined stereo) structure #1450.
Warning (Accepted unusual valence(s): C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1701.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1718.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1741.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Omitted undefined stereo) structure #1747.
Warning (Omitted undefined stereo) structure #1748.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1761.
Warning (Omitted undefined stereo) structure #1768.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Omitted undefined stereo) structure #1974.
Warning (Omitted undefined stereo) structure #1975.
Warning (Omitted undefined stereo) structure #1976.
Warning (Omitted undefined stereo) structure #1977.
Warning (Omitted undefined stereo) structure #1978.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.64
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-27.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-27.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-27.inc its-non-std-27.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -KET -15T -Key"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Omit undefined/unknown stereogenic centers and bonds
Account for keto-enol tautomerism
Account for 1,5-tautomerism
Generating InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected; Omitted undefined stereo) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected; Omitted undefined stereo) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected; Omitted undefined stereo) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected; Omitted undefined stereo) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected; Omitted undefined stereo) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected; Omitted undefined stereo) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected; Omitted undefined stereo) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected; Omitted undefined stereo) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected; Omitted undefined stereo) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected; Omitted undefined stereo) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected; Omitted undefined stereo) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected...) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected; Omitted undefined stereo) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected; Omitted undefined stereo) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected...) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Omitted undefined stereo) structure #207.
Warning (Omitted undefined stereo) structure #208.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #214.
Warning (Omitted undefined stereo) structure #235.
Warning (Omitted undefined stereo) structure #236.
Warning (Omitted undefined stereo) structure #237.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged; Omitted undefined stereo) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #254.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed; Omitted undefined stereo) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed; Omitted undefined stereo) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #453.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #454.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #471.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #475.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #476.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #477.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #479.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #481.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #482.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #483.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #489.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #495.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Omitted undefined stereo) structure #509.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Omitted undefined stereo) structure #512.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Omitted undefined stereo) structure #520.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Omitted undefined stereo) structure #529.
Warning (Omitted undefined stereo) structure #530.
Warning (Omitted undefined stereo) structure #533.
Warning (Omitted undefined stereo) structure #534.
Warning (Omitted undefined stereo) structure #535.
Warning (Omitted undefined stereo) structure #536.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Omitted undefined stereo) structure #545.
Warning (Omitted undefined stereo) structure #548.
Warning (Omitted undefined stereo) structure #549.
Warning (Omitted undefined stereo) structure #551.
Warning (Omitted undefined stereo) structure #553.
Warning (Omitted undefined stereo) structure #564.
Warning (Omitted undefined stereo) structure #582.
Warning (Omitted undefined stereo) structure #583.
Warning (Omitted undefined stereo) structure #586.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #600.
Warning (Omitted undefined stereo) structure #601.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #607.
Warning (Omitted undefined stereo) structure #608.
Warning (Omitted undefined stereo) structure #609.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #610.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #611.
Warning (Omitted undefined stereo) structure #612.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #613.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #614.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #615.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Omitted undefined stereo) structure #655.
Warning (Omitted undefined stereo) structure #659.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged; Omitted undefined stereo) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #712.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #719.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #720.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Omitted undefined stereo) structure #741.
Warning (Proton(s) added/removed) structure #742.
Warning (Omitted undefined stereo) structure #743.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Omitted undefined stereo) structure #754.
Warning (Omitted undefined stereo) structure #755.
Warning (Omitted undefined stereo) structure #758.
Warning (Omitted undefined stereo) structure #760.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Omitted undefined stereo) structure #765.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Omitted undefined stereo) structure #799.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Omitted undefined stereo) structure #825.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Omitted undefined stereo) structure #845.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #847.
Warning (Omitted undefined stereo) structure #849.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Omitted undefined stereo) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4); Omitted undefined stereo) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #856.
Warning (Accepted unusual valence(s): O(3); Omitted undefined stereo) structure #857.
Warning (Omitted undefined stereo) structure #858.
Warning (Accepted unusual valence(s): C(5); O(3); Omitted undefined stereo) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Omitted undefined stereo) structure #876.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Omitted undefined stereo) structure #882.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Omitted undefined stereo) structure #890.
Warning (Omitted undefined stereo) structure #891.
Warning (Omitted undefined stereo) structure #897.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected; Omitted undefined stereo) structure #900.
Warning (Metal was disconnected; Omitted undefined stereo; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Omitted undefined stereo) structure #922.
Warning (Omitted undefined stereo) structure #923.
Warning (Omitted undefined stereo) structure #925.
Warning (Omitted undefined stereo) structure #933.
Warning (Omitted undefined stereo) structure #934.
Warning (Omitted undefined stereo) structure #940.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Omitted undefined stereo) structure #942.
Warning (Omitted undefined stereo) structure #943.
Warning (Omitted undefined stereo) structure #944.
Warning (Omitted undefined stereo) structure #945.
Warning (Omitted undefined stereo) structure #947.
Warning (Omitted undefined stereo) structure #948.
Warning (Charges were rearranged) structure #953.
Warning (Omitted undefined stereo) structure #954.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Omitted undefined stereo) structure #987.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected; Omitted undefined stereo) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Omitted undefined stereo) structure #1002.
Warning (Omitted undefined stereo) structure #1003.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Omitted undefined stereo; Not chiral) structure #1022.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Omitted undefined stereo; Not chiral) structure #1037.
Warning (Omitted undefined stereo; Not chiral) structure #1039.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1044.
Warning (Omitted undefined stereo; Not chiral) structure #1045.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1047.
Warning (Omitted undefined stereo) structure #1048.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1052.
Warning (Omitted undefined stereo; Not chiral) structure #1053.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1054.
Warning (Omitted undefined stereo; Not chiral) structure #1055.
Warning (Omitted undefined stereo; Not chiral) structure #1056.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1058.
Warning (Omitted undefined stereo; Not chiral) structure #1059.
Warning (Omitted undefined stereo; Not chiral) structure #1060.
Warning (Omitted undefined stereo) structure #1061.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1062.
Warning (Omitted undefined stereo; Not chiral) structure #1064.
Warning (Omitted undefined stereo; Not chiral) structure #1065.
Warning (Omitted undefined stereo; Not chiral) structure #1066.
Warning (Omitted undefined stereo; Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Omitted undefined stereo; Not chiral) structure #1081.
Warning (Omitted undefined stereo) structure #1082.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Omitted undefined stereo; Not chiral) structure #1085.
Warning (Omitted undefined stereo; Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2); Omitted undefined stereo) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Omitted undefined stereo) structure #1137.
Warning (Omitted undefined stereo) structure #1138.
Warning (Omitted undefined stereo) structure #1139.
Warning (Omitted undefined stereo) structure #1140.
Warning (Omitted undefined stereo) structure #1141.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1162.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1163.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Omitted undefined stereo) structure #1214.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Omitted undefined stereo) structure #1256.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Omitted undefined stereo) structure #1266.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Omitted undefined stereo) structure #1279.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Omitted undefined stereo) structure #1292.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5); Omitted undefined stereo) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected; Omitted undefined stereo) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected; Omitted undefined stereo) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Omitted undefined stereo) structure #1354.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1359.
Warning (Omitted undefined stereo) structure #1360.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1366.
Warning (Omitted undefined stereo) structure #1368.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Omitted undefined stereo) structure #1413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Omitted undefined stereo) structure #1415.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Omitted undefined stereo) structure #1446.
Warning (Omitted undefined stereo) structure #1449.
Warning (Accepted unusual valence(s): C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Omitted undefined stereo) structure #1468.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Omitted undefined stereo) structure #1471.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Omitted undefined stereo; Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1485.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1487.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Omitted undefined stereo) structure #1490.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1497.
Warning (Omitted undefined stereo; Not chiral) structure #1498.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Omitted undefined stereo) structure #1505.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected; Omitted undefined stereo) structure #1513.
Warning (Omitted undefined stereo) structure #1514.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Omitted undefined stereo) structure #1585.
Warning (Omitted undefined stereo) structure #1586.
Warning (Omitted undefined stereo; Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Omitted undefined stereo) structure #1606.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed; Omitted undefined stereo) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Omitted undefined stereo) structure #1620.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Omitted undefined stereo) structure #1632.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Omitted undefined stereo) structure #1662.
Warning (Omitted undefined stereo) structure #1663.
Warning (Omitted undefined stereo) structure #1664.
Warning (Omitted undefined stereo) structure #1665.
Warning (Omitted undefined stereo) structure #1666.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Omitted undefined stereo) structure #1704.
Warning (Omitted undefined stereo) structure #1705.
Warning (Omitted undefined stereo) structure #1712.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s); Omitted undefined stereo) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Omitted undefined stereo) structure #1744.
Warning (Omitted undefined stereo) structure #1745.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Omitted undefined stereo) structure #1771.
Warning (Omitted undefined stereo) structure #1773.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Omitted undefined stereo) structure #1810.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Omitted undefined stereo) structure #1820.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Omitted undefined stereo; Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Omitted undefined stereo) structure #1878.
Warning (Accepted unusual valence(s): N(4); C(10); Omitted undefined stereo) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Omitted undefined stereo) structure #1915.
Warning (Omitted undefined stereo) structure #1916.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1926.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Omitted undefined stereo) structure #1954.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3); Omitted undefined stereo) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Omitted undefined stereo) structure #1967.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Omitted undefined stereo) structure #1989.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged; Omitted undefined stereo) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2008.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2011.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2012.
Warning (Omitted undefined stereo) structure #2013.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Omitted undefined stereo) structure #2018.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed; Omitted undefined stereo) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Omitted undefined stereo) structure #2036.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2048.
Warning (Salt was disconnected; Omitted undefined stereo) structure #2049.
Warning (Proton(s) added/removed; Omitted undefined stereo) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Omitted undefined stereo) structure #2084.
Warning (Proton(s) added/removed) structure #2086.
Warning (Omitted undefined stereo) structure #2088.
Warning (Omitted undefined stereo) structure #2089.
Warning (Omitted undefined stereo) structure #2090.
Warning (Omitted undefined stereo) structure #2091.
Warning (Omitted undefined stereo) structure #2092.
Warning (Omitted undefined stereo) structure #2093.
Warning (Omitted undefined stereo) structure #2094.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Omitted undefined stereo) structure #2107.
Warning (Omitted undefined stereo) structure #2109.
Warning (Omitted undefined stereo) structure #2112.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Omitted undefined stereo) structure #2115.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Omitted undefined stereo; Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Omitted undefined stereo; Not chiral) structure #2127.
Warning (Omitted undefined stereo) structure #2128.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Omitted undefined stereo) structure #2139.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed; Omitted undefined stereo) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2149.
Warning (Omitted undefined stereo) structure #2150.
Warning (Omitted undefined stereo) structure #2151.
Warning (Charges were rearranged; Omitted undefined stereo) structure #2152.
Warning (Charges were rearranged; Omitted undefined stereo; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Omitted undefined stereo; Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Omitted undefined stereo; Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.31
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'its-non-std-28.log'
Opened input file 'InChI_TestSet.sdf'
Opened output file 'its-non-std-28.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 InChI_TestSet.sdf its-non-std-28.inc its-non-std-28.log /dev/null -AuxNone -OutErrINCHI -NoLabels -NEWPSOFF -KET -15T -SUU -SLUUD"
Using specific structure perception features:
Both ends of wedge point to stereocenters
Generating non-standard InChI with the options:
Mobile H Perception ON (omit FixedH layer)
Do not reconnect metals (omit RecMet layer)
Absolute Stereo ON
Include undefined/unknown stereogenic centers and bonds
Make labels for unknown and undefined stereo different
Account for keto-enol tautomerism
Account for 1,5-tautomerism
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Warning (Metal was disconnected) structure #13.
Warning (Metal was disconnected) structure #14.
Warning (Metal was disconnected) structure #15.
Warning (Metal was disconnected) structure #16.
Warning (Metal was disconnected) structure #17.
Warning (Metal was disconnected) structure #26.
Warning (Metal was disconnected) structure #27.
Warning (Metal was disconnected) structure #28.
Warning (Metal was disconnected) structure #29.
Warning (Metal was disconnected) structure #30.
Warning (Metal was disconnected) structure #40.
Warning (Metal was disconnected) structure #41.
Warning (Metal was disconnected) structure #42.
Warning (Metal was disconnected) structure #43.
Warning (Metal was disconnected) structure #51.
Warning (Metal was disconnected) structure #55.
Warning (Metal was disconnected) structure #56.
Warning (Metal was disconnected) structure #64.
Warning (Metal was disconnected) structure #68.
Warning (Metal was disconnected) structure #69.
Warning (Metal was disconnected) structure #82.
Warning (Metal was disconnected) structure #105.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #106.
Warning (Accepted unusual valence(s): Mn(1); Fe(1); Zn(1); Gd(1); Ac(1); Ni(1); Co(1); Pd(1); Rh(1); Cr(1); V(1); Ru(1); Tc(1); Ti(1); Sc(1); Mo(1); Nb(1); Zr(1); Y(1); Hf(1); La(1); Pr(1); Ce(1); W(1); Ta(1); Pm(1); Nd(1); Os(1); Re(1); Eu(1); Sm(1); Pt(1); Ir(1)) structure #107.
Warning (Accepted unusual valence(s): Ag(3); H(3); Fr(3); Kr(3); Xe(3); Rn(3); Pt(3); Pd(3); He(3); Rf(3); Ra(3); Be(3); Li(3); Mg(3); Na(3); Ne(3); F(3); Ar(3); O(3); S(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Zr(3); Hf(3); Ta(3); Tc(3); Re(3); Zn(3); Cd(3)) structure #108.
Warning (Accepted unusual valence(s): O-1(2); Metal was disconnected) structure #109.
Warning (Accepted unusual valence(s): N-2(2); Metal was disconnected) structure #110.
Warning (Accepted unusual valence(s): Ra+1(2); Mg+1(2); Sr+1(2); Be+1(2); Ca+1(2); Ba+1(2); Metal was disconnected) structure #111.
Warning (Accepted unusual valence(s): Al+2(2); In+2(2); B+2(2); Ga+2(2); Metal was disconnected) structure #112.
Warning (Accepted unusual valence(s): Ag(3); Cd(3); Hg(3); H(3); Be(3); F(3); O(3); Li(3); Rf(3); Ra(3); Fr(3); S(3); Mg(3); Na(3); Ca(3); K(3); Sr(3); Rb(3); Ba(3); Cs(3); Pd(3); Tc(3); Zr(3); Zn(3); Pt(3); Re(3); Ta(3); Hf(3); Cu(3); Lr(3); No(3)...) structure #113.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4); Sr(4); Rb(4)...) structure #114.
Warning (Accepted unusual valence(s): Ag(2); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #115.
Warning (Accepted unusual valence(s): Ag(4); Cd(4); Hg(4); Lu(4); Yb(4); Tm(4); Er(4); Ho(4); Dy(4); Cm(4); H(4); B(4); Be(4); He(4); Ne(4); F(4); O(4); N(4); Li(4); Rf(4); Ac(4); Ra(4); Fr(4); Ar(4); Al(4); Mg(4); Na(4); Kr(4); Ga(4); Ca(4); K(4); Xe(4); In(4)...) structure #116.
Warning (Accepted unusual valence(s): O-1(3); N-1(3); Metal was disconnected) structure #117.
Warning (Accepted unusual valence(s): N-2(3); C-2(3); Si-2(3); Metal was disconnected) structure #118.
Warning (Accepted unusual valence(s): B+1(3); Be+1(3); F+1(3); Ra+1(3); Al+1(3); Mg+1(3); Ca+1(3); Sr+1(3); Ba+1(3); Metal was disconnected) structure #119.
Warning (Accepted unusual valence(s): B+2(3); C+2(3); Si+2(3); Al+2(3); Ga+2(3); In+2(3); Metal was disconnected) structure #120.
Warning (Accepted unusual valence(s): Ag(4); Cu(4); Zn(4); Cd(4); Hg(4); Au(4); H(4); B(4); Be(4); F(4); O(4); N(4); Li(4); Al(4); Mg(4); Na(4); Ga(4); Ca(4); K(4); In(4); Sr(4); Rb(4); Tl(4); Ba(4); Cs(4); Ni(4); Co(4); Cr(4); Sc(4); Tc(4); Nb(4); Y(4); Ta(4)...) structure #121.
Warning (Accepted unusual valence(s): O-1(4); N-1(4); C-1(4); Metal was disconnected) structure #122.
Warning (Accepted unusual valence(s): B-2(4); N-2(4); C-2(4); Si-2(4); Metal was disconnected) structure #123.
Warning (Accepted unusual valence(s): B+1(4); Be+1(4); F+1(4); C+1(4); Si+1(4); Al+1(4); Mg+1(4); Ge+1(4); Ca+1(4); Sn+1(4); Sr+1(4); Pb+1(4); Ba+1(4); Ra+1(4); Metal was disconnected) structure #124.
Warning (Accepted unusual valence(s): B+2(4); N+2(4); C+2(4); P+2(4); Si+2(4); Al+2(4); As+2(4); Ga+2(4); Sb+2(4); In+2(4); Bi+2(4); Metal was disconnected) structure #125.
Warning (Accepted unusual valence(s): Ag(5); Cu(5); Zn(5); Cd(5); Hg(5); Pt(5); Au(5); H(5); B(5); Be(5); F(5); O(5); C(5); Li(5); Si(5); Al(5); Mg(5); Na(5); Ge(5); Ga(5); Ca(5); K(5); Sn(5); In(5); Sr(5); Rb(5); Pb(5); Tl(5); Ba(5); Cs(5); Mn(5); Fe(5); Ni(5)...) structure #126.
Warning (Accepted unusual valence(s): B-1(5); O-1(5); N-1(5); C-1(5); Al-1(5); Ga-1(5); In-1(5); Tl-1(5); Metal was disconnected) structure #127.
Warning (Accepted unusual valence(s): B-2(5); N-2(5); C-2(5); Si-2(5); Metal was disconnected) structure #128.
Warning (Accepted unusual valence(s): B+1(5); Be+1(5); F+1(5); N+1(5); C+1(5); P+1(5); Si+1(5); Al+1(5); Mg+1(5); As+1(5); Ge+1(5); Ca+1(5); Sb+1(5); Sn+1(5); Sr+1(5); Bi+1(5); Pb+1(5); Ba+1(5); Ra+1(5); Metal was disconnected) structure #129.
Warning (Accepted unusual valence(s): B+2(5); O+2(5); N+2(5); C+2(5); S+2(5); P+2(5); Si+2(5); Al+2(5); Se+2(5); As+2(5); Ga+2(5); Te+2(5); Sb+2(5); In+2(5); Po+2(5); Bi+2(5); Metal was disconnected) structure #130.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(6); Cd(6); Hg(6); Pt(6); Au(6); H(6); B(6); Be(6); F(6); O(6); N(6); C(6); Li(6); P(6); Si(6); Al(6); Mg(6); Na(6); As(6); Ge(6); Ga(6); Ca(6); K(6); Sb(6); Sn(6); In(6); Sr(6); Rb(6); Bi(6); Pb(6); Tl(6)...) structure #131.
Warning (Accepted unusual valence(s): B-1(6); O-1(6); N-1(6); C-1(6); Si-1(6); Al-1(6); Ge-1(6); Ga-1(6); Sn-1(6); In-1(6); Pb-1(6); Tl-1(6); Metal was disconnected) structure #132.
Warning (Accepted unusual valence(s): B-2(6); N-2(6); C-2(6); Si-2(6); Al-2(6); Ga-2(6); In-2(6); Tl-2(6); Metal was disconnected) structure #133.
Warning (Accepted unusual valence(s): B+1(6); Be+1(6); F+1(6); O+1(6); N+1(6); C+1(6); S+1(6); P+1(6); Si+1(6); Al+1(6); Mg+1(6); Se+1(6); As+1(6); Ge+1(6); Ca+1(6); Te+1(6); Sb+1(6); Sn+1(6); Sr+1(6); Po+1(6); Bi+1(6); Pb+1(6); Ba+1(6); Ra+1(6)...) structure #134.
Warning (Accepted unusual valence(s): B+2(6); F+2(6); O+2(6); N+2(6); C+2(6); Cl+2(6); S+2(6); P+2(6); Si+2(6); Al+2(6); Br+2(6); Se+2(6); As+2(6); Ga+2(6); I+2(6); Te+2(6); Sb+2(6); In+2(6); At+2(6); Po+2(6); Bi+2(6); Metal was disconnected) structure #135.
Warning (Accepted unusual valence(s): Ag(6); Cu(6); Zn(7); Cd(7); Hg(6); Pt(7); Au(7); H(7); B(7); Be(7); F(6); O(6); N(6); C(7); Li(7); S(7); P(7); Si(7); Al(7); Mg(7); Na(7); Se(7); As(7); Ge(7); Ga(7); Ca(7); K(7); Te(7); Sb(7); Sn(7); In(7); Sr(7); Rb(7)...) structure #136.
Warning (Accepted unusual valence(s): B-1(7); O-1(7); N-1(7); C-1(7); P-1(7); Si-1(7); Al-1(7); As-1(7); Ge-1(7); Ga-1(7); Sb-1(7); Sn-1(7); In-1(7); Bi-1(7); Pb-1(7); Tl-1(7); Metal was disconnected) structure #137.
Warning (Accepted unusual valence(s): B-2(7); N-2(7); C-2(7); Si-2(7); Al-2(7); Ge-2(7); Ga-2(7); Sn-2(7); In-2(7); Pb-2(7); Tl-2(7); Metal was disconnected) structure #138.
Warning (Accepted unusual valence(s): B+1(7); Be+1(7); F+1(7); O+1(7); N+1(7); C+1(7); Cl+1(7); S+1(7); P+1(7); Si+1(7); Al+1(7); Mg+1(7); Br+1(7); Se+1(7); As+1(7); Ge+1(7); Ca+1(7); I+1(7); Te+1(7); Sb+1(7); Sn+1(7); Sr+1(7); At+1(7); Po+1(7); Bi+1(7); Pb+1(7)) structure #139.
Warning (Accepted unusual valence(s): B+2(7); F+2(7); O+2(7); N+2(7); C+2(7); Cl+2(7); S+2(7); P+2(7); Si+2(7); Al+2(7); Br+2(7); Se+2(7); As+2(7); Ga+2(7); I+2(7); Te+2(7); Sb+2(7); In+2(7); At+2(7); Po+2(7); Bi+2(7); Metal was disconnected) structure #140.
Warning (Accepted unusual valence(s): Ag(7); Cu(8); Zn(8); Cd(8); Hg(8); Pt(8); Au(8); H(8); B(8); Be(8); F(8); O(8); N(8); C(8); Li(8); Cl(8); S(8); P(8); Si(8); Al(8); Mg(8); Na(8); Br(8); Se(8); As(8); Ge(8); Ga(8); Ca(8); K(8); I(8); Te(8); Sb(8); Sn(8); In(8)) structure #141.
Warning (Accepted unusual valence(s): B-1(8); O-1(8); N-1(8); C-1(8); S-1(8); P-1(8); Si-1(8); Al-1(8); Se-1(8); As-1(8); Ge-1(8); Ga-1(8); Te-1(8); Sb-1(8); Sn-1(8); In-1(8); Po-1(8); Bi-1(8); Pb-1(8); Tl-1(8); Metal was disconnected) structure #142.
Warning (Accepted unusual valence(s): B-2(8); N-2(8); C-2(8); P-2(8); Si-2(8); Al-2(8); As-2(8); Ge-2(8); Ga-2(8); Sb-2(8); Sn-2(8); In-2(8); Bi-2(8); Pb-2(8); Tl-2(8); Metal was disconnected) structure #143.
Warning (Accepted unusual valence(s): B+1(8); Be+1(8); F+1(8); O+1(8); N+1(8); C+1(8); Cl+1(8); S+1(8); P+1(8); Si+1(8); Al+1(8); Mg+1(8); Br+1(8); Se+1(8); As+1(8); Ge+1(8); Ca+1(8); I+1(8); Te+1(8); Sb+1(8); Sn+1(8); Sr+1(8); At+1(8); Po+1(8); Bi+1(8); Pb+1(8)) structure #144.
Warning (Accepted unusual valence(s): B+2(8); F+2(8); O+2(8); N+2(8); C+2(8); Cl+2(8); S+2(8); P+2(8); Si+2(8); Al+2(8); Br+2(8); Se+2(8); As+2(8); Ga+2(8); I+2(8); Te+2(8); Sb+2(8); In+2(8); At+2(8); Po+2(8); Bi+2(8); Metal was disconnected) structure #145.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #146.
Warning (Accepted unusual valence(s): Ag(2); H(2); Au(2); Ti(2); Mo(2); Zr(2); Hf(2); Pr(2); W(2); Pm(2); Dy(2); Pa(2); Er(2); Np(2); Am(2); Cf(2); Fm(2); No(2); Li(2); Fr(2); Ac(2); Rf(2); F(2); Gd(2); Lu(2); Cm(2); Lr(2); Md(2); Pu(2); Tc(2); Nb(2); Ta(2); Nd(2)) structure #147.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); Ni(1); Pd(1); Cr(1); Ru(1); Ti(1); Mo(1); Zr(1); Hf(1); Pr(1); W(1); Pm(1); Os(1); Eu(1); Pt(1); Dy(1); Pa(1); Er(1); Np(1); Yb(1); Am(1); Cd(1); Cf(1); Fm(1); Ac(1); Co(1); Ir(1); Rh(1); Gd(1); Lu(1); Cm(1)...) structure #148.
Warning (Metal was disconnected; Proton(s) added/removed) structure #149.
Warning (Metal was disconnected) structure #150.
Warning (Metal was disconnected) structure #151.
Warning (Metal was disconnected; Proton(s) added/removed) structure #152.
Warning (Metal was disconnected) structure #153.
Warning (Metal was disconnected) structure #154.
Warning (Metal was disconnected; Proton(s) added/removed) structure #155.
Warning (Metal was disconnected) structure #156.
Warning (Metal was disconnected; Proton(s) added/removed) structure #158.
Warning (Metal was disconnected) structure #159.
Warning (Metal was disconnected) structure #161.
Warning (Metal was disconnected) structure #162.
Warning (Metal was disconnected) structure #163.
Warning (Accepted unusual valence(s): Mn(1); Zn(1); B(1); Pd(1); Pt(1); Cd(1); Sc(1); Y(1); La(1); Ce(1); Tb(1); Th(1); Bk(1); Be(1); Mg(1); Ca(1); Sr(1); Ba(1); Ti(1); Zr(1); Hf(1); Pr(1); Dy(1); Pa(1); Cf(1); Al(1); Ga(1); In(1); V(1); Nb(1); Ta(1); Nd(1); Ho(1)) structure #165.
Warning (Accepted unusual valence(s): Ag(2); H(2); B(2); Li(2); Na(2); K(2); Rb(2); Cs(2); Sc(2); Y(2); La(2); Ce(2); Tb(2); Th(2); Bk(2); Ti(2); Zr(2); Hf(2); Pr(2); Dy(2); Pa(2); Cf(2); Al(2); Ga(2); In(2); Tl(2); Nb(2); Ta(2); Nd(2); Ho(2); U(2); Es(2); Fr(2)) structure #166.
Warning (Accepted unusual valence(s): Ag(3); H(3); Zn(3); Cu(3); Pd(3); Pt(3); Cd(3); Li(3); Na(3); K(3); Rb(3); Cs(3); Be(3); Mg(3); Ca(3); Sr(3); Ba(3); Zr(3); Hf(3); Ta(3); Fr(3); C(3); Si(3); Ge(3); Sn(3); Pb(3); Ra(3); Tc(3); Re(3); O(3); S(3); Se(3); Te(3)) structure #167.
Warning (Accepted unusual valence(s): Ag(4); H(4); Zn(4); Cu(4); B(4); Cd(4); Li(4); Na(4); K(4); Rb(4); Cs(4); Sc(4); Y(4); La(4); Be(4); Mg(4); Ca(4); Sr(4); Ba(4); Dy(4); Cf(4); Al(4); Ga(4); In(4); Tl(4); Nb(4); Ta(4); Nd(4); Ho(4); Es(4); Fr(4); Cr(4); Pm(4)) structure #168.
Warning (Charges were rearranged) structure #169.
Warning (Proton(s) added/removed; Charges neutralized) structure #170.
Warning (Metal was disconnected; Proton(s) added/removed; Ambiguous stereo: bond(s); Charges neutralized) structure #171.
Warning (Charges were rearranged) structure #175.
Warning (Charges were rearranged) structure #177.
Warning (Charges were rearranged) structure #178.
Warning (Charges were rearranged) structure #182.
Warning (Proton(s) added/removed) structure #186.
Warning (Proton(s) added/removed) structure #187.
Warning (Proton(s) added/removed) structure #188.
Warning (Proton(s) added/removed) structure #189.
Warning (Proton(s) added/removed) structure #190.
Warning (Proton(s) added/removed) structure #191.
Warning (Proton(s) added/removed) structure #194.
Warning (Proton(s) added/removed) structure #195.
Warning (Proton(s) added/removed) structure #196.
Warning (Proton(s) added/removed) structure #197.
Warning (Proton(s) added/removed) structure #198.
Warning (Proton(s) added/removed) structure #199.
Warning (Proton(s) added/removed) structure #205.
Warning (Proton(s) added/removed) structure #209.
Warning (Proton(s) added/removed) structure #213.
Warning (Proton(s) added/removed) structure #214.
Warning (Charges were rearranged; Proton(s) added/removed) structure #245.
Warning (Proton(s) added/removed) structure #246.
Warning (Proton(s) added/removed) structure #247.
Warning (Charges were rearranged) structure #248.
Warning (Charges were rearranged) structure #249.
Warning (Charges were rearranged) structure #250.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); Metal was disconnected) structure #251.
Warning (Charges were rearranged; Accepted unusual valence(s): V(6); Metal was disconnected; Proton(s) added/removed) structure #252.
Warning (Accepted unusual valence(s): V(6); Metal was disconnected) structure #253.
Warning (Proton(s) added/removed) structure #254.
Warning (Proton(s) added/removed) structure #256.
Warning (Charges were rearranged; Accepted unusual valence(s): Cl-1(6); Sb(1); V(6); Metal was disconnected; Proton(s) added/removed) structure #257.
Warning (Charges were rearranged; Proton(s) added/removed) structure #258.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2); Metal was disconnected; Proton(s) added/removed) structure #259.
Warning (Charges were rearranged) structure #260.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #262.
Warning (Accepted unusual valence(s): O(4)) structure #263.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #264.
Warning (Accepted unusual valence(s): O(4)) structure #265.
Warning (Accepted unusual valence(s): O(4)) structure #266.
Warning (Charges were rearranged) structure #267.
Warning (Charges were rearranged) structure #268.
Warning (Charges were rearranged) structure #269.
Warning (Charges were rearranged) structure #270.
Warning (Charges were rearranged) structure #275.
Warning (Charges were rearranged) structure #276.
Warning (Charges were rearranged) structure #277.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #281.
Warning (Accepted unusual valence(s): O(4)) structure #282.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #283.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #284.
Warning (Accepted unusual valence(s): O(4)) structure #285.
Warning (Charges were rearranged) structure #286.
Warning (Charges were rearranged) structure #287.
Warning (Charges were rearranged) structure #288.
Warning (Charges were rearranged) structure #289.
Warning (Charges were rearranged) structure #290.
Warning (Charges were rearranged) structure #291.
Warning (Charges were rearranged) structure #292.
Warning (Charges were rearranged) structure #293.
Warning (Charges were rearranged) structure #294.
Warning (Charges were rearranged) structure #295.
Warning (Charges were rearranged) structure #296.
Warning (Charges were rearranged) structure #297.
Warning (Charges were rearranged) structure #298.
Warning (Charges were rearranged) structure #299.
Warning (Charges were rearranged) structure #300.
Warning (Charges were rearranged) structure #301.
Warning (Charges were rearranged) structure #302.
Warning (Charges were rearranged) structure #303.
Warning (Charges were rearranged) structure #304.
Warning (Charges were rearranged) structure #305.
Warning (Charges were rearranged) structure #306.
Warning (Charges were rearranged) structure #307.
Warning (Charges were rearranged) structure #308.
Warning (Charges were rearranged) structure #309.
Warning (Charges were rearranged) structure #310.
Warning (Charges were rearranged) structure #311.
Warning (Charges were rearranged; Metal was disconnected) structure #312.
Warning (Charges were rearranged) structure #313.
Warning (Charges were rearranged; Metal was disconnected) structure #314.
Warning (Charges were rearranged; Metal was disconnected) structure #315.
Warning (Charges were rearranged; Metal was disconnected) structure #316.
Warning (Charges were rearranged; Metal was disconnected) structure #317.
Warning (Charges were rearranged; Metal was disconnected) structure #318.
Warning (Charges were rearranged; Metal was disconnected) structure #319.
Warning (Charges were rearranged; Metal was disconnected) structure #320.
Warning (Charges were rearranged) structure #321.
Warning (Charges were rearranged) structure #322.
Warning (Metal was disconnected) structure #323.
Warning (Metal was disconnected) structure #324.
Warning (Charges were rearranged; Metal was disconnected) structure #325.
Warning (Charges were rearranged; Metal was disconnected) structure #326.
Warning (Charges were rearranged; Metal was disconnected) structure #327.
Warning (Charges were rearranged; Metal was disconnected) structure #328.
Warning (Charges were rearranged; Metal was disconnected) structure #329.
Warning (Charges were rearranged; Metal was disconnected) structure #330.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #331.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #332.
Warning (Accepted unusual valence(s): O(4)) structure #333.
Warning (Charges were rearranged) structure #334.
Warning (Charges were rearranged) structure #336.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #337.
Warning (Accepted unusual valence(s): O(4)) structure #338.
Warning (Charges were rearranged) structure #339.
Warning (Charges were rearranged) structure #341.
Warning (Charges were rearranged) structure #343.
Warning (Charges were rearranged) structure #345.
Warning (Charges were rearranged) structure #347.
Warning (Charges were rearranged) structure #349.
Warning (Charges were rearranged) structure #351.
Warning (Charges were rearranged) structure #352.
Warning (Charges were rearranged) structure #353.
Warning (Charges were rearranged) structure #354.
Warning (Charges were rearranged) structure #355.
Warning (Charges were rearranged) structure #356.
Warning (Charges were rearranged) structure #357.
Warning (Charges were rearranged) structure #358.
Warning (Charges were rearranged) structure #359.
Warning (Charges were rearranged) structure #360.
Warning (Charges were rearranged) structure #361.
Warning (Charges were rearranged) structure #362.
Warning (Charges were rearranged) structure #363.
Warning (Charges were rearranged) structure #364.
Warning (Charges were rearranged) structure #365.
Warning (Charges were rearranged) structure #366.
Warning (Charges were rearranged) structure #367.
Warning (Charges were rearranged) structure #368.
Warning (Charges were rearranged) structure #369.
Warning (Charges were rearranged) structure #370.
Warning (Charges were rearranged; Metal was disconnected) structure #371.
Warning (Charges were rearranged; Metal was disconnected) structure #372.
Warning (Charges were rearranged; Metal was disconnected) structure #373.
Warning (Charges were rearranged; Metal was disconnected) structure #374.
Warning (Charges were rearranged; Metal was disconnected) structure #375.
Warning (Charges were rearranged; Metal was disconnected) structure #376.
Warning (Charges were rearranged; Metal was disconnected) structure #377.
Warning (Charges were rearranged; Metal was disconnected) structure #378.
Warning (Metal was disconnected) structure #379.
Warning (Metal was disconnected) structure #380.
Warning (Charges were rearranged) structure #381.
Warning (Charges were rearranged) structure #382.
Warning (Charges were rearranged) structure #384.
Warning (Charges were rearranged) structure #385.
Warning (Charges were rearranged; Metal was disconnected) structure #386.
Warning (Charges were rearranged) structure #388.
Warning (Charges were rearranged) structure #389.
Warning (Charges were rearranged; Metal was disconnected) structure #390.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Metal was disconnected) structure #391.
Warning (Accepted unusual valence(s): Si(2)) structure #392.
Warning (Accepted unusual valence(s): C(2); Metal was disconnected) structure #398.
Warning (Metal was disconnected) structure #399.
Warning (Metal was disconnected) structure #400.
Warning (Metal was disconnected) structure #401.
Warning (Metal was disconnected) structure #402.
Warning (Metal was disconnected) structure #403.
Warning (Accepted unusual valence(s): Si(2); C(2); Metal was disconnected) structure #404.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #405.
Warning (Charges were rearranged; Proton(s) added/removed) structure #406.
Warning (Metal was disconnected; Proton(s) added/removed) structure #407.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #408.
Warning (Charges were rearranged; Proton(s) added/removed) structure #409.
Warning (Metal was disconnected; Proton(s) added/removed) structure #410.
Warning (Accepted unusual valence(s): N(4); As(4); Proton(s) added/removed) structure #411.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Proton(s) added/removed) structure #412.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #413.
Warning (Metal was disconnected; Proton(s) added/removed) structure #414.
Warning (Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #415.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #416.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Proton(s) added/removed) structure #417.
Warning (Accepted unusual valence(s): S(8); Se(8); Te(8); Po(8); Metal was disconnected; Charges were rearranged; Proton(s) added/removed) structure #418.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #419.
Warning (Charges were rearranged) structure #430.
Warning (Charges were rearranged) structure #432.
Warning (Charges were rearranged) structure #433.
Warning (Charges were rearranged) structure #434.
Warning (Charges were rearranged) structure #436.
Warning (Charges were rearranged) structure #437.
Warning (Charges were rearranged) structure #439.
Warning (Charges were rearranged) structure #441.
Warning (Charges were rearranged) structure #443.
Warning (Charges were rearranged) structure #444.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #445.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #446.
Warning (Ambiguous stereo: center(s)) structure #448.
Warning (Ambiguous stereo: center(s)) structure #453.
Warning (Ambiguous stereo: center(s)) structure #454.
Warning (Ambiguous stereo: center(s)) structure #455.
Warning (Ambiguous stereo: center(s)) structure #456.
Warning (Ambiguous stereo: center(s)) structure #459.
Warning (Ambiguous stereo: center(s)) structure #460.
Warning (Ambiguous stereo: center(s)) structure #461.
Warning (Ambiguous stereo: center(s)) structure #462.
Warning (Ambiguous stereo: center(s)) structure #465.
Warning (Ambiguous stereo: center(s)) structure #466.
Warning (Ambiguous stereo: center(s)) structure #468.
Warning (Ambiguous stereo: center(s)) structure #469.
Warning (Ambiguous stereo: center(s)) structure #471.
Warning (Ambiguous stereo: center(s)) structure #473.
Warning (Ambiguous stereo: center(s)) structure #475.
Warning (Ambiguous stereo: center(s)) structure #476.
Warning (Ambiguous stereo: center(s)) structure #477.
Warning (Ambiguous stereo: center(s)) structure #479.
Warning (Ambiguous stereo: center(s)) structure #481.
Warning (Ambiguous stereo: center(s)) structure #482.
Warning (Ambiguous stereo: center(s)) structure #483.
Warning (Ambiguous stereo: center(s)) structure #489.
Warning (Ambiguous stereo: center(s)) structure #495.
Warning (Ambiguous stereo: center(s)) structure #496.
Warning (Proton(s) added/removed) structure #497.
Warning (Proton(s) added/removed) structure #498.
Warning (Charges were rearranged) structure #503.
Warning (Accepted unusual valence(s): C(5)) structure #504.
Warning (Proton(s) added/removed) structure #505.
Warning (Accepted unusual valence(s): C(5); Ni(7); Metal was disconnected) structure #510.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #513.
Warning (Proton(s) added/removed) structure #521.
Warning (Proton(s) added/removed) structure #522.
Warning (Metal was disconnected) structure #523.
Warning (Ambiguous stereo: center(s)) structure #537.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #539.
Warning (Accepted unusual valence(s): C(5); Fe(10); C,d(4); Metal was disconnected) structure #540.
Warning (Accepted unusual valence(s): Fe(11); Fe(12); Metal was disconnected) structure #541.
Warning (Charges were rearranged) structure #542.
Warning (Charges neutralized) structure #543.
Warning (Metal was disconnected) structure #587.
Warning (Accepted unusual valence(s): C(12)) structure #588.
Warning (Ambiguous stereo: center(s)) structure #590.
Warning (Proton(s) added/removed) structure #591.
Warning (Proton(s) added/removed) structure #592.
Warning (Proton(s) added/removed) structure #593.
Warning (Proton(s) added/removed) structure #594.
Warning (Proton(s) added/removed) structure #596.
Warning (Proton(s) added/removed) structure #597.
Warning (Proton(s) added/removed) structure #598.
Warning (Metal was disconnected) structure #599.
Warning (Proton(s) added/removed) structure #600.
Warning (Ambiguous stereo: center(s)) structure #602.
Warning (Proton(s) added/removed) structure #604.
Warning (Proton(s) added/removed) structure #605.
Warning (Proton(s) added/removed) structure #606.
Warning (Proton(s) added/removed) structure #607.
Warning (Proton(s) added/removed) structure #610.
Warning (Proton(s) added/removed) structure #611.
Warning (Proton(s) added/removed) structure #613.
Warning (Proton(s) added/removed) structure #614.
Warning (Proton(s) added/removed) structure #615.
Warning (Proton(s) added/removed) structure #617.
Warning (Proton(s) added/removed) structure #618.
Warning (Proton(s) added/removed) structure #619.
Warning (Proton(s) added/removed) structure #620.
Warning (Proton(s) added/removed) structure #621.
Warning (Proton(s) added/removed) structure #622.
Warning (Proton(s) added/removed) structure #623.
Warning (Proton(s) added/removed) structure #624.
Warning (Proton(s) added/removed) structure #625.
Warning (Proton(s) added/removed) structure #626.
Warning (Proton(s) added/removed) structure #627.
Warning (Proton(s) added/removed) structure #628.
Warning (Proton(s) added/removed) structure #629.
Warning (Proton(s) added/removed) structure #630.
Warning (Proton(s) added/removed) structure #631.
Warning (Proton(s) added/removed) structure #632.
Warning (Proton(s) added/removed) structure #633.
Warning (Proton(s) added/removed) structure #634.
Warning (Proton(s) added/removed) structure #635.
Warning (Proton(s) added/removed) structure #636.
Warning (Proton(s) added/removed) structure #637.
Warning (Proton(s) added/removed) structure #638.
Warning (Charges were rearranged; Proton(s) added/removed; Not chiral) structure #647.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #649.
Warning (Proton(s) added/removed) structure #651.
Warning (Ambiguous stereo: bond(s); center(s)) structure #660.
Warning (Ambiguous stereo: bond(s); center(s)) structure #661.
Warning (Charges were rearranged) structure #663.
Warning (Ambiguous stereo: center(s)) structure #672.
Warning (Accepted unusual valence(s): C(5)) structure #673.
Warning (Accepted unusual valence(s): C(5); Ambiguous stereo: center(s)) structure #675.
Warning (Salt was disconnected; Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #679.
Warning (Accepted unusual valence(s): C,d(1)) structure #682.
Warning (Ambiguous stereo: center(s)) structure #684.
Warning (Charges were rearranged; Proton(s) added/removed) structure #687.
Warning (Proton(s) added/removed) structure #688.
Warning (Proton(s) added/removed) structure #689.
Warning (Proton(s) added/removed) structure #690.
Warning (Proton(s) added/removed) structure #691.
Warning (Proton(s) added/removed) structure #692.
Warning (Proton(s) added/removed) structure #693.
Warning (Proton(s) added/removed) structure #694.
Warning (Proton(s) added/removed) structure #695.
Warning (Proton(s) added/removed) structure #696.
Warning (Charges neutralized) structure #697.
Warning (Proton(s) added/removed) structure #698.
Warning (Proton(s) added/removed) structure #699.
Warning (Proton(s) added/removed) structure #700.
Warning (Proton(s) added/removed) structure #701.
Warning (Proton(s) added/removed) structure #702.
Warning (Proton(s) added/removed) structure #703.
Warning (Proton(s) added/removed) structure #704.
Warning (Proton(s) added/removed) structure #705.
Warning (Proton(s) added/removed) structure #706.
Warning (Charges were rearranged) structure #709.
Warning (Charges were rearranged; Proton(s) added/removed) structure #710.
Warning (Charges were rearranged; Proton(s) added/removed) structure #711.
Warning (Charges were rearranged; Proton(s) added/removed) structure #712.
Warning (Proton(s) added/removed) structure #719.
Warning (Proton(s) added/removed) structure #720.
Warning (Proton(s) added/removed) structure #725.
Warning (Metal was disconnected; Proton(s) added/removed) structure #726.
Warning (Metal was disconnected; Proton(s) added/removed) structure #727.
Warning (Metal was disconnected; Proton(s) added/removed) structure #728.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #729.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #730.
Warning (Accepted unusual valence(s): Co-1(7); N(4); Metal was disconnected; Proton(s) added/removed) structure #731.
Warning (Proton(s) added/removed) structure #734.
Warning (Accepted unusual valence(s): C(5); Co(8); S(3); B(6); B(5); H(2); Metal was disconnected) structure #738.
Warning (Accepted unusual valence(s): B(6); B(5); H(2); Metal was disconnected) structure #739.
Warning (Metal was disconnected; Proton(s) added/removed) structure #740.
Warning (Proton(s) added/removed) structure #742.
Warning (Ambiguous stereo: bond(s)) structure #744.
Warning (Accepted unusual valence(s): C(5); O,t(2); C+2(3); C,t(3); N+1(3); O-2(2)) structure #745.
Warning (Accepted unusual valence(s): C(5); O,t(2); C,t(3); C+2(3); N+1(3); O-2(2)) structure #746.
Warning (Accepted unusual valence(s): C(5)) structure #747.
Warning (Accepted unusual valence(s): C(5)) structure #748.
Warning (Accepted unusual valence(s): C(5)) structure #749.
Warning (Accepted unusual valence(s): C(5)) structure #750.
Warning (Accepted unusual valence(s): C(5)) structure #751.
Warning (Accepted unusual valence(s): C(5)) structure #752.
Warning (Accepted unusual valence(s): C(5)) structure #753.
Warning (Proton(s) added/removed) structure #761.
Warning (Ambiguous stereo: center(s)) structure #762.
Warning (Ambiguous stereo: center(s)) structure #763.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4)) structure #769.
Warning (Ambiguous stereo: center(s)) structure #770.
Warning (Accepted unusual valence(s): C-1(4); N-1(3); N(4); Ambiguous stereo: center(s)) structure #771.
Warning (Proton(s) added/removed) structure #773.
Warning (Accepted unusual valence(s): H(2)) structure #775.
Warning (Accepted unusual valence(s): N(4)) structure #796.
Warning (Accepted unusual valence(s): O(1)) structure #797.
Warning (Accepted unusual valence(s): N(4); O(1)) structure #798.
Warning (Salt was disconnected) structure #801.
Warning (Proton(s) added/removed) structure #802.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #804.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #805.
Warning (Proton(s) added/removed) structure #812.
Warning (Proton(s) added/removed) structure #813.
Warning (Proton(s) added/removed) structure #814.
Warning (Proton(s) added/removed) structure #815.
Warning (Proton(s) added/removed) structure #816.
Warning (Proton(s) added/removed) structure #817.
Warning (Proton(s) added/removed) structure #818.
Warning (Accepted unusual valence(s): H(2)) structure #827.
Warning (Proton(s) added/removed) structure #829.
Warning (Proton(s) added/removed) structure #830.
Warning (Proton(s) added/removed) structure #832.
Warning (Proton(s) added/removed) structure #833.
Warning (Proton(s) added/removed) structure #834.
Warning (Proton(s) added/removed) structure #835.
Warning (Accepted unusual valence(s): Dy(1); Metal was disconnected) structure #836.
Warning (Accepted unusual valence(s): C(5)) structure #837.
Warning (Proton(s) added/removed) structure #839.
Warning (Proton(s) added/removed) structure #840.
Warning (Proton(s) added/removed) structure #841.
Warning (Proton(s) added/removed) structure #842.
Warning (Proton(s) added/removed) structure #843.
Warning (Proton(s) added/removed) structure #846.
Warning (Charges were rearranged; Proton(s) added/removed) structure #847.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #851.
Warning (Accepted unusual valence(s): C-1,d(4)) structure #852.
Warning (Accepted unusual valence(s): C(3); O(1)) structure #854.
Warning (Accepted unusual valence(s): C(5)) structure #856.
Warning (Accepted unusual valence(s): O(3)) structure #857.
Warning (Accepted unusual valence(s): C(5); O(3)) structure #859.
Warning (Accepted unusual valence(s): C(3)) structure #862.
Warning (Accepted unusual valence(s): S(3)) structure #863.
Warning (Accepted unusual valence(s): C(3); S(3)) structure #864.
Warning (Accepted unusual valence(s): S(3)) structure #867.
Warning (Accepted unusual valence(s): S(3)) structure #870.
Warning (Proton(s) added/removed) structure #871.
Warning (Proton(s) added/removed) structure #872.
Warning (Proton(s) added/removed) structure #873.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected; Charges neutralized; Proton(s) added/removed) structure #874.
Warning (Accepted unusual valence(s): C(3)) structure #880.
Warning (Not chiral) structure #881.
Warning (Proton(s) added/removed) structure #883.
Warning (Proton(s) added/removed) structure #887.
Warning (Proton(s) added/removed) structure #888.
Warning (Accepted unusual valence(s): C(3)) structure #898.
Warning (Metal was disconnected) structure #900.
Warning (Metal was disconnected; Proton(s) added/removed) structure #901.
Warning (Metal was disconnected) structure #902.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #903.
Warning (Accepted unusual valence(s): C(5); C-1(4); Metal was disconnected) structure #904.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected) structure #905.
Warning (Accepted unusual valence(s): C-1(5); Fe(10); Metal was disconnected) structure #906.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #907.
Warning (Accepted unusual valence(s): C(3); C-1(2)) structure #908.
Warning (Accepted unusual valence(s): Fe(9); Metal was disconnected) structure #913.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #914.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #915.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #916.
Warning (Accepted unusual valence(s): S(7); N(4)) structure #941.
Warning (Charges were rearranged) structure #953.
Warning (Proton(s) added/removed) structure #956.
Warning (Proton(s) added/removed) structure #958.
Warning (Proton(s) added/removed) structure #959.
Warning (Proton(s) added/removed) structure #961.
Warning (Accepted unusual valence(s): B(4); H(2)) structure #965.
Warning (Proton(s) added/removed) structure #971.
Warning (Proton(s) added/removed) structure #973.
Warning (Proton(s) added/removed) structure #974.
Warning (Proton(s) added/removed) structure #975.
Warning (Proton(s) added/removed) structure #976.
Warning (Salt was disconnected; Accepted unusual valence(s): C(2); Ag(2); Metal was disconnected; Proton(s) added/removed) structure #977.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #978.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #979.
Warning (Proton(s) added/removed) structure #980.
Warning (Charges were rearranged; Proton(s) added/removed) structure #981.
Warning (Charges were rearranged) structure #983.
Warning (Charges were rearranged; Proton(s) added/removed) structure #984.
Warning (Charges were rearranged) structure #989.
Warning (Proton(s) added/removed) structure #991.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #992.
Warning (Accepted unusual valence(s): C(6); Metal was disconnected) structure #993.
Error 78 (no InChI; Unacceptable isotope of hydrogen) inp structure #995.
Warning (Proton(s) added/removed) structure #1005.
Warning (Proton(s) added/removed) structure #1006.
Warning (Accepted unusual valence(s): Ni(7); Metal was disconnected) structure #1011.
Warning (Ambiguous stereo: center(s)) structure #1012.
Warning (Metal was disconnected) structure #1013.
Warning (Ambiguous stereo: center(s)) structure #1014.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1017.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1018.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1019.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1020.
Warning (Not chiral) structure #1022.
Warning (Proton(s) added/removed; Not chiral) structure #1027.
Warning (Proton(s) added/removed; Not chiral) structure #1028.
Warning (Proton(s) added/removed; Not chiral) structure #1029.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1032.
Warning (Proton(s) added/removed) structure #1033.
Warning (Not chiral) structure #1037.
Warning (Not chiral) structure #1039.
Warning (Proton(s) added/removed; Not chiral) structure #1044.
Warning (Not chiral) structure #1045.
Warning (Proton(s) added/removed; Not chiral) structure #1047.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1049.
Warning (Proton(s) added/removed; Not chiral) structure #1050.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1051.
Warning (Proton(s) added/removed; Not chiral) structure #1052.
Warning (Not chiral) structure #1053.
Warning (Proton(s) added/removed; Not chiral) structure #1054.
Warning (Not chiral) structure #1055.
Warning (Not chiral) structure #1056.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1057.
Warning (Charges were rearranged; Ambiguous stereo: center(s)) structure #1058.
Warning (Not chiral) structure #1059.
Warning (Not chiral) structure #1060.
Warning (Proton(s) added/removed; Not chiral) structure #1062.
Warning (Not chiral) structure #1064.
Warning (Not chiral) structure #1065.
Warning (Not chiral) structure #1066.
Warning (Not chiral) structure #1067.
Warning (Not chiral) structure #1068.
Warning (Not chiral) structure #1069.
Warning (Proton(s) added/removed; Not chiral) structure #1070.
Warning (Ambiguous stereo: center(s)) structure #1071.
Warning (Ambiguous stereo: center(s)) structure #1073.
Warning (Ambiguous stereo: center(s)) structure #1074.
Warning (Ambiguous stereo: center(s)) structure #1075.
Warning (Ambiguous stereo: center(s)) structure #1076.
Warning (Not chiral) structure #1081.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1083.
Warning (Ambiguous stereo: center(s)) structure #1084.
Warning (Not chiral) structure #1085.
Warning (Not chiral) structure #1086.
Warning (Ambiguous stereo: center(s)) structure #1087.
Warning (Proton(s) added/removed) structure #1088.
Warning (Proton(s) added/removed) structure #1090.
Warning (Proton(s) added/removed) structure #1091.
Warning (Proton(s) added/removed) structure #1092.
Warning (Proton(s) added/removed) structure #1094.
Warning (Proton(s) added/removed) structure #1096.
Warning (Proton(s) added/removed) structure #1098.
Warning (Proton(s) added/removed) structure #1100.
Warning (Proton(s) added/removed) structure #1101.
Warning (Proton(s) added/removed) structure #1103.
Warning (Proton(s) added/removed) structure #1104.
Warning (Proton(s) added/removed) structure #1106.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected) structure #1109.
Warning (Proton(s) added/removed) structure #1111.
Warning (Accepted unusual valence(s): H(2)) structure #1114.
Warning (Proton(s) added/removed; Ambiguous stereo: bond(s)) structure #1115.
Warning (Proton(s) added/removed) structure #1116.
Warning (Proton(s) added/removed) structure #1117.
Warning (Proton(s) added/removed) structure #1118.
Warning (Proton(s) added/removed) structure #1119.
Warning (Accepted unusual valence(s): C(2); C(3); O(1); N(1); Proton(s) added/removed) structure #1120.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s)) structure #1121.
Warning (Accepted unusual valence(s): Fe(10); Ni(10); Metal was disconnected) structure #1122.
Warning (Proton(s) added/removed) structure #1123.
Warning (Proton(s) added/removed) structure #1124.
Warning (Proton(s) added/removed) structure #1125.
Warning (Proton(s) added/removed) structure #1126.
Warning (Proton(s) added/removed) structure #1127.
Warning (Charges were rearranged) structure #1128.
Warning (Proton(s) added/removed) structure #1129.
Warning (Proton(s) added/removed) structure #1130.
Warning (Proton(s) added/removed) structure #1131.
Warning (Charges were rearranged) structure #1133.
Warning (Charges were rearranged) structure #1134.
Warning (Proton(s) added/removed) structure #1135.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1142.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1143.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1144.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1145.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1146.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1147.
Warning (Charges were rearranged; Salt was disconnected; Proton(s) added/removed) structure #1148.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1149.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1157.
Warning (Charges were rearranged; Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1158.
Warning (Proton(s) added/removed) structure #1159.
Warning (Proton(s) added/removed) structure #1160.
Warning (Proton(s) added/removed) structure #1162.
Warning (Proton(s) added/removed) structure #1163.
Warning (Proton(s) added/removed) structure #1164.
Warning (Metal was disconnected) structure #1166.
Warning (Charges were rearranged) structure #1168.
Warning (Charges were rearranged) structure #1170.
Warning (Charges were rearranged) structure #1174.
Warning (Charges were rearranged) structure #1176.
Warning (Charges were rearranged) structure #1178.
Warning (Charges were rearranged) structure #1180.
Warning (Proton(s) added/removed) structure #1189.
Warning (Proton(s) added/removed) structure #1190.
Warning (Proton(s) added/removed) structure #1191.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1193.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1194.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1195.
Warning (Charges were rearranged) structure #1197.
Warning (Charges were rearranged) structure #1198.
Warning (Salt was disconnected) structure #1213.
Warning (Charges were rearranged; Accepted unusual valence(s): C(3)) structure #1215.
Warning (Charges were rearranged) structure #1216.
Warning (Charges were rearranged) structure #1217.
Warning (Charges were rearranged) structure #1218.
Warning (Proton(s) added/removed) structure #1220.
Warning (Proton(s) added/removed) structure #1221.
Warning (Charges were rearranged) structure #1222.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1223.
Warning (Proton(s) added/removed) structure #1225.
Warning (Proton(s) added/removed) structure #1226.
Warning (Ambiguous stereo: center(s)) structure #1231.
Warning (Charges were rearranged) structure #1236.
Warning (Accepted unusual valence(s): N-1(4)) structure #1237.
Warning (Metal was disconnected) structure #1238.
Warning (Proton(s) added/removed) structure #1239.
Warning (Proton(s) added/removed) structure #1240.
Warning (Proton(s) added/removed) structure #1241.
Warning (Proton(s) added/removed) structure #1243.
Warning (Accepted unusual valence(s): N(4); B(4)) structure #1247.
Warning (Accepted unusual valence(s): B(4); N(4)) structure #1248.
Warning (Charges were rearranged; Metal was disconnected) structure #1250.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1251.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1252.
Warning (Accepted unusual valence(s): Fe,d(11); Metal was disconnected) structure #1253.
Warning (Charges were rearranged; Metal was disconnected) structure #1254.
Warning (Accepted unusual valence(s): N(4); Metal was disconnected; Proton(s) added/removed) structure #1258.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1259.
Warning (Charges were rearranged; Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1260.
Warning (Accepted unusual valence(s): Mo(8); C,d(5); Metal was disconnected) structure #1261.
Warning (Metal was disconnected) structure #1262.
Warning (Accepted unusual valence(s): W(9); C(5); Metal was disconnected) structure #1263.
Warning (Accepted unusual valence(s): B(4)) structure #1265.
Warning (Metal was disconnected) structure #1268.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1269.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1270.
Warning (Accepted unusual valence(s): Cu(4); Metal was disconnected; Proton(s) added/removed) structure #1271.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1273.
Warning (Charges were rearranged) structure #1274.
Warning (Proton(s) added/removed) structure #1275.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1276.
Warning (Charges were rearranged) structure #1280.
Warning (Charges were rearranged) structure #1281.
Warning (Charges were rearranged) structure #1289.
Warning (Charges were rearranged; Accepted unusual valence(s): Ni(4); Metal was disconnected) structure #1291.
Warning (Charges were rearranged; Metal was disconnected) structure #1293.
Warning (Accepted unusual valence(s): Rh(5); Metal was disconnected; Proton(s) added/removed) structure #1294.
Warning (Accepted unusual valence(s): C(5); Cr(9); C-1(4); Metal was disconnected) structure #1295.
Warning (Accepted unusual valence(s): C(5)) structure #1308.
Warning (Ambiguous stereo: center(s)) structure #1309.
Warning (Accepted unusual valence(s): Co,d(6); Metal was disconnected) structure #1310.
Warning (Accepted unusual valence(s): N(4)) structure #1311.
Warning (Proton(s) added/removed) structure #1314.
Warning (Proton(s) added/removed) structure #1315.
Warning (Proton(s) added/removed) structure #1317.
Warning (Accepted unusual valence(s): Fe(10); Metal was disconnected) structure #1318.
Warning (Proton(s) added/removed) structure #1319.
Warning (Accepted unusual valence(s): Mo(9); Metal was disconnected) structure #1322.
Warning (Metal was disconnected) structure #1323.
Warning (Metal was disconnected) structure #1324.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1327.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1328.
Warning (Accepted unusual valence(s): Rh(9); Metal was disconnected) structure #1329.
Warning (Proton(s) added/removed) structure #1330.
Warning (Accepted unusual valence(s): B(5)) structure #1331.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1335.
Warning (Proton(s) added/removed) structure #1336.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1337.
Warning (Proton(s) added/removed) structure #1338.
Warning (Metal was disconnected) structure #1340.
Warning (Metal was disconnected) structure #1341.
Warning (Charges were rearranged; Accepted unusual valence(s): Co(6); Metal was disconnected) structure #1342.
Warning (Metal was disconnected) structure #1343.
Warning (Proton(s) added/removed) structure #1345.
Warning (Charges were rearranged) structure #1348.
Warning (Proton(s) added/removed) structure #1352.
Warning (Proton(s) added/removed) structure #1353.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected) structure #1355.
Warning (Charges were rearranged; Metal was disconnected; Ambiguous stereo: bond(s)) structure #1356.
Warning (Proton(s) added/removed) structure #1358.
Warning (Ambiguous stereo: center(s)) structure #1359.
Warning (Accepted unusual valence(s): Cu(6); Metal was disconnected; Proton(s) added/removed) structure #1361.
Warning (Accepted unusual valence(s): N(4); O(3); Metal was disconnected; Proton(s) added/removed) structure #1363.
Warning (Accepted unusual valence(s): Co(6); Metal was disconnected; Proton(s) added/removed) structure #1365.
Warning (Charges were rearranged) structure #1366.
Warning (Accepted unusual valence(s): Ti(6); Metal was disconnected; Proton(s) added/removed) structure #1371.
Warning (Accepted unusual valence(s): O(3); Metal was disconnected) structure #1372.
Warning (Accepted unusual valence(s): N(4); Proton(s) added/removed) structure #1374.
Warning (Accepted unusual valence(s): B-2(5)) structure #1378.
Warning (Accepted unusual valence(s): Ni(6); Metal was disconnected) structure #1379.
Warning (Accepted unusual valence(s): S(8)) structure #1388.
Warning (Accepted unusual valence(s): S(8)) structure #1389.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1390.
Warning (Proton(s) added/removed) structure #1392.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1393.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1394.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1395.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1396.
Warning (Accepted unusual valence(s): S(3)) structure #1397.
Warning (Proton(s) added/removed) structure #1398.
Warning (Accepted unusual valence(s): C+1,d(4); Metal was disconnected) structure #1399.
Warning (Accepted unusual valence(s): C(6); Pt,d(7); C,d(5); Metal was disconnected) structure #1400.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1401.
Warning (Metal was disconnected) structure #1403.
Warning (Accepted unusual valence(s): C+1,d(4)) structure #1405.
Warning (Accepted unusual valence(s): S(3)) structure #1406.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1407.
Warning (Ambiguous stereo: center(s)) structure #1408.
Warning (Accepted unusual valence(s): S(3)) structure #1409.
Warning (Accepted unusual valence(s): S(3)) structure #1410.
Warning (Charges were rearranged; Metal was disconnected; Proton(s) added/removed) structure #1411.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1414.
Warning (Accepted unusual valence(s): C-1(5); Metal was disconnected; Proton(s) added/removed) structure #1416.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1417.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1418.
Warning (Ambiguous stereo: center(s)) structure #1421.
Warning (Proton(s) added/removed) structure #1434.
Warning (Proton(s) added/removed) structure #1435.
Warning (Accepted unusual valence(s): C(5); Fe(10); Metal was disconnected) structure #1440.
Warning (Accepted unusual valence(s): C-1,d(4); Metal was disconnected; Proton(s) added/removed) structure #1441.
Warning (Metal was disconnected) structure #1442.
Warning (Accepted unusual valence(s): C-1(4); C(5); B+2(4); Metal was disconnected) structure #1443.
Warning (Accepted unusual valence(s): C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1451.
Warning (Accepted unusual valence(s): N(4); C+1(4); Ambiguous stereo: center(s); Proton(s) added/removed) structure #1452.
Warning (Accepted unusual valence(s): C(5); Cr(12); Metal was disconnected) structure #1453.
Warning (Charges were rearranged) structure #1454.
Warning (Proton(s) added/removed) structure #1456.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1457.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1458.
Warning (Accepted unusual valence(s): C-2(4); Metal was disconnected) structure #1459.
Warning (Metal was disconnected) structure #1460.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1461.
Warning (Metal was disconnected) structure #1462.
Warning (Accepted unusual valence(s): Mo(10); Metal was disconnected; Proton(s) added/removed) structure #1463.
Warning (Charges were rearranged) structure #1464.
Warning (Charges were rearranged) structure #1466.
Warning (Proton(s) added/removed) structure #1467.
Warning (Accepted unusual valence(s): N(2)) structure #1469.
Warning (Accepted unusual valence(s): O(1); H(2)) structure #1472.
Warning (Accepted unusual valence(s): Zr(20); Metal was disconnected) structure #1473.
Warning (Ambiguous stereo: center(s)) structure #1474.
Warning (Not chiral) structure #1477.
Warning (Charges were rearranged) structure #1482.
Warning (Charges were rearranged) structure #1483.
Warning (Accepted unusual valence(s): N+1(2); N+1(3)) structure #1484.
Warning (Charges were rearranged) structure #1485.
Warning (Metal was disconnected) structure #1487.
Warning (Metal was disconnected) structure #1488.
Warning (Charges were rearranged) structure #1489.
Warning (Proton(s) added/removed) structure #1492.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1493.
Warning (Metal was disconnected) structure #1494.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1497.
Warning (Not chiral) structure #1498.
Warning (Proton(s) added/removed; Not chiral) structure #1499.
Warning (Charges neutralized) structure #1503.
Warning (Proton(s) added/removed) structure #1511.
Warning (Proton(s) added/removed) structure #1512.
Warning (Metal was disconnected) structure #1513.
Warning (Accepted unusual valence(s): N(7)) structure #1517.
Warning (Accepted unusual valence(s): N+1(7)) structure #1518.
Warning (Charges were rearranged) structure #1531.
Warning (Charges were rearranged) structure #1564.
Warning (Accepted unusual valence(s): C(5)) structure #1571.
Warning (Ambiguous stereo: center(s)) structure #1579.
Warning (Ambiguous stereo: center(s)) structure #1580.
Warning (Ambiguous stereo: center(s)) structure #1581.
Warning (Ambiguous stereo: center(s)) structure #1582.
Warning (Ambiguous stereo: center(s)) structure #1583.
Warning (Ambiguous stereo: center(s)) structure #1584.
Warning (Proton(s) added/removed) structure #1587.
Warning (Ambiguous stereo: center(s)) structure #1588.
Warning (Ambiguous stereo: center(s)) structure #1589.
Warning (Proton(s) added/removed) structure #1590.
Warning (Proton(s) added/removed) structure #1591.
Warning (Proton(s) added/removed) structure #1593.
Warning (Proton(s) added/removed) structure #1594.
Warning (Proton(s) added/removed) structure #1596.
Warning (Proton(s) added/removed) structure #1607.
Warning (Charges were rearranged; Accepted unusual valence(s): S(3); Proton(s) added/removed) structure #1608.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1609.
Warning (Charges were rearranged) structure #1611.
Warning (Accepted unusual valence(s): S(8)) structure #1615.
Warning (Accepted unusual valence(s): N-1,t(2)) structure #1616.
Warning (Metal was disconnected; Charges neutralized) structure #1623.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1624.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1625.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1626.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1627.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1628.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1629.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1630.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1631.
Warning (Proton(s) added/removed) structure #1634.
Warning (Ambiguous stereo: center(s)) structure #1659.
Warning (Metal was disconnected) structure #1667.
Warning (Ambiguous stereo: bond(s)) structure #1668.
Warning (Accepted unusual valence(s): N+1(2); N(2)) structure #1669.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1677.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1678.
Warning (Ambiguous stereo: center(s)) structure #1679.
Warning (Ambiguous stereo: center(s)) structure #1681.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1685.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected) structure #1687.
Warning (Ambiguous stereo: center(s)) structure #1690.
Warning (Ambiguous stereo: center(s)) structure #1691.
Warning (Ambiguous stereo: center(s)) structure #1693.
Warning (Ambiguous stereo: center(s)) structure #1698.
Warning (Accepted unusual valence(s): La(4); Metal was disconnected; Ambiguous stereo: center(s)) structure #1699.
Warning (Metal was disconnected) structure #1700.
Warning (Ambiguous stereo: center(s)) structure #1713.
Warning (Ambiguous stereo: center(s)) structure #1714.
Warning (Ambiguous stereo: center(s)) structure #1715.
Warning (Ambiguous stereo: center(s)) structure #1716.
Warning (Ambiguous stereo: center(s)) structure #1717.
Warning (Ambiguous stereo: center(s)) structure #1719.
Warning (Ambiguous stereo: center(s)) structure #1720.
Warning (Ambiguous stereo: center(s)) structure #1721.
Warning (Ambiguous stereo: center(s)) structure #1722.
Warning (Ambiguous stereo: center(s)) structure #1724.
Warning (Ambiguous stereo: center(s)) structure #1725.
Warning (Proton(s) added/removed; Ambiguous stereo: center(s); bond(s)) structure #1727.
Warning (Ambiguous stereo: center(s)) structure #1750.
Warning (Ambiguous stereo: center(s)) structure #1751.
Warning (Ambiguous stereo: center(s)) structure #1752.
Warning (Ambiguous stereo: center(s)) structure #1753.
Warning (Ambiguous stereo: center(s)) structure #1754.
Warning (Ambiguous stereo: center(s)) structure #1755.
Warning (Ambiguous stereo: center(s)) structure #1756.
Warning (Ambiguous stereo: center(s)) structure #1757.
Warning (Ambiguous stereo: center(s)) structure #1758.
Warning (Ambiguous stereo: center(s)) structure #1759.
Warning (Accepted unusual valence(s): N+1(2); Proton(s) added/removed) structure #1775.
Warning (Proton(s) added/removed) structure #1776.
Warning (Proton(s) added/removed) structure #1777.
Warning (Proton(s) added/removed) structure #1778.
Warning (Proton(s) added/removed) structure #1779.
Warning (Proton(s) added/removed) structure #1781.
Warning (Proton(s) added/removed) structure #1782.
Warning (Proton(s) added/removed) structure #1783.
Warning (Proton(s) added/removed) structure #1784.
Warning (Proton(s) added/removed) structure #1785.
Warning (Proton(s) added/removed) structure #1788.
Warning (Proton(s) added/removed) structure #1789.
Warning (Proton(s) added/removed) structure #1790.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1792.
Warning (Accepted unusual valence(s): Co(1); Metal was disconnected) structure #1793.
Warning (Charges were rearranged) structure #1794.
Warning (Charges were rearranged) structure #1797.
Warning (Proton(s) added/removed) structure #1798.
Warning (Charges were rearranged) structure #1801.
Warning (Proton(s) added/removed) structure #1802.
Warning (Charges were rearranged; Ambiguous stereo: bond(s)) structure #1804.
Warning (Proton(s) added/removed) structure #1805.
Warning (Proton(s) added/removed) structure #1809.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1812.
Warning (Proton(s) added/removed) structure #1813.
Warning (Proton(s) added/removed) structure #1815.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1816.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1817.
Warning (Proton(s) added/removed) structure #1818.
Warning (Salt was disconnected; Metal was disconnected; Proton(s) added/removed) structure #1819.
Warning (Proton(s) added/removed) structure #1826.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1827.
Warning (Accepted unusual valence(s): C(5)) structure #1832.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1835.
Warning (Proton(s) added/removed) structure #1836.
Warning (Not chiral) structure #1838.
Warning (Proton(s) added/removed) structure #1839.
Warning (Accepted unusual valence(s): C(5)) structure #1840.
Warning (Proton(s) added/removed) structure #1851.
Warning (Proton(s) added/removed) structure #1856.
Warning (Proton(s) added/removed) structure #1877.
Warning (Accepted unusual valence(s): N(4); C(10)) structure #1892.
Warning (Charges were rearranged) structure #1894.
Warning (Accepted unusual valence(s): N,d(3)) structure #1901.
Warning (Accepted unusual valence(s): S(5)) structure #1906.
Warning (Accepted unusual valence(s): S(5)) structure #1907.
Warning (Accepted unusual valence(s): N+1(5); N,d(3)) structure #1912.
Warning (Accepted unusual valence(s): N+1(5)) structure #1913.
Warning (Proton(s) added/removed) structure #1918.
Warning (Proton(s) added/removed) structure #1919.
Warning (Proton(s) added/removed) structure #1920.
Warning (Charges were rearranged; Proton(s) added/removed) structure #1921.
Warning (Proton(s) added/removed) structure #1924.
Warning (Proton(s) added/removed) structure #1925.
Warning (Proton(s) added/removed) structure #1926.
Warning (Proton(s) added/removed) structure #1939.
Warning (Proton(s) added/removed) structure #1940.
Warning (Proton(s) added/removed) structure #1941.
Warning (Proton(s) added/removed) structure #1942.
Warning (Proton(s) added/removed) structure #1943.
Warning (Proton(s) added/removed) structure #1945.
Warning (Proton(s) added/removed) structure #1946.
Warning (Proton(s) added/removed) structure #1947.
Warning (Proton(s) added/removed) structure #1950.
Warning (Proton(s) added/removed) structure #1951.
Warning (Proton(s) added/removed) structure #1955.
Warning (Accepted unusual valence(s): C(3)) structure #1956.
Warning (Proton(s) added/removed) structure #1958.
Warning (Proton(s) added/removed) structure #1960.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1961.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1962.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1963.
Warning (Accepted unusual valence(s): C+1,t(2); C-1,t(3)) structure #1964.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1965.
Warning (Accepted unusual valence(s): C(5); C+1,t(2); C-1,t(3)) structure #1966.
Warning (Proton(s) added/removed) structure #1968.
Warning (Metal was disconnected; Proton(s) added/removed) structure #1971.
Warning (Accepted unusual valence(s): C,t(3); Metal was disconnected; Proton(s) added/removed) structure #1972.
Warning (Proton(s) added/removed) structure #1980.
Warning (Proton(s) added/removed) structure #1987.
Warning (Charges were rearranged) structure #1991.
Warning (Charges were rearranged) structure #1992.
Warning (Charges were rearranged) structure #1993.
Warning (Proton(s) added/removed) structure #1994.
Warning (Salt was disconnected; Proton(s) added/removed) structure #1995.
Warning (Proton(s) added/removed) structure #2000.
Warning (Proton(s) added/removed) structure #2001.
Warning (Proton(s) added/removed) structure #2002.
Warning (Proton(s) added/removed) structure #2003.
Warning (Charges neutralized) structure #2007.
Warning (Proton(s) added/removed) structure #2008.
Warning (Proton(s) added/removed) structure #2009.
Warning (Proton(s) added/removed) structure #2010.
Warning (Proton(s) added/removed) structure #2011.
Warning (Proton(s) added/removed) structure #2012.
Warning (Proton(s) added/removed) structure #2014.
Warning (Proton(s) added/removed) structure #2016.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); C(2)) structure #2018.
Warning (Charges were rearranged) structure #2019.
Warning (Proton(s) added/removed; Charges neutralized) structure #2020.
Warning (Charges were rearranged) structure #2021.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2022.
Warning (Charges were rearranged) structure #2024.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2034.
Warning (Proton(s) added/removed) structure #2037.
Warning (Salt was disconnected) structure #2040.
Warning (Salt was disconnected; Proton(s) added/removed) structure #2041.
Warning (Proton(s) added/removed) structure #2048.
Warning (Salt was disconnected) structure #2049.
Warning (Proton(s) added/removed) structure #2056.
Warning (Proton(s) added/removed) structure #2057.
Warning (Proton(s) added/removed) structure #2058.
Warning (Proton(s) added/removed) structure #2059.
Warning (Proton(s) added/removed) structure #2060.
Warning (Proton(s) added/removed) structure #2061.
Warning (Ambiguous stereo: center(s)) structure #2063.
Warning (Ambiguous stereo: center(s)) structure #2064.
Warning (Ambiguous stereo: center(s)) structure #2065.
Warning (Ambiguous stereo: center(s)) structure #2066.
Warning (Ambiguous stereo: center(s)) structure #2067.
Warning (Ambiguous stereo: center(s)) structure #2068.
Warning (Ambiguous stereo: center(s)) structure #2069.
Warning (Ambiguous stereo: center(s)) structure #2070.
Warning (Ambiguous stereo: center(s)) structure #2071.
Warning (Ambiguous stereo: center(s)) structure #2072.
Warning (Ambiguous stereo: center(s)) structure #2073.
Warning (Ambiguous stereo: center(s)) structure #2074.
Warning (Ambiguous stereo: center(s)) structure #2075.
Warning (Ambiguous stereo: center(s)) structure #2076.
Warning (Ambiguous stereo: center(s)) structure #2077.
Warning (Ambiguous stereo: center(s)) structure #2078.
Warning (Ambiguous stereo: center(s)) structure #2079.
Warning (Ambiguous stereo: center(s)) structure #2080.
Warning (Ambiguous stereo: center(s)) structure #2081.
Warning (Ambiguous stereo: center(s)) structure #2082.
Warning (Ambiguous stereo: center(s)) structure #2083.
Warning (Proton(s) added/removed) structure #2086.
Warning (Accepted unusual valence(s): N(4)) structure #2095.
Warning (Accepted unusual valence(s): O-1,d(2); H,t(1)) structure #2096.
Warning (Proton(s) added/removed; Charges neutralized) structure #2099.
Warning (Proton(s) added/removed) structure #2100.
Warning (Proton(s) added/removed) structure #2101.
Warning (Proton(s) added/removed; Charges neutralized) structure #2103.
Warning (Charges neutralized) structure #2104.
Warning (Metal was disconnected) structure #2113.
Warning (Charges were rearranged; Accepted unusual valence(s): C,d(5); Metal was disconnected) structure #2114.
Warning (Not chiral) structure #2117.
Warning (Charges were rearranged) structure #2118.
Warning (Proton(s) added/removed) structure #2120.
Warning (Proton(s) added/removed) structure #2122.
Warning (Charges were rearranged; Not chiral) structure #2123.
Warning (Charges were rearranged) structure #2124.
Warning (Not chiral) structure #2125.
Warning (Not chiral) structure #2126.
Warning (Proton(s) added/removed; Not chiral) structure #2127.
Warning (Metal was disconnected) structure #2130.
Warning (Accepted unusual valence(s): C(5)) structure #2133.
Warning (Proton(s) added/removed) structure #2135.
Warning (Metal was disconnected; Proton(s) added/removed) structure #2136.
Warning (Charges were rearranged) structure #2140.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2142.
Warning (Proton(s) added/removed) structure #2143.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2144.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2145.
Warning (Proton(s) added/removed) structure #2146.
Warning (Proton(s) added/removed) structure #2147.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2148.
Warning (Charges were rearranged) structure #2149.
Warning (Charges were rearranged) structure #2152.
Warning (Charges were rearranged; Proton(s) added/removed) structure #2153.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2154.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2155.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2156.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2157.
Warning (Charges were rearranged) structure #2161.
Warning (Charges were rearranged) structure #2163.
Warning (Charges were rearranged) structure #2165.
Warning (Charges were rearranged) structure #2166.
Warning (Charges were rearranged) structure #2167.
Warning (Charges were rearranged) structure #2168.
Warning (Charges were rearranged) structure #2169.
Warning (Charges were rearranged) structure #2170.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2173.
Warning (Charges were rearranged) structure #2174.
Warning (Charges were rearranged) structure #2175.
Warning (Charges were rearranged) structure #2179.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4)) structure #2180.
Warning (Charges were rearranged; Accepted unusual valence(s): O(4); Charges neutralized) structure #2181.
Warning (Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2184.
Warning (Charges were rearranged; Accepted unusual valence(s): O+1(1); Proton(s) added/removed) structure #2186.
End of file detected after structure #2186.
Finished processing 2186 structures: 1 error, processing time 0:00:00.33
+ for f in inchify_{InChI_TestSet,zzp}
+ sh ./inchify_zzp.sh
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp.inc zzp.log /dev/null -AuxNone -OutErrINCHI -NoLabels -Key"
Generating standard InChI
Generating standard InChIKey
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Error 76 (no InChI; Invalid element(s): *) inp structure #1.
Error 76 (no InChI; Invalid element(s): Zz) inp structure #2.
Error 76 (no InChI; Invalid element(s): *) inp structure #3.
Error 76 (no InChI; Invalid element(s): *) inp structure #4.
Error 76 (no InChI; Invalid element(s): *) inp structure #5.
Error 76 (no InChI; Invalid element(s): *; Zz) inp structure #6.
Error 76 (no InChI; Invalid element(s): *) inp structure #7.
Error 76 (no InChI; Invalid element(s): *) inp structure #8.
Error 76 (no InChI; Invalid element(s): *) inp structure #9.
Error 76 (no InChI; Invalid element(s): *) inp structure #10.
Error 76 (no InChI; Invalid element(s): *) inp structure #11.
Error 76 (no InChI; Invalid element(s): *) inp structure #12.
Error 76 (no InChI; Invalid element(s): *) inp structure #13.
Error 76 (no InChI; Invalid element(s): *) inp structure #14.
Error 76 (no InChI; Invalid element(s): *) inp structure #15.
Error 76 (no InChI; Invalid element(s): *) inp structure #16.
Error 76 (no InChI; Invalid element(s): *) inp structure #17.
Error 76 (no InChI; Invalid element(s): *) inp structure #18.
Error 76 (no InChI; Invalid element(s): *) inp structure #19.
Error 76 (no InChI; Invalid element(s): *) inp structure #20.
Error 76 (no InChI; Invalid element(s): *) inp structure #21.
Error 76 (no InChI; Invalid element(s): *) inp structure #22.
Error 76 (no InChI; Invalid element(s): *) inp structure #23.
Error 76 (no InChI; Invalid element(s): *) inp structure #24.
Error 76 (no InChI; Invalid element(s): *) inp structure #25.
Error 76 (no InChI; Invalid element(s): *) inp structure #26.
Error 76 (no InChI; Invalid element(s): *) inp structure #27.
Error 76 (no InChI; Invalid element(s): *) inp structure #28.
Error 76 (no InChI; Invalid element(s): *) inp structure #29.
Error 76 (no InChI; Invalid element(s): *) inp structure #30.
Error 76 (no InChI; Invalid element(s): *) inp structure #31.
Error 76 (no InChI; Invalid element(s): *) inp structure #32.
Warning: (Ignore polymer data) inp structure #33.
Warning: (Ignore polymer data) inp structure #34.
Warning: (Ignore polymer data) inp structure #35.
Warning: (Ignore polymer data) inp structure #36.
Warning: (Ignore polymer data) inp structure #37.
Warning: (Ignore polymer data) inp structure #38.
Warning: (Ignore polymer data) inp structure #39.
Warning: (Ignore polymer data) inp structure #40.
Warning: (Ignore polymer data) inp structure #41.
Warning: (Ignore polymer data) inp structure #42.
Warning: (Ignore polymer data) inp structure #43.
Warning: (Ignore polymer data) inp structure #44.
Warning: (Ignore polymer data) inp structure #46.
Warning: (Ignore polymer data) inp structure #47.
Warning: (Ignore polymer data) inp structure #48.
Warning: (Ignore polymer data) inp structure #49.
Warning (Omitted undefined stereo) structure #49.
Warning: (Ignore polymer data) inp structure #50.
Warning: (Ignore polymer data) inp structure #51.
Warning: (Ignore polymer data) inp structure #53.
Warning: (Ignore polymer data) inp structure #54.
Warning (Omitted undefined stereo) structure #54.
Warning: (Ignore polymer data) inp structure #55.
Warning (Omitted undefined stereo) structure #55.
Warning: (Ignore polymer data) inp structure #56.
Warning: (Ignore polymer data) inp structure #57.
Warning: (Ignore polymer data) inp structure #58.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #59.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #60.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #61.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #62.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #63.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #64.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #65.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #66.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #67.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #68.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #69.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #70.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #71.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #72.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #73.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #74.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #75.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #76.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #77.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #78.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #79.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #80.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #81.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #82.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #83.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #84.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #85.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #86.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #87.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #88.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #89.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #90.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #91.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #92.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *; Zz) inp structure #93.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #94.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #95.
Error 76 (no InChI; Ignore polymer data; Invalid element(s): *) inp structure #96.
End of file detected after structure #96.
Finished processing 96 structures: 70 errors, processing time 0:00:00.00
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp-NPZZ.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp-NPZZ.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp-NPZZ.inc zzp-NPZZ.log /dev/null -NPZZ -AuxNone -OutErrINCHI -NoLabels"
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Allowing non-polymer Zz pseudo atoms
Warning (Omitted undefined stereo) structure #11.
Warning (Not chiral) structure #12.
Warning (Proton(s) added/removed) structure #20.
Warning (Charges were rearranged) structure #23.
Warning (Proton(s) added/removed) structure #26.
Warning (Omitted undefined stereo) structure #31.
Warning: (Ignore polymer data) inp structure #33.
Warning: (Ignore polymer data) inp structure #34.
Warning: (Ignore polymer data) inp structure #35.
Warning: (Ignore polymer data) inp structure #36.
Warning: (Ignore polymer data) inp structure #37.
Warning: (Ignore polymer data) inp structure #38.
Warning: (Ignore polymer data) inp structure #39.
Warning: (Ignore polymer data) inp structure #40.
Warning: (Ignore polymer data) inp structure #41.
Warning: (Ignore polymer data) inp structure #42.
Warning: (Ignore polymer data) inp structure #43.
Warning: (Ignore polymer data) inp structure #44.
Warning: (Ignore polymer data) inp structure #46.
Warning: (Ignore polymer data) inp structure #47.
Warning: (Ignore polymer data) inp structure #48.
Warning: (Ignore polymer data) inp structure #49.
Warning (Omitted undefined stereo) structure #49.
Warning: (Ignore polymer data) inp structure #50.
Warning: (Ignore polymer data) inp structure #51.
Warning: (Ignore polymer data) inp structure #53.
Warning: (Ignore polymer data) inp structure #54.
Warning (Omitted undefined stereo) structure #54.
Warning: (Ignore polymer data) inp structure #55.
Warning (Omitted undefined stereo) structure #55.
Warning: (Ignore polymer data) inp structure #56.
Warning: (Ignore polymer data) inp structure #57.
Warning: (Ignore polymer data) inp structure #58.
Warning: (Ignore polymer data) inp structure #59.
Warning: (Ignore polymer data) inp structure #60.
Warning (Omitted undefined stereo) structure #60.
Warning: (Ignore polymer data) inp structure #61.
Warning: (Ignore polymer data) inp structure #62.
Warning: (Ignore polymer data) inp structure #63.
Warning (Omitted undefined stereo) structure #63.
Warning: (Ignore polymer data) inp structure #64.
Warning: (Ignore polymer data) inp structure #65.
Warning: (Ignore polymer data) inp structure #66.
Warning: (Ignore polymer data) inp structure #67.
Warning: (Ignore polymer data) inp structure #68.
Warning (Omitted undefined stereo) structure #68.
Warning: (Ignore polymer data) inp structure #69.
Warning: (Ignore polymer data) inp structure #70.
Warning: (Ignore polymer data) inp structure #71.
Warning: (Ignore polymer data) inp structure #72.
Warning: (Ignore polymer data) inp structure #73.
Warning: (Ignore polymer data) inp structure #74.
Warning: (Ignore polymer data) inp structure #75.
Warning: (Ignore polymer data) inp structure #76.
Warning: (Ignore polymer data) inp structure #77.
Warning: (Ignore polymer data) inp structure #78.
Warning: (Ignore polymer data) inp structure #79.
Warning (Omitted undefined stereo) structure #79.
Warning: (Ignore polymer data) inp structure #80.
Warning: (Ignore polymer data) inp structure #81.
Warning: (Ignore polymer data) inp structure #82.
Warning: (Ignore polymer data) inp structure #83.
Warning: (Ignore polymer data) inp structure #84.
Warning: (Ignore polymer data) inp structure #85.
Warning: (Ignore polymer data) inp structure #86.
Warning: (Ignore polymer data) inp structure #87.
Warning (Proton(s) added/removed) structure #87.
Warning: (Ignore polymer data) inp structure #88.
Warning: (Ignore polymer data) inp structure #89.
Warning (Proton(s) added/removed) structure #89.
Warning: (Ignore polymer data) inp structure #90.
Warning (Metal was disconnected) structure #90.
Warning: (Ignore polymer data) inp structure #91.
Warning (Accepted unusual valence(s): N(4); Cu(4); Metal was disconnected; Proton(s) added/removed) structure #91.
Warning: (Ignore polymer data) inp structure #92.
Warning (Omitted undefined stereo) structure #92.
Warning: (Ignore polymer data) inp structure #93.
Warning: (Ignore polymer data) inp structure #94.
Warning (Omitted undefined stereo) structure #94.
Warning: (Ignore polymer data) inp structure #95.
Warning: (Ignore polymer data) inp structure #96.
End of file detected after structure #96.
Finished processing 96 structures: 0 errors, processing time 0:00:00.00
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp-Polymers.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp-Polymers.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp-Polymers.inc zzp-Polymers.log /dev/null -Polymers -AuxNone -OutErrINCHI -NoLabels"
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Experimental mode: Treating polymers
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #1.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #2.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #3.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #4.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #5.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #6.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #7.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #8.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #9.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #10.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #11.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #12.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #13.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #14.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #15.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #16.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #17.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #18.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #19.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #20.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #21.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #22.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #23.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #24.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #25.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #26.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #27.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #28.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #29.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #30.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #31.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #32.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #33.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #35.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #36.
Warning (Ignore connection pattern for src-based polymer unit) structure #37.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #38.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #41.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #42.
Warning (Ignore connection pattern for src-based polymer unit) structure #43.
Warning (Ignore connection pattern for src-based polymer unit) structure #44.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #46.
Warning (Ignore connection pattern for src-based polymer unit) structure #47.
Warning (Ignore connection pattern for src-based polymer unit) structure #48.
Warning (Omitted undefined stereo) structure #49.
Warning (Set missing copolymer unit connection to EU; Omitted undefined stereo) structure #54.
Warning (Omitted undefined stereo) structure #55.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #59.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #60.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #61.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #62.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #63.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #64.
Warning (Bond(s) rearranged due to CRU frame shift) structure #65.
Warning (Bond(s) rearranged due to CRU frame shift) structure #66.
Warning (Bond(s) rearranged due to CRU frame shift) structure #67.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #68.
Warning (Bond(s) rearranged due to CRU frame shift) structure #69.
Warning (Bond(s) rearranged due to CRU frame shift) structure #71.
Warning (Bond(s) rearranged due to CRU frame shift; Accepted unusual valence(s): C(5); C(3)) structure #72.
Warning (Bond(s) rearranged due to CRU frame shift) structure #74.
Warning (Bond(s) rearranged due to CRU frame shift; Accepted unusual valence(s): C(5); C(3); N(2); N(4)) structure #75.
Warning (Bond(s) rearranged due to CRU frame shift) structure #77.
Warning (Bond(s) rearranged due to CRU frame shift) structure #78.
Warning (Omitted undefined stereo) structure #79.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #80.
Warning (Bond(s) rearranged due to CRU frame shift) structure #81.
Warning (Proton(s) added/removed) structure #87.
Warning (Bond(s) rearranged due to CRU frame shift) structure #88.
Warning (Proton(s) added/removed) structure #89.
Warning (Metal was disconnected) structure #90.
Warning (Bond(s) rearranged due to CRU frame shift; Accepted unusual valence(s): N(4); Cu(4); Metal was disconnected; Proton(s) added/removed) structure #91.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #92.
Error 74 (CRU folding and frame shift analysis failed; Polymer-unrelated pseudoatoms are not allowed) structure #93.
Error 74 (CRU folding and frame shift analysis failed; Polymer-unrelated pseudoatoms are not allowed) structure #94.
Warning (Bond(s) rearranged due to CRU frame shift) structure #95.
Warning (Bond(s) rearranged due to CRU frame shift) structure #96.
End of file detected after structure #96.
Finished processing 96 structures: 34 errors, processing time 0:00:00.00
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp-Polymers-FoldCRU-NPZZ.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp-Polymers-FoldCRU-NPZZ.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp-Polymers-FoldCRU-NPZZ.inc zzp-Polymers-FoldCRU-NPZZ.log /dev/null -Polymers -FoldCRU -NPZZ -AuxNone -OutErrINCHI -NoLabels"
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Experimental mode: Treating polymers; CRU folding enabled
Allowing non-polymer Zz pseudo atoms
Warning (Omitted undefined stereo) structure #11.
Warning (Not chiral) structure #12.
Warning (Proton(s) added/removed) structure #20.
Warning (Charges were rearranged) structure #23.
Warning (Proton(s) added/removed) structure #26.
Warning (Omitted undefined stereo) structure #31.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #33.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #35.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #36.
Warning (Ignore connection pattern for src-based polymer unit) structure #37.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #38.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #41.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #42.
Warning (Ignore connection pattern for src-based polymer unit) structure #43.
Warning (Ignore connection pattern for src-based polymer unit) structure #44.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #46.
Warning (Ignore connection pattern for src-based polymer unit) structure #47.
Warning (Ignore connection pattern for src-based polymer unit) structure #48.
Warning (Omitted undefined stereo) structure #49.
Warning (Set missing copolymer unit connection to EU; Omitted undefined stereo) structure #54.
Warning (Omitted undefined stereo) structure #55.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #59.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #60.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #61.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #62.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #63.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #64.
Warning (Bond(s) rearranged due to CRU frame shift) structure #65.
Warning (Atom(s) removed due to CRU folding; Bond(s) rearranged due to CRU frame shift) structure #66.
Warning (Atom(s) removed due to CRU folding; Bond(s) rearranged due to CRU frame shift) structure #67.
Warning (Atom(s) removed due to CRU folding; Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #68.
Warning (Bond(s) rearranged due to CRU frame shift) structure #69.
Warning (Atom(s) removed due to CRU folding) structure #71.
Warning (Atom(s) removed due to CRU folding) structure #72.
Warning (Atom(s) removed due to CRU folding) structure #74.
Warning (Atom(s) removed due to CRU folding) structure #75.
Warning (Atom(s) removed due to CRU folding) structure #77.
Warning (Bond(s) rearranged due to CRU frame shift) structure #78.
Warning (Omitted undefined stereo) structure #79.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #80.
Warning (Bond(s) rearranged due to CRU frame shift) structure #81.
Warning (Proton(s) added/removed) structure #87.
Warning (Bond(s) rearranged due to CRU frame shift) structure #88.
Warning (Proton(s) added/removed) structure #89.
Warning (Metal was disconnected) structure #90.
Warning (Bond(s) rearranged due to CRU frame shift; Accepted unusual valence(s): N(4); Cu(4); Metal was disconnected; Proton(s) added/removed) structure #91.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #92.
Warning (Bond(s) rearranged due to CRU frame shift) structure #93.
Warning (Bond(s) rearranged due to CRU frame shift; Omitted undefined stereo) structure #94.
Warning (Bond(s) rearranged due to CRU frame shift) structure #95.
Warning (Bond(s) rearranged due to CRU frame shift) structure #96.
End of file detected after structure #96.
Finished processing 96 structures: 0 errors, processing time 0:00:00.00
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp-Polymers105.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp-Polymers105.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp-Polymers105.inc zzp-Polymers105.log /dev/null -Polymers105 -AuxNone -OutErrINCHI -NoLabels"
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Experimental mode: Treating polymers (v. 1.05 legacy mode)
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #1.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #2.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #3.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #4.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #5.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #6.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #7.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #8.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #9.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #10.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #11.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #12.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #13.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #14.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #15.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #16.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #17.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #18.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #19.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #20.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #21.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #22.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #23.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #24.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #25.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #26.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #27.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #28.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #29.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #30.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #31.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #32.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #33.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #35.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #36.
Warning (Ignore connection pattern for src-based polymer unit) structure #37.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #38.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #41.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #42.
Warning (Ignore connection pattern for src-based polymer unit) structure #43.
Warning (Ignore connection pattern for src-based polymer unit) structure #44.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #46.
Warning (Ignore connection pattern for src-based polymer unit) structure #47.
Warning (Ignore connection pattern for src-based polymer unit) structure #48.
Warning (Omitted undefined stereo) structure #49.
Warning (Set missing copolymer unit connection to EU; Omitted undefined stereo) structure #54.
Warning (Omitted undefined stereo) structure #55.
Warning (Omitted undefined stereo) structure #59.
Warning (Omitted undefined stereo) structure #60.
Warning (Omitted undefined stereo) structure #61.
Warning (Omitted undefined stereo) structure #62.
Warning (Omitted undefined stereo) structure #63.
Warning (Omitted undefined stereo) structure #64.
Warning (Omitted undefined stereo) structure #68.
Warning (Ambiguous stereo: bond(s)) structure #77.
Warning (Omitted undefined stereo) structure #79.
Warning (Omitted undefined stereo) structure #80.
Warning (Proton(s) added/removed) structure #87.
Warning (Proton(s) added/removed) structure #89.
Warning (Frame shift in metallated polymer unit may be missed; Metal was disconnected) structure #90.
Warning (Frame shift in metallated polymer unit may be missed; Accepted unusual valence(s): N(4); Cu(4); Metal was disconnected; Proton(s) added/removed) structure #91.
Warning (Omitted undefined stereo) structure #92.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #93.
Error 74 (Polymer-unrelated pseudoatoms are not allowed) structure #94.
End of file detected after structure #96.
Finished processing 96 structures: 34 errors, processing time 0:00:00.00
InChI version 1, Software v. 1.06 (inchi-1 executable)
Linux 32-bit Build (gcc 13.0.0 20221219 (Red Hat 13.0.0-0)) of Jul 21 2022 00:00:00
Opened log file 'zzp-Polymers105-NPZZ.log'
Opened input file 'zzp.sdf'
Opened output file 'zzp-Polymers105-NPZZ.inc'
Opened problem file '/dev/null'
The command line used:
"../../INCHI_EXE/bin/Linux/inchi-1 zzp.sdf zzp-Polymers105-NPZZ.inc zzp-Polymers105-NPZZ.log /dev/null -Polymers105 -NPZZ -AuxNone -OutErrINCHI -NoLabels"
Generating standard InChI
Input format: MOLfile
Output format: Plain text
Aux. info suppressed
Print empty InChI if generation fails
Timeout per structure: 60000 msec
Up to 1024 atoms per structure
Experimental mode: Treating polymers (v. 1.05 legacy mode)
Allowing non-polymer Zz pseudo atoms
Warning (Omitted undefined stereo) structure #11.
Warning (Not chiral) structure #12.
Warning (Proton(s) added/removed) structure #20.
Warning (Charges were rearranged) structure #23.
Warning (Proton(s) added/removed) structure #26.
Warning (Omitted undefined stereo) structure #31.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #33.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #35.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #36.
Warning (Ignore connection pattern for src-based polymer unit) structure #37.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #38.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #41.
Warning (Ignore connection pattern for src-based polymer unit; Set missing copolymer subtype to RAN) structure #42.
Warning (Ignore connection pattern for src-based polymer unit) structure #43.
Warning (Ignore connection pattern for src-based polymer unit) structure #44.
Warning (Converted src-based polymer unit type to MON; Ignore connection pattern for src-based polymer unit) structure #46.
Warning (Ignore connection pattern for src-based polymer unit) structure #47.
Warning (Ignore connection pattern for src-based polymer unit) structure #48.
Warning (Omitted undefined stereo) structure #49.
Warning (Set missing copolymer unit connection to EU; Omitted undefined stereo) structure #54.
Warning (Omitted undefined stereo) structure #55.
Warning (Omitted undefined stereo) structure #59.
Warning (Omitted undefined stereo) structure #60.
Warning (Omitted undefined stereo) structure #61.
Warning (Omitted undefined stereo) structure #62.
Warning (Omitted undefined stereo) structure #63.
Warning (Omitted undefined stereo) structure #64.
Warning (Omitted undefined stereo) structure #68.
Warning (Ambiguous stereo: bond(s)) structure #77.
Warning (Omitted undefined stereo) structure #79.
Warning (Omitted undefined stereo) structure #80.
Warning (Proton(s) added/removed) structure #87.
Warning (Proton(s) added/removed) structure #89.
Warning (Frame shift in metallated polymer unit may be missed; Metal was disconnected) structure #90.
Warning (Frame shift in metallated polymer unit may be missed; Accepted unusual valence(s): N(4); Cu(4); Metal was disconnected; Proton(s) added/removed) structure #91.
Warning (Omitted undefined stereo) structure #92.
Warning (Omitted undefined stereo) structure #94.
End of file detected after structure #96.
Finished processing 96 structures: 0 errors, processing time 0:00:00.00
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-01.inc its-non-std-01.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-02.inc its-non-std-02.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-03.inc its-non-std-03.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-04.inc its-non-std-04.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-05.inc its-non-std-05.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-06.inc its-non-std-06.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-07.inc its-non-std-07.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-08.inc its-non-std-08.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-09.inc its-non-std-09.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-10.inc its-non-std-10.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-11.inc its-non-std-11.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-12.inc its-non-std-12.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-13.inc its-non-std-13.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-14.inc its-non-std-14.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-15.inc its-non-std-15.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-16.inc its-non-std-16.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-17.inc its-non-std-17.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-18.inc its-non-std-18.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-19.inc its-non-std-19.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-20.inc its-non-std-20.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-21.inc its-non-std-21.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-22.inc its-non-std-22.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-23.inc its-non-std-23.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-24.inc its-non-std-24.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-25.inc its-non-std-25.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-26.inc its-non-std-26.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-27.inc its-non-std-27.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-non-std-28.inc its-non-std-28.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-std-01.inc its-std-01.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-std-02.inc its-std-02.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-std-03.inc its-std-03.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-std-04.inc its-std-04.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/its-std-05.inc its-std-05.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/zzp-NPZZ.inc zzp-NPZZ.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/zzp-Polymers-FoldCRU-NPZZ.inc zzp-Polymers-FoldCRU-NPZZ.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/zzp-Polymers.inc zzp-Polymers.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/zzp-Polymers105-NPZZ.inc zzp-Polymers105-NPZZ.inc
+ for t in its-*.inc zzp-*.inc
+ diff -u reference/zzp-Polymers105.inc zzp-Polymers105.inc
~/build/BUILD/INCHI-1-SRC
+ popd
+ RPM_EC=0
++ jobs -p
+ exit 0
Processing files: inchi-1.0.6-5.fc38.i686
Provides: inchi = 1.0.6-5.fc38 inchi(x86-32) = 1.0.6-5.fc38
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Requires: libc.so.6 libc.so.6(GLIBC_2.0) libc.so.6(GLIBC_2.1) libc.so.6(GLIBC_2.3) libc.so.6(GLIBC_2.3.4) libc.so.6(GLIBC_2.34) libc.so.6(GLIBC_2.4) libm.so.6 libm.so.6(GLIBC_2.0) libm.so.6(GLIBC_2.1) rtld(GNU_HASH)
Processing files: inchi-libs-1.0.6-5.fc38.i686
Executing(%doc): /bin/sh -e /var/tmp/rpm-tmp.chIaOn
+ umask 022
+ cd /builddir/build/BUILD
+ cd INCHI-1-SRC
+ DOCDIR=/builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-libs
+ export LC_ALL=C
+ LC_ALL=C
+ export DOCDIR
+ /usr/bin/mkdir -p /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-libs
+ cp -pr readme.txt /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-libs
+ RPM_EC=0
++ jobs -p
+ exit 0
Executing(%license): /bin/sh -e /var/tmp/rpm-tmp.pcHavu
+ umask 022
+ cd /builddir/build/BUILD
+ cd INCHI-1-SRC
+ LICENSEDIR=/builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/licenses/inchi-libs
+ export LC_ALL=C
+ LC_ALL=C
+ export LICENSEDIR
+ /usr/bin/mkdir -p /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/licenses/inchi-libs
+ cp -pr LICENCE.pdf /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/licenses/inchi-libs
+ RPM_EC=0
++ jobs -p
+ exit 0
Provides: inchi-libs = 1.0.6-5.fc38 inchi-libs(x86-32) = 1.0.6-5.fc38 libinchi.so.1
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Requires: libc.so.6 libc.so.6(GLIBC_2.0) libc.so.6(GLIBC_2.1) libc.so.6(GLIBC_2.1.3) libc.so.6(GLIBC_2.3) libc.so.6(GLIBC_2.3.4) libc.so.6(GLIBC_2.4) libm.so.6 libm.so.6(GLIBC_2.0) libm.so.6(GLIBC_2.1) rtld(GNU_HASH)
Processing files: inchi-devel-1.0.6-5.fc38.i686
Provides: inchi-devel = 1.0.6-5.fc38 inchi-devel(x86-32) = 1.0.6-5.fc38
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Requires: libinchi.so.1
Processing files: inchi-doc-1.0.6-5.fc38.noarch
Executing(%doc): /bin/sh -e /var/tmp/rpm-tmp.cM52Is
+ umask 022
+ cd /builddir/build/BUILD
+ cd INCHI-1-SRC
+ DOCDIR=/builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-doc
+ export LC_ALL=C
+ LC_ALL=C
+ export DOCDIR
+ /usr/bin/mkdir -p /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-doc
+ cp -pr INCHI-1-DOC/CHANGELOG.pdf INCHI-1-DOC/External-contributors.pdf INCHI-1-DOC/InChI_API_Reference.pdf INCHI-1-DOC/InChI_TechMan.pdf INCHI-1-DOC/InChI_UserGuide.pdf INCHI-1-DOC/KNOWNISSUES.pdf INCHI-1-DOC/LICENCE.pdf INCHI-1-DOC/RelNotes.pdf INCHI-1-DOC/readme.txt /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386/usr/share/doc/inchi-doc
+ RPM_EC=0
++ jobs -p
+ exit 0
Provides: inchi-doc = 1.0.6-5.fc38
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Processing files: inchi-debugsource-1.0.6-5.fc38.i686
Provides: inchi-debugsource = 1.0.6-5.fc38 inchi-debugsource(x86-32) = 1.0.6-5.fc38
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Processing files: inchi-debuginfo-1.0.6-5.fc38.i686
Provides: debuginfo(build-id) = 21a5fd14e459155f51a01f0592a1cb39f18ae8db inchi-debuginfo = 1.0.6-5.fc38 inchi-debuginfo(x86-32) = 1.0.6-5.fc38
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Recommends: inchi-debugsource(x86-32) = 1.0.6-5.fc38
Processing files: inchi-libs-debuginfo-1.0.6-5.fc38.i686
Provides: debuginfo(build-id) = 7f1a32631ee127a2d2f4ebaa10552e736ed826d5 inchi-libs-debuginfo = 1.0.6-5.fc38 inchi-libs-debuginfo(x86-32) = 1.0.6-5.fc38 libinchi.so.1.06.00-1.0.6-5.fc38.i386.debug
Requires(rpmlib): rpmlib(CompressedFileNames) <= 3.0.4-1 rpmlib(FileDigests) <= 4.6.0-1 rpmlib(PayloadFilesHavePrefix) <= 4.0-1
Recommends: inchi-debugsource(x86-32) = 1.0.6-5.fc38
Checking for unpackaged file(s): /usr/lib/rpm/check-files /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386
Wrote: /builddir/build/RPMS/inchi-doc-1.0.6-5.fc38.noarch.rpm
Wrote: /builddir/build/RPMS/inchi-libs-debuginfo-1.0.6-5.fc38.i686.rpm
Wrote: /builddir/build/RPMS/inchi-debuginfo-1.0.6-5.fc38.i686.rpm
Wrote: /builddir/build/RPMS/inchi-libs-1.0.6-5.fc38.i686.rpm
Wrote: /builddir/build/RPMS/inchi-debugsource-1.0.6-5.fc38.i686.rpm
Wrote: /builddir/build/RPMS/inchi-devel-1.0.6-5.fc38.i686.rpm
Wrote: /builddir/build/RPMS/inchi-1.0.6-5.fc38.i686.rpm
Executing(%clean): /bin/sh -e /var/tmp/rpm-tmp.S3Hij9
+ umask 022
+ cd /builddir/build/BUILD
+ cd INCHI-1-SRC
+ /usr/bin/rm -rf /builddir/build/BUILDROOT/inchi-1.0.6-5.fc38.i386
+ RPM_EC=0
++ jobs -p
+ exit 0
Executing(rmbuild): /bin/sh -e /var/tmp/rpm-tmp.pMoMXX
+ umask 022
+ cd /builddir/build/BUILD
+ rm -rf INCHI-1-SRC INCHI-1-SRC.gemspec
+ RPM_EC=0
++ jobs -p
+ exit 0
Child return code was: 0