diff options
| author | Navan Chauhan <navanchauhan@gmail.com> | 2020-08-30 12:50:38 +0530 |
|---|---|---|
| committer | Navan Chauhan <navanchauhan@gmail.com> | 2020-08-30 12:50:38 +0530 |
| commit | e64830992db27939840bc68364de3f47441c154f (patch) | |
| tree | aaaecfddc19b35c069a52e05191b2bb00425a88d /app/static/ketcher/library.sdf | |
| parent | fa9a26deb28c8d8ec4f1650183f19ddbd4de4ff6 (diff) | |
added ketcher option
Diffstat (limited to 'app/static/ketcher/library.sdf')
| -rw-r--r-- | app/static/ketcher/library.sdf | 11632 |
1 files changed, 11632 insertions, 0 deletions
diff --git a/app/static/ketcher/library.sdf b/app/static/ketcher/library.sdf new file mode 100644 index 0000000..47df7da --- /dev/null +++ b/app/static/ketcher/library.sdf @@ -0,0 +1,11632 @@ +alpha-D-Allopyranose + Ketcher 11161713142D 1 1.00000 0.00000 0 + + 12 12 0 1 0 999 V2000 + -2.4110 3.5743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -2.4110 1.6992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -4.2304 0.7587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -6.0499 1.6991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -4.2360 3.5743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -6.8478 2.9800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -3.3208 3.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -3.3208 2.1638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -4.2360 1.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -5.1456 2.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -5.1456 3.1151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -6.0499 3.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 6 12 1 0 0 0 + 11 5 1 0 0 0 + 5 7 1 0 0 0 + 7 8 1 0 0 0 + 8 9 1 0 0 0 + 9 10 1 0 0 0 + 10 11 1 0 0 0 + 11 12 1 1 0 0 + 7 1 1 6 0 0 + 8 2 1 6 0 0 + 9 3 1 6 0 0 + 10 4 1 6 0 0 +M END +> <group> +alpha-D-Sugars + +> <prerender> +library.svg#tmpl1 + +> <atomid> +0 + +> <bondid> +0 + +$$$$ +alpha-D-Altropyranose + Ketcher 11161713142D 1 1.00000 0.00000 0 + + 12 12 0 1 0 999 V2000 + -0.9910 2.2903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -0.9910 0.7936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -2.2875 0.0452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -3.5799 0.7935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -2.2834 2.2903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -4.1462 1.8062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 + -1.6372 1.9161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -1.6372 1.1678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -2.2834 0.7935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -2.9337 1.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -2.9337 1.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + -3.5799 2.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 + 6 12 1 0 0 0 + 11 5 1 0 0 0 + 5 7 1 0 0 0 + 7 8 1 0 0 0 + 8 9 1 0 0 0 + 9 10 1 0 0 0 + 10 11 1 0 0 0 + 11 12 1 1 0 0 + 7 1 1 6 0 0 + 8 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