HMDB0014967 RDKit 3D Diazepam 33 35 0 0 0 0 0 0 0 0999 V2000 -3.5873 -0.7394 1.3998 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4678 -0.8553 0.5336 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0553 -2.1487 0.0466 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5924 -3.1433 0.5763 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0471 -2.4576 -1.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2155 -1.7984 -0.7532 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5207 -0.5721 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8946 -0.2498 -0.1989 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8587 -1.2191 -0.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1961 -1.0431 -0.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6275 0.1065 0.3816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7181 1.0515 0.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3723 0.8532 0.4142 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5072 0.4723 -0.3431 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0166 1.6825 -0.7932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 2.7586 -0.7328 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2402 4.3003 -1.2888 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1439 2.6530 -0.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6297 1.4407 0.2036 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7901 0.3462 0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5346 -0.4660 0.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7999 -1.7194 1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4106 -0.0442 2.2598 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8575 -3.5466 -1.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3912 -2.1791 -2.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5199 -2.1261 -1.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9472 -1.7858 -0.4955 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7021 0.2159 0.5935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0607 1.9667 1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7062 1.6541 0.7823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9949 1.7136 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7898 3.5406 -0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6281 1.3384 0.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 7 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 2 0 20 2 1 0 13 8 1 0 20 14 1 0 1 21 1 0 1 22 1 0 1 23 1 0 5 24 1 0 5 25 1 0 9 26 1 0 10 27 1 0 11 28 1 0 12 29 1 0 13 30 1 0 15 31 1 0 18 32 1 0 19 33 1 0 M END