HMDB0014618 RDKit 3D Chlordiazepoxide 35 37 0 0 0 0 0 0 0 0999 V2000 4.2616 -1.4746 1.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7128 -1.3927 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5708 -0.5918 -0.3627 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3603 0.4458 0.4147 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 1.3752 0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5561 2.6799 0.5393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5592 3.6303 0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6963 3.3154 -0.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9475 4.5299 -0.4019 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9641 1.9749 -0.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 1.0223 -0.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4446 -0.3483 -0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8223 -0.6189 -0.2663 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5317 -1.6811 -0.7877 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8121 -2.0278 -0.3518 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4377 -1.3107 0.6363 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7704 -0.2532 1.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4858 0.0884 0.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3448 -1.1821 -1.1407 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.1491 -2.4015 -1.3997 O 0 0 0 0 0 1 0 0 0 0 0 0 1.7547 -1.0199 -1.5247 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -2.5047 1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 -0.8854 1.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5763 -1.0629 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1526 -1.9259 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5191 2.9440 0.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7694 4.6703 0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9109 1.6652 -0.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1429 -2.2854 -1.5907 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2934 -2.8742 -0.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4201 -1.5853 0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2209 0.3504 1.9649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9841 0.8967 1.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1352 -1.9372 -1.9807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -0.2252 -2.2936 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 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 12 19 2 0 19 20 1 0 19 21 1 0 21 3 1 0 11 5 1 0 18 13 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 6 26 1 0 7 27 1 0 10 28 1 0 14 29 1 0 15 30 1 0 16 31 1 0 17 32 1 0 18 33 1 0 21 34 1 0 21 35 1 0 M CHG 2 19 1 20 -1 M END