HMDB0240243 RDKit 3D Homochlorcyclizine 45 47 0 0 0 0 0 0 0 0999 V2000 4.8522 -0.5897 1.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5508 -0.9450 0.6612 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -0.5587 -0.7318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1146 -1.1397 -1.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9244 -0.1777 -1.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4293 -0.2683 0.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8988 0.0309 0.5662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 1.4272 0.4382 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1743 2.1374 -0.7161 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5857 3.4693 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1684 4.1037 0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3461 3.4089 1.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9374 2.0991 1.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8931 -0.8822 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0185 -0.3505 -0.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -1.1982 -1.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7504 -2.5688 -1.3368 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9543 -3.5767 -2.1305 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6171 -3.0897 -0.7514 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -2.2213 -0.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2044 -0.9615 1.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5438 -0.2632 1.4522 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5533 -1.4588 1.1834 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -0.2310 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2936 0.2569 0.5367 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2558 -1.0027 -1.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 0.5455 -0.8612 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8915 -2.1490 -0.9722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2485 -1.1330 -2.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3758 0.8181 -1.2478 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2069 -0.3692 -1.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9884 -0.1978 1.6854 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.7418 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 4.0176 -1.7553 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4735 5.1353 0.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8186 3.9311 2.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0977 1.5784 2.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1855 0.7138 -0.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8414 -0.7916 -1.7602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4683 -4.1582 -0.7845 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8363 -2.7027 0.3011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3542 -2.0351 1.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6578 -0.8785 2.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8376 -0.2935 2.5055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4248 0.7774 1.1089 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 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 2 0 17 18 1 0 17 19 1 0 19 20 2 0 6 21 1 0 21 22 1 0 22 2 1 0 13 8 1 0 20 14 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 5 31 1 0 7 32 1 0 9 33 1 0 10 34 1 0 11 35 1 0 12 36 1 0 13 37 1 0 15 38 1 0 16 39 1 0 19 40 1 0 20 41 1 0 21 42 1 0 21 43 1 0 22 44 1 0 22 45 1 0 M END