HMDB0015307 RDKit 3D Cyclizine 42 44 0 0 0 0 0 0 0 0999 V2000 4.6937 0.3157 -0.2618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5106 -0.4052 0.2316 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4988 0.5343 0.6758 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5168 0.8556 -0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6378 -0.2939 -0.7295 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4126 -0.2656 0.2463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0435 1.1185 0.2735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3157 1.7324 1.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8909 2.9977 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1987 3.6593 0.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9262 3.0447 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3547 1.7877 -0.8935 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4454 -1.2871 0.1727 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2923 -2.6446 0.2125 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3605 -3.5456 0.1133 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6416 -3.0791 -0.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8344 -1.7171 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7781 -0.8638 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4806 -1.4476 -0.5352 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9403 -1.1156 -0.8989 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 0.6467 -1.2965 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9178 1.1753 0.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5067 -0.4347 -0.3093 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0399 1.4906 0.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9883 0.2368 1.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0938 1.1461 -1.3413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9679 1.7392 -0.1139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0868 -0.3838 1.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0898 1.2479 2.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1146 3.5015 2.4622 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6534 4.6591 0.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 3.5442 -1.7934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1515 1.3284 -1.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3167 -3.0673 0.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1591 -4.6069 0.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4978 -3.7679 -0.1118 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8655 -1.3731 -0.1907 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9817 0.1867 -0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1751 -2.2715 -1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -1.6887 0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4561 -2.0958 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0237 -0.5933 -1.8498 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 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 6 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 5 19 1 0 19 20 1 0 20 2 1 0 12 7 1 0 18 13 1 0 1 21 1 0 1 22 1 0 1 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 6 28 1 0 8 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 12 33 1 0 14 34 1 0 15 35 1 0 16 36 1 0 17 37 1 0 18 38 1 0 19 39 1 0 19 40 1 0 20 41 1 0 20 42 1 0 M END