HMDB0015044 RDKit 3D Quinidine 48 51 0 0 0 0 0 0 0 0999 V2000 4.7609 -2.6821 -0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6792 -2.0785 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5121 -0.6106 -0.1294 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3376 -0.2397 -0.9767 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8311 1.0333 -0.5079 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9399 1.9394 -0.2813 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7051 1.5446 0.9882 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3666 0.0790 1.2328 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8932 0.0593 1.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0927 0.9253 0.7061 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2698 0.2517 0.5216 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8152 0.2442 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1757 1.0813 -0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8209 2.3109 -0.8022 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7435 2.9996 -1.5514 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9696 2.5352 -1.8129 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3415 1.3366 -1.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6049 0.8155 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9733 -0.4143 -1.0723 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1007 -1.1686 -0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -2.4019 0.2195 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6988 -2.9320 -0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8559 -0.6557 -0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4576 0.5734 -0.5563 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5332 -2.1166 -0.8892 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8802 -3.7412 -0.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9123 -2.6531 0.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4236 -0.1766 -0.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5889 -0.1388 -2.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5608 -1.0219 -0.8554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5263 2.9632 -0.1523 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5847 1.9078 -1.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3913 2.1755 1.8416 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7985 1.5977 0.7997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9877 -0.3796 2.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8617 0.5449 2.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5054 -0.9509 1.7675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9062 1.9224 1.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1671 -0.7860 0.2081 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4615 -0.5190 2.3455 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1608 2.7026 -0.6018 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4548 3.9651 -1.9456 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2915 1.3997 -2.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9558 -0.8237 -1.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7068 -4.0061 0.2689 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9403 -2.8580 -1.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -2.3566 0.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1078 -1.1967 0.5333 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 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 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 2 0 8 3 1 0 24 13 1 0 10 5 1 0 24 17 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 6 4 29 1 0 4 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 1 9 36 1 0 9 37 1 0 10 38 1 1 11 39 1 6 12 40 1 0 14 41 1 0 15 42 1 0 18 43 1 0 19 44 1 0 22 45 1 0 22 46 1 0 22 47 1 0 23 48 1 0 M END