HMDB0041842 RDKit 3D Bufotenin 31 32 0 0 0 0 0 0 0 0999 V2000 -3.6372 0.3594 0.8906 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7772 -0.7742 0.6489 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5183 -1.8396 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6785 -0.3176 -0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8439 0.6383 0.6128 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3273 1.1379 -0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4922 2.3067 -0.8469 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 2.3096 -1.3867 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3944 1.1775 -1.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6703 0.7136 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1251 -0.5037 -0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2604 -1.2403 -0.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6973 -2.4636 0.3943 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9899 -0.7808 0.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.4466 -0.2819 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6578 -0.0174 1.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6317 1.0172 0.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1825 0.8868 1.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8336 -2.3883 -0.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3408 -1.3429 -0.5745 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8415 -2.5453 0.7391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0969 -1.1906 -0.5398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 0.2098 -1.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3947 1.5050 1.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4915 0.0587 1.5212 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2972 3.0624 -0.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 3.0562 -1.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3144 1.3027 -1.9564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1296 -0.8606 -1.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1719 -2.5779 1.2818 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -1.3456 0.8063 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 6 1 0 15 9 1 0 1 16 1 0 1 17 1 0 1 18 1 0 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 7 26 1 0 8 27 1 0 10 28 1 0 11 29 1 0 13 30 1 0 14 31 1 0 M END