HMDB0061070 RDKit 3D norhydrocodone 40 44 0 0 0 0 0 0 0 0999 V2000 4.9236 -0.1462 1.1642 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5946 -0.5746 1.3152 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5278 0.0205 0.6615 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7137 1.1066 -0.2065 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6461 1.6995 -0.8589 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3624 1.2002 -0.6425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2594 0.1608 0.2014 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2568 -0.4843 0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6912 -1.5178 1.6465 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5079 -1.8728 0.9164 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0269 -2.4788 -0.3603 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6797 -3.4705 -0.2953 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3615 -1.9411 -1.6874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7091 -1.3132 -1.6863 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9959 -0.4008 -0.5300 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1090 1.0538 -0.9048 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8307 1.7296 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6687 1.7701 0.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7724 1.0044 1.4166 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5526 0.2315 1.7803 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0141 -0.5066 0.5838 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1901 0.1705 0.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1153 0.6809 1.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5929 -0.9893 1.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7258 1.4912 -0.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7549 2.5390 -1.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1744 -2.5061 1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4134 -2.8175 -2.3994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4362 -1.2957 -2.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8633 -0.6930 -2.6185 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -2.1272 -1.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9942 -0.6909 -0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7914 1.1651 -1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7229 1.7536 -2.4219 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 2.8252 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2698 2.7226 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7009 0.3982 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9292 1.7489 2.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8662 -0.5339 2.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 0.8881 2.2615 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 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 21 20 1 1 8 3 1 0 21 10 1 0 17 6 1 0 21 7 1 0 21 15 1 0 1 22 1 0 1 23 1 0 1 24 1 0 4 25 1 0 5 26 1 0 10 27 1 1 13 28 1 0 13 29 1 0 14 30 1 0 14 31 1 0 15 32 1 1 16 33 1 6 17 34 1 0 17 35 1 0 18 36 1 0 19 37 1 0 19 38 1 0 20 39 1 0 20 40 1 0 M END