HMDB0061075 RDKit 3D beta-noroxycodol 43 47 0 0 0 0 0 0 0 0999 V2000 5.1204 1.0085 -0.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 1.2750 0.3966 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8125 0.3511 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0961 -0.8075 -0.6467 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0835 -1.7172 -0.9569 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7995 -1.4510 -0.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 -0.3118 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5184 0.6189 0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8629 1.6163 1.1938 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5458 1.5563 0.8889 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7723 2.4330 -0.2850 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1435 3.7074 0.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 1.9768 -1.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4881 0.5231 -1.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7337 -0.2768 -0.4060 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0216 0.0346 0.0497 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6665 -1.7582 -0.5876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3363 -2.3533 -0.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2694 -2.3811 0.5609 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1627 -1.6655 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0466 -0.6973 1.8868 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7593 0.1023 0.6677 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1429 1.0723 -1.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3775 -0.0305 0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7755 1.7653 0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1147 -1.0091 -0.9712 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3067 -2.6341 -1.5255 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0592 1.8760 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1821 2.6156 -0.8609 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0169 3.7740 1.1642 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8441 2.0750 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7117 2.5804 -2.1799 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4374 0.5061 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2024 0.2542 -2.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9735 0.8001 0.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3244 -2.0141 -1.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1886 -2.7076 -1.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1857 -3.2640 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2723 -2.6343 0.3936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0174 -2.4272 2.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1576 -1.1958 2.0322 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1221 -1.2165 2.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3063 0.0305 2.7103 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 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 1 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 22 21 1 1 8 3 1 0 22 10 1 0 18 6 1 0 22 7 1 0 22 15 1 0 1 23 1 0 1 24 1 0 1 25 1 0 4 26 1 0 5 27 1 0 10 28 1 1 11 29 1 6 12 30 1 0 13 31 1 0 13 32 1 0 14 33 1 0 14 34 1 0 16 35 1 0 17 36 1 0 18 37 1 0 18 38 1 0 19 39 1 0 20 40 1 0 20 41 1 0 21 42 1 0 21 43 1 0 M END