HMDB0013156 RDKit 3D 16-alpha-Hydroxyandrosterone 52 55 0 0 0 0 0 0 0 0999 V2000 -2.9886 -0.9747 -1.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6464 0.2655 -0.5242 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7932 1.2431 -1.2433 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3217 1.0347 -1.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0029 -0.3004 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6184 -0.3111 0.8957 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 0.6616 1.7668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5741 0.8313 1.5136 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1514 -0.3797 0.7939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6293 -0.2117 0.6425 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1122 0.5014 -0.5552 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9548 1.5936 -0.2338 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0354 0.9092 -1.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 -0.3189 -1.7183 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4212 -0.7037 -0.4699 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4280 -2.2558 -0.5099 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0233 0.0812 0.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0403 -0.7790 1.5015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3236 -0.0399 1.0930 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6958 0.7433 2.2015 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9411 0.8358 -0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5094 1.7897 -0.5071 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7123 -1.9198 -0.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1041 -1.0814 -1.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -0.8648 -2.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1073 2.2715 -0.8886 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1287 1.2397 -2.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.1744 -2.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0755 1.8943 -0.4975 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5266 -1.0405 -1.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4378 -1.3217 1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3568 1.6710 1.6739 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 0.3581 2.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8914 1.7884 1.0575 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1006 0.8321 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -1.1972 1.5467 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1597 -1.1844 0.7613 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9665 0.3850 1.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7943 -0.1898 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6925 1.2343 0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4897 1.8061 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5413 1.0886 -2.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9276 -1.1147 -2.0192 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5621 -0.1670 -2.5987 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2181 -2.6400 0.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.5829 -0.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6123 -2.5673 -1.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1571 1.0893 1.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0478 -1.8221 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8812 -0.7197 2.6006 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1329 -0.7360 0.8534 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0248 0.1005 2.8831 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 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 1 0 14 15 1 0 15 16 1 6 6 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 2 0 17 2 1 0 21 2 1 0 15 5 1 0 15 9 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 11 39 1 6 12 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 14 44 1 0 16 45 1 0 16 46 1 0 16 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 19 51 1 6 20 52 1 0 M END