HMDB0000352 RDKit 3D 16a-Hydroxydehydroisoandrosterone 50 53 0 0 0 0 0 0 0 0999 V2000 -2.8029 -1.6004 -0.3742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5214 -0.2714 -1.0034 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5785 -0.3449 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1435 -0.4229 -1.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2887 0.1662 -0.5392 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7368 0.0809 0.5713 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2727 0.6667 1.8502 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1773 0.9862 1.8932 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0581 0.4975 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4765 0.8777 1.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3261 0.5749 -0.0169 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6522 0.5087 0.3489 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9284 -0.7106 -0.7093 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5172 -0.5569 -1.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5871 -0.4184 -0.0170 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3543 -1.8262 0.5344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9616 0.7365 0.0043 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0895 0.9238 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3198 0.8741 0.0147 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8975 2.1294 -0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8152 0.3815 -1.3114 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4088 0.5315 -2.3611 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9561 -2.3161 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1594 -1.5140 0.6602 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6547 -2.0624 -0.9514 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8446 -1.2789 -2.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8149 0.4903 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2258 -1.4905 -1.8528 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.0797 -2.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 1.2646 -0.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8983 -1.0218 0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5412 0.0017 2.7228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8302 1.6121 2.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 1.6614 2.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.9742 1.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9129 0.3906 2.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2479 1.3875 -0.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7942 1.0456 1.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0509 -1.5928 -0.0735 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5825 -0.7703 -1.6282 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 0.2695 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 -1.5049 -1.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 -2.4477 0.3032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5042 -2.2988 -0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2188 -1.8191 1.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7123 1.6429 -0.5442 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1665 0.2093 1.7518 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0539 1.9448 1.3734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 0.1263 0.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6302 2.2330 0.5543 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 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 2 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 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 6 6 31 1 1 7 32 1 0 7 33 1 0 8 34 1 0 10 35 1 0 10 36 1 0 11 37 1 6 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 16 44 1 0 16 45 1 0 17 46 1 6 18 47 1 0 18 48 1 0 19 49 1 1 20 50 1 0 M END