HMDB0015467 RDKit 3D Drospirenone 57 63 0 0 0 0 0 0 0 0999 V2000 1.7614 1.0982 1.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8312 0.1444 -0.0654 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3451 0.8253 -1.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0964 1.2377 -1.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9885 0.1448 -0.6627 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4638 -0.7357 0.4240 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9511 -1.0797 0.0816 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6439 -2.0452 0.9442 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5697 -1.7475 2.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1175 -1.7677 0.6509 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1690 -0.5004 -0.1791 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5812 -0.8742 -1.5614 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2652 0.3565 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6211 1.0958 -0.9003 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1853 2.2114 -0.7917 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2284 0.3566 0.2314 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2599 -2.0209 0.3945 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2230 -2.3375 1.4731 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6854 -1.8092 0.1407 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1693 -0.4199 0.1301 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4587 -0.1893 0.3472 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9048 1.1965 0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8801 1.5290 1.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2005 2.2091 -0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9108 1.7170 -1.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2817 0.7638 -0.1144 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0644 1.4206 1.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 2.1374 0.7132 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0535 0.8641 1.8603 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8111 1.2388 1.4627 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9148 1.7797 -1.4625 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 0.1795 -2.1952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1711 2.1737 -0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4555 1.5800 -2.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3094 -0.4688 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5619 -0.3040 1.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9112 -1.5278 -0.9593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3002 -3.1130 0.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8836 -2.6380 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -0.8355 2.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7139 -2.6194 0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7977 -1.2750 -2.2003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3983 -1.6483 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6715 0.9057 -2.8436 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2278 0.0840 -2.6398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8005 -2.8923 -0.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2925 -1.7051 2.3693 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3768 -3.4158 1.6826 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2196 -2.5129 -0.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1487 -1.0185 0.5314 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9355 2.4791 -1.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1129 3.1316 0.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2539 2.5689 -1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0863 1.2286 -2.0521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2014 0.7216 2.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 1.8683 1.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7881 2.2539 1.3767 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 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 6 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 1 7 2 1 0 10 8 1 0 11 16 1 1 19 17 1 0 26 20 1 0 11 2 1 0 26 5 1 0 1 28 1 0 1 29 1 0 1 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 6 6 36 1 1 7 37 1 6 8 38 1 1 9 39 1 0 9 40 1 0 10 41 1 1 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 17 46 1 6 18 47 1 0 18 48 1 0 19 49 1 6 21 50 1 0 24 51 1 0 24 52 1 0 25 53 1 0 25 54 1 0 27 55 1 0 27 56 1 0 27 57 1 0 M END