HMDB0006001 RDKit 3D 3'-Hydroxystanozolol 57 61 0 0 0 0 0 0 0 0999 V2000 1.2782 -1.8459 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5888 -0.5362 -0.0667 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4554 -0.7280 -1.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8609 -0.3445 -1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4214 -0.0949 0.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7089 0.2218 -0.1325 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9538 0.1771 -1.4299 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -0.1687 -2.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7039 -0.3109 -3.3553 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5556 -0.2163 1.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2383 0.4171 0.8728 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4012 0.8314 2.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1502 1.5012 1.4865 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5714 0.4961 0.6645 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3008 0.1228 -0.5459 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4220 -0.6299 -1.5844 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7801 -1.1179 -1.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5769 -0.3883 -0.2898 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8388 -1.2180 0.9476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8409 0.9103 0.0574 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8266 1.6257 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0911 1.4487 0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8897 0.1577 -0.7592 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9290 0.3991 -2.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9434 -0.6878 -0.4359 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.1326 0.4551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4579 -1.7862 1.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9552 -2.6375 0.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0406 -0.2326 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4457 -1.8159 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3851 0.4606 0.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8916 0.3887 -1.8295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4251 -1.2956 1.4946 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9847 0.2855 2.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4981 1.3372 0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0546 -0.0215 2.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0003 1.5505 2.6395 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4857 2.3276 0.8031 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.8996 2.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6353 -0.4574 1.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6229 1.1153 -0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4691 -0.0392 -2.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2201 -1.5183 -1.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7249 -2.2004 -0.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3881 -1.1758 -2.2405 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5578 -0.7374 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2626 -2.1619 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9211 -1.5362 0.9933 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7117 1.4373 -0.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0083 1.2513 1.8736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6277 2.7306 0.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9992 1.4443 0.6195 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0517 2.2876 -0.7247 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9739 0.7764 -2.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 1.1924 -2.4349 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3006 -0.5076 -2.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6192 -0.2504 0.1418 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 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 5 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 1 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 1 11 2 1 0 20 14 1 0 15 2 1 0 23 18 1 0 8 4 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 3 30 1 0 6 31 1 0 7 32 1 0 10 33 1 0 10 34 1 0 11 35 1 6 12 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 14 40 1 1 15 41 1 6 16 42 1 0 16 43 1 0 17 44 1 0 17 45 1 0 19 46 1 0 19 47 1 0 19 48 1 0 20 49 1 6 21 50 1 0 21 51 1 0 22 52 1 0 22 53 1 0 24 54 1 0 24 55 1 0 24 56 1 0 25 57 1 0 M END