HMDB0247088 RDKit 3D 6-Methylprednisolone 57 60 0 0 0 0 0 0 0 0999 V2000 -3.1119 -2.3187 -1.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5983 -1.9023 -0.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1025 -1.9795 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4861 -0.6631 -0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0498 0.3931 0.5384 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1379 1.5458 0.6326 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6512 2.5885 1.4104 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0565 1.0247 1.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7241 -0.0846 0.7445 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0307 -1.1878 1.7588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0047 -0.6893 -0.4057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5137 -0.0272 -1.6608 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6318 0.9024 -1.2553 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0259 0.4490 0.1488 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5019 1.5744 0.8011 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -0.6114 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7029 -1.6559 -0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -0.4117 0.3626 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6616 0.8521 0.8845 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4536 0.6725 0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4048 0.8707 -1.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0769 1.8853 0.5336 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1916 1.8803 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8936 0.6451 1.5364 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9665 0.6473 2.1891 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2640 -0.5746 1.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1461 -0.5802 0.3624 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0515 -1.8078 -1.7151 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4195 -3.4130 -1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3594 -2.3158 -2.2158 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0091 -2.6907 0.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8094 -2.1427 1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7118 -2.8231 -0.6114 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8088 -0.4992 -1.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1757 -0.0155 1.5762 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1815 1.9880 -0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0989 3.2420 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6165 0.6353 2.4181 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6905 1.8715 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9913 -2.1796 1.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2684 -1.2222 2.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0038 -1.0443 2.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 -1.7748 -0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8425 -0.7698 -2.4204 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7388 0.5834 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3575 1.9724 -1.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4563 0.7560 -1.9835 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6356 1.4279 1.7904 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7804 -1.1835 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1301 -0.5079 -0.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7862 1.5477 0.1956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6008 -0.0156 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4884 1.3564 -1.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2418 1.5864 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 2.8881 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 2.8487 1.5526 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7519 -1.5434 1.2609 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 5 20 1 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 2 0 27 2 1 0 11 4 1 0 27 20 1 0 14 9 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 5 35 1 0 6 36 1 0 7 37 1 0 8 38 1 0 8 39 1 0 10 40 1 0 10 41 1 0 10 42 1 0 11 43 1 0 12 44 1 0 12 45 1 0 13 46 1 0 13 47 1 0 15 48 1 0 18 49 1 0 18 50 1 0 19 51 1 0 21 52 1 0 21 53 1 0 21 54 1 0 22 55 1 0 23 56 1 0 26 57 1 0 M END