HMDB0061033 RDKit 3D 6-beta-hydrocortisol 57 60 0 0 0 0 0 0 0 0999 V2000 2.2843 -0.6193 -1.8981 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7974 -0.6126 -0.4653 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9664 -1.8008 -0.1238 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4875 -1.7130 -0.4028 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7679 -2.0059 -1.7051 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.4039 0.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2497 0.7185 -0.4872 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7982 2.0805 -0.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8753 2.0768 0.8652 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4829 3.3530 0.8122 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8889 1.0192 0.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1196 1.2344 1.0497 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1475 0.2393 0.8397 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3341 0.5014 1.0718 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7709 -1.1082 0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2763 -1.3609 0.5455 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -0.2300 -0.0868 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9584 -0.0978 -1.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2082 0.7101 -0.1179 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5041 0.9317 1.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6024 -0.0399 1.6831 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 -0.6414 0.3964 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4935 -1.9563 0.5784 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 0.2103 -0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9548 1.3916 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4887 -0.3292 -0.4873 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3037 0.6697 -0.9955 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5651 -1.0003 -2.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5942 0.3992 -2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2018 -1.2702 -1.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3782 -2.6777 -0.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1017 -2.0567 0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9896 -2.5100 0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7995 -1.2721 -2.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8507 -0.3991 1.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2754 0.6043 -1.6093 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2524 2.5703 -1.0961 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 2.7843 0.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4106 1.9349 1.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1782 3.9131 1.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4165 2.1491 1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3659 -1.8487 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0458 -1.1596 -0.7234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0489 -2.3130 0.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1289 -1.4072 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9689 0.4083 -1.4606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3373 0.5572 -2.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1576 -1.0930 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6709 1.5150 -0.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8825 1.9581 1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6729 0.7579 2.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4827 0.4981 2.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2873 -0.7758 2.4424 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0566 -2.2073 -0.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4714 -1.1452 -1.2301 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9375 -0.6606 0.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8165 1.5295 -1.1513 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 6 7 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 1 22 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 19 2 1 0 22 2 1 0 17 6 1 0 17 11 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 1 5 34 1 0 6 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 1 10 40 1 0 12 41 1 0 15 42 1 0 15 43 1 0 16 44 1 0 16 45 1 0 18 46 1 0 18 47 1 0 18 48 1 0 19 49 1 0 20 50 1 0 20 51 1 0 21 52 1 0 21 53 1 0 23 54 1 0 26 55 1 0 26 56 1 0 27 57 1 0 M END