HMDB0061004 RDKit 3D 6-beta-hydroxyprogesterone 54 57 0 0 0 0 0 0 0 0999 V2000 5.7087 -0.5924 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3327 -0.9884 0.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1454 -2.1333 -0.0219 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2582 0.0057 0.4756 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4623 1.2366 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 1.6658 -0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1763 0.8074 -0.0716 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1976 0.5597 -0.5678 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8738 1.8335 -0.8878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1459 2.1324 -0.1937 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9307 2.9741 -1.0183 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 0.9770 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3042 1.0766 0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0782 -0.1234 0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2356 -0.2645 0.2037 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4529 -1.1538 1.4471 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -1.0298 1.5293 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3581 -0.3502 0.3197 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6266 -1.2188 -0.8922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8848 -0.1914 0.5831 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2311 -1.4845 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2607 -1.4781 0.8359 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9189 -0.5171 -0.0693 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1910 -1.0180 -1.4551 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 0.4239 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3306 -0.5784 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1049 -1.3675 1.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0842 0.2578 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0865 0.9240 -1.2505 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9326 2.0592 0.1952 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9026 2.7502 -0.5993 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9794 1.5912 -1.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 1.1589 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2185 -0.1792 -1.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0864 1.8350 -1.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2047 2.7332 -0.7539 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9711 2.7458 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 3.9090 -0.9432 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8007 2.0464 0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7793 -2.1864 1.1762 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8344 -1.0011 2.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4995 -2.0597 1.6112 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6047 -0.4781 2.4258 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3167 -2.0709 -0.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1689 -0.6548 -1.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6931 -1.5887 -1.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7821 0.4720 1.4667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5127 -1.7901 1.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6358 -2.3106 0.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5873 -2.5166 0.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6989 -1.3612 1.8694 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -0.8708 -1.7736 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0017 -2.1101 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6068 -0.5078 -2.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 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 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 6 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 6 23 4 1 0 23 7 1 0 20 8 1 0 18 12 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 1 5 29 1 0 5 30 1 0 6 31 1 0 6 32 1 0 7 33 1 1 8 34 1 6 9 35 1 0 9 36 1 0 10 37 1 1 11 38 1 0 13 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 19 44 1 0 19 45 1 0 19 46 1 0 20 47 1 1 21 48 1 0 21 49 1 0 22 50 1 0 22 51 1 0 24 52 1 0 24 53 1 0 24 54 1 0 M END