HMDB0060424 RDKit 3D 7alpha-Hydroxypregnenolone 56 59 0 0 0 0 0 0 0 0999 V2000 5.9340 -0.3450 1.1547 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5108 -0.7436 1.0771 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1986 -1.8736 1.3689 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4998 0.2174 0.6534 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7714 0.7421 -0.7635 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3923 1.0358 -1.3575 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4561 0.8354 -0.2222 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0419 0.5676 -0.5678 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6040 1.9036 -0.9225 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1929 2.8087 0.0554 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0868 1.8316 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 0.7850 -0.4125 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 0.8917 -0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8225 0.2413 0.8164 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1915 0.3118 0.8257 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3099 -1.1958 0.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8425 -1.1237 1.1771 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0712 -0.4330 0.1006 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8742 -1.4064 -1.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7101 0.0399 0.6139 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0061 -1.0567 1.3578 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3688 -0.5584 1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -0.3489 0.4909 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1339 -1.5614 -0.4126 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 -1.1980 1.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0769 0.4619 1.9314 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1957 0.1324 0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4275 1.1124 1.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4086 1.6316 -0.7518 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2749 -0.0519 -1.3577 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 2.0468 -1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1556 0.2580 -2.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5631 1.7168 0.4636 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0312 -0.0853 -1.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2307 2.2862 -1.8894 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9173 3.3302 0.4379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6151 2.7078 -1.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5641 1.9616 -0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 0.3735 -1.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3474 0.7189 1.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5698 1.1008 0.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3898 -1.5576 -0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8852 -1.8295 1.5033 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7227 -0.6242 2.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.1921 1.2344 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8991 -1.8951 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6425 -2.2079 -1.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -0.8800 -2.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 0.8679 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0558 -1.9850 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6258 -1.3029 2.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8655 -1.2404 2.4742 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2256 0.4424 2.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -1.4712 -1.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9579 -2.4709 0.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1577 -1.7224 -0.8619 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 9 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 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 6 10 36 1 0 11 37 1 0 13 38 1 0 13 39 1 0 14 40 1 1 15 41 1 0 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 1 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 M END