HMDB0299126 RDKit 3D DG(PGF1alpha/i-15:0/0:0) 116116 0 0 0 0 0 0 0 0999 V2000 -13.2121 -1.8569 -1.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7474 -0.4441 -2.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9414 0.0141 -0.8045 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4285 1.4047 -1.0093 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5272 1.5813 -2.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2776 0.7688 -2.1802 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4650 -0.5904 -2.1509 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4203 1.2308 -1.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2247 1.7306 -1.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4001 2.1743 -0.0777 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9677 1.6892 1.2603 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0177 2.4423 1.7158 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7522 1.7580 2.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5807 2.0323 1.2503 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6114 3.4352 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0696 1.3332 -0.0609 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2035 1.7010 -1.1768 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0134 0.8848 -1.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 0.4978 -0.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3079 -0.4867 0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7636 -1.8252 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -2.4856 -0.8347 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4672 -2.7944 -0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4688 -2.0064 -0.2334 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3524 -3.9059 0.6494 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7103 -4.3588 1.3747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1327 -3.4389 2.4816 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0855 -3.2197 3.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2564 -2.3742 4.4365 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5983 -2.2245 1.9542 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8994 -1.7729 2.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5391 -2.5496 3.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4644 -0.5231 1.7426 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8747 -0.2877 2.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8484 -1.3305 1.7234 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2649 -1.0327 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2178 -2.1038 1.8176 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4181 -2.2862 0.3604 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0264 -1.0597 -0.3328 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3527 -0.7445 0.2742 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0106 0.4197 -0.4296 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1886 1.6470 -0.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7440 2.8864 -0.9701 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0312 2.9079 -2.4204 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5368 4.3425 -2.7599 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2083 2.0230 -2.7614 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8598 -2.2577 -2.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2796 -2.4726 -1.6754 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6524 -1.8151 -0.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6385 0.1796 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0893 -0.4079 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1830 -0.7518 -0.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6314 -0.0170 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0046 1.8514 -0.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3445 2.0358 -1.2247 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2792 2.6816 -2.2298 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1399 1.4163 -3.1151 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7142 1.0026 -3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6737 -1.1126 -1.9528 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8185 1.1391 -0.0339 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8464 1.8180 -2.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 3.2314 0.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2143 0.6000 1.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6150 1.8563 2.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5988 0.7978 2.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9344 2.5632 2.8926 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6131 1.8086 1.5716 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0908 3.9093 1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3322 0.3429 0.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8539 1.6024 -2.1267 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9506 2.8182 -1.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4335 1.3162 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3724 -0.0986 -1.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0796 0.1227 -0.9807 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6224 1.4225 0.0738 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2953 -0.7489 1.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9377 -0.2521 1.4344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8844 -2.4857 0.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7448 -1.7800 -0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4881 -1.8517 -1.6922 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1486 -3.4850 -1.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -4.5080 0.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5143 -5.3983 1.7739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9092 -3.9367 3.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4181 -4.2117 3.7505 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9275 -2.7549 2.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0896 -1.4569 4.2826 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -0.6093 0.6154 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8205 0.3603 1.9517 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 0.7021 1.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8695 -0.2398 3.2935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8729 -1.4227 0.6122 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5863 -2.3114 2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5472 -0.0637 1.7702 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2319 -0.9958 3.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8327 -3.0877 2.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2087 -1.9908 2.3162 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4471 -2.4649 -0.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1184 -3.1336 0.2116 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1930 -1.3546 -1.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3381 -0.2225 -0.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0298 -1.6410 0.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -0.5383 1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1348 0.1126 -1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0471 0.5629 -0.0287 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9186 1.9211 0.7062 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1476 1.4709 -0.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9900 3.7059 -0.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6660 3.1429 -0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 2.7562 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0996 4.2765 -3.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6463 4.9866 -2.8825 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1930 4.6735 -1.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9802 2.5910 -3.3909 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8018 1.7065 -1.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8368 1.1916 -3.4050 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 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 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 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 27 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 16 10 1 0 1 47 1 0 1 48 1 0 1 49 1 0 2 50 1 0 2 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 4 55 1 0 5 56 1 0 5 57 1 0 6 58 1 6 7 59 1 0 8 60 1 0 9 61 1 0 10 62 1 1 11 63 1 6 12 64 1 0 13 65 1 0 13 66 1 0 14 67 1 1 15 68 1 0 16 69 1 1 17 70 1 0 17 71 1 0 18 72 1 0 18 73 1 0 19 74 1 0 19 75 1 0 20 76 1 0 20 77 1 0 21 78 1 0 21 79 1 0 22 80 1 0 22 81 1 0 26 82 1 0 26 83 1 0 27 84 1 1 28 85 1 0 28 86 1 0 29 87 1 0 33 88 1 0 33 89 1 0 34 90 1 0 34 91 1 0 35 92 1 0 35 93 1 0 36 94 1 0 36 95 1 0 37 96 1 0 37 97 1 0 38 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 0 40103 1 0 41104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 1 0 43109 1 0 44110 1 0 45111 1 0 45112 1 0 45113 1 0 46114 1 0 46115 1 0 46116 1 0 M END