HMDB0299408 RDKit 3D DG(i-17:0/PGF2alpha/0:0) 120120 0 0 0 0 0 0 0 0999 V2000 -15.0717 0.3582 -0.9628 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0128 1.1608 -1.7153 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7433 0.3775 -1.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2063 0.0557 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9120 1.3235 0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3631 1.0319 1.6730 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.0542 2.1323 2.4242 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1084 0.1863 1.5427 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1435 0.5261 0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8810 -0.1687 0.4867 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7246 -1.4062 1.2981 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3885 -1.6138 1.6993 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1774 -2.5487 0.3982 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8111 -2.0751 -0.9986 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5816 -2.6175 -1.3276 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8111 -0.5714 -0.9756 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6919 0.0681 -1.7133 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3594 -0.2890 -1.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4379 -0.9347 -1.8312 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1076 -1.3012 -1.2621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0057 -0.8411 0.1515 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6664 -1.2412 0.7127 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 -0.6112 -0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2136 -1.1496 -1.1429 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0441 0.6066 0.3468 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9579 1.2212 -0.3771 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4426 2.5096 -1.0384 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 3.4065 -0.0942 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1759 1.4825 0.4245 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7632 0.3722 1.0049 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.3701 2.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0819 -0.0498 2.5201 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8102 -1.5748 2.6394 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2534 -1.6906 2.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0032 -0.4907 2.7949 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4654 -0.6807 2.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7898 -0.7855 1.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4564 0.3966 0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1657 1.6556 0.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6546 1.5689 0.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2713 1.2470 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8133 1.1737 -0.6622 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2618 0.1346 0.2813 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7165 -0.0406 0.4296 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5798 -0.5279 -0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7315 0.1572 -1.9317 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7832 -0.7041 -2.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3366 1.5319 -1.8447 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1342 -0.6408 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0306 0.8615 -1.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8671 0.2753 0.1143 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8849 2.1332 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4368 1.3149 -2.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9804 1.0617 -2.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8209 -0.5188 -2.4439 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9206 -0.5825 0.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3162 -0.5820 -0.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8435 1.9115 0.4498 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2277 1.9696 -0.2621 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1117 0.3934 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3817 2.1302 3.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0168 -0.7181 2.1317 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3094 1.4583 0.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 0.5694 0.7022 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3002 -1.4599 2.2238 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1335 -1.0264 2.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6570 -3.4750 0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2657 -2.7448 0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5804 -2.4396 -1.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6271 -3.3318 -1.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7609 -0.2099 -1.4705 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7915 1.1784 -1.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7359 -0.1520 -2.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1477 -0.0078 -0.0981 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7163 -1.1796 -2.8588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -0.8428 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9364 -2.3957 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8218 -1.2359 0.7958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0315 0.2850 0.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -0.9925 1.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6121 -2.3616 0.5982 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2165 0.5702 -1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3811 2.1936 -1.7098 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2197 2.9745 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5091 4.1315 -0.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9775 2.2759 1.2057 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9092 2.0027 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7144 -1.4241 3.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -2.4849 2.3558 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6601 -2.6422 2.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3932 -1.7447 1.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9620 -0.4803 3.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5857 0.4253 2.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1138 0.0207 3.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7232 -1.6861 2.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8951 -1.0404 0.9588 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3101 -1.6892 0.5998 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3737 0.5984 0.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5918 0.1234 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 2.4555 -0.1237 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7895 1.9409 1.5698 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 0.8078 1.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0683 2.5297 0.9169 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9839 0.2803 -1.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0687 2.0152 -1.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2511 1.2093 -1.6371 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0963 2.1747 -0.1804 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8832 0.4059 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7346 -0.8530 0.1078 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8379 -0.7561 1.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1159 0.9266 0.8953 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6441 -0.6348 -0.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3114 -1.6305 -0.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8460 0.2088 -2.5951 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2317 -1.6112 -2.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0993 -0.1651 -3.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5890 -0.8955 -1.9822 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6241 2.2552 -1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3238 1.5314 -1.3417 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5156 1.8835 -2.8897 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 2 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 26 29 1 0 29 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 45 46 1 0 46 47 1 0 46 48 1 0 16 10 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 2 53 1 0 3 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 0 5 59 1 0 6 60 1 1 7 61 1 0 8 62 1 0 9 63 1 0 10 64 1 1 11 65 1 1 12 66 1 0 13 67 1 0 13 68 1 0 14 69 1 6 15 70 1 0 16 71 1 6 17 72 1 0 17 73 1 0 18 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 6 27 83 1 0 27 84 1 0 28 85 1 0 29 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 44111 1 0 45112 1 0 45113 1 0 46114 1 0 47115 1 0 47116 1 0 47117 1 0 48118 1 0 48119 1 0 48120 1 0 M END