HMDB0289041 RDKit 3D PC(PGF2alpha/DiMe(11,5)) 152153 0 0 0 0 0 0 0 0999 V2000 1.4797 1.2871 -8.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3841 1.1431 -7.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9085 0.9311 -5.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2251 0.7817 -4.6557 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4056 0.5819 -3.3152 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5299 0.4071 -2.1918 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.6874 -1.5366 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7008 -0.4598 -0.5954 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -1.4108 0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4765 -1.3490 1.6794 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -1.8533 1.3855 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7853 -1.6576 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1648 -2.2364 2.3553 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1342 -1.9664 3.4746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3339 -0.4412 3.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3013 -0.0696 4.6656 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5534 1.3905 4.7407 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4533 2.2792 5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2534 2.4261 4.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1727 1.8656 4.6685 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1275 3.1663 3.1186 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 3.1917 2.4858 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9728 3.1337 1.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 2.0930 0.3814 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9081 1.7013 0.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6933 2.3494 1.1647 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5041 0.5478 -0.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4876 1.0684 -1.3368 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2244 0.1563 -2.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -0.7288 -3.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6101 -2.0493 -3.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9609 -3.0003 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0916 -4.0513 -3.4586 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7496 -4.9668 -2.4826 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2701 -4.2925 -1.3693 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5804 -5.7728 -1.9641 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5679 -4.6603 -1.7371 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8110 -4.0126 -0.5441 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7629 -3.7320 -2.9361 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6553 -4.1424 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1469 -3.2041 -4.3236 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2856 -3.5058 -5.2659 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5182 -4.8957 -5.2363 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5414 -2.8462 -4.7858 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7184 -3.1093 -5.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9682 -2.4458 -5.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -2.8748 -3.8456 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6971 -2.1608 -3.4387 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2559 4.6182 2.7545 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1129 4.8221 4.0878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5334 6.2769 4.5340 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.4009 6.7941 3.3833 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6022 7.4299 4.9970 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.6192 6.1034 5.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8265 4.7352 5.9855 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7624 4.3976 7.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9907 2.9962 7.2714 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.0417 2.2461 6.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8642 2.4664 8.0473 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1867 2.7100 8.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9957 0.8858 -0.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9221 1.6992 0.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2511 1.4529 -1.6388 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 2.8731 -2.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0474 1.4902 -9.0635 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 0.2914 -8.1246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 2.0157 -7.7445 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3205 0.3509 -7.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1626 2.1268 -7.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5613 1.7843 -5.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5416 0.0232 -5.6761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 0.0289 -4.9595 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 1.7736 -4.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1612 -0.2485 -3.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0465 1.4961 -3.1262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3324 -1.1301 0.6702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3073 -2.4538 0.0528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -0.3552 2.0939 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9499 -2.0655 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4055 -1.2478 0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1304 -2.9257 1.1884 H 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 -4.5115 3.5594 8.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0047 2.4189 7.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0062 1.7880 8.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 1.8614 -0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0505 1.1971 1.1647 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 2.6760 0.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9173 3.0131 -2.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2141 3.1689 -2.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6068 3.5140 -1.2674 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 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 22 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 51 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 57 59 1 0 57 60 1 0 8 61 2 0 61 62 1 0 61 63 1 0 63 64 1 0 63 6 2 0 39 33 1 0 1 65 1 0 1 66 1 0 1 67 1 0 2 68 1 0 2 69 1 0 3 70 1 0 3 71 1 0 4 72 1 0 4 73 1 0 5 74 1 0 5 75 1 0 9 76 1 0 9 77 1 0 10 78 1 0 10 79 1 0 11 80 1 0 11 81 1 0 12 82 1 0 12 83 1 0 13 84 1 0 13 85 1 0 14 86 1 0 14 87 1 0 15 88 1 0 15 89 1 0 16 90 1 0 16 91 1 0 17 92 1 0 17 93 1 0 18 94 1 0 18 95 1 0 22 96 1 1 23 97 1 0 23 98 1 0 27 99 1 0 27100 1 0 28101 1 0 28102 1 0 29103 1 0 29104 1 0 30105 1 0 31106 1 0 32107 1 0 32108 1 0 33109 1 6 34110 1 6 35111 1 0 36112 1 0 36113 1 0 37114 1 1 38115 1 0 39116 1 1 40117 1 0 41118 1 0 42119 1 6 43120 1 0 44121 1 0 44122 1 0 45123 1 0 45124 1 0 46125 1 0 46126 1 0 47127 1 0 47128 1 0 48129 1 0 48130 1 0 48131 1 0 49132 1 0 49133 1 0 55134 1 0 55135 1 0 56136 1 0 56137 1 0 58138 1 0 58139 1 0 58140 1 0 59141 1 0 59142 1 0 59143 1 0 60144 1 0 60145 1 0 60146 1 0 62147 1 0 62148 1 0 62149 1 0 64150 1 0 64151 1 0 64152 1 0 M CHG 2 53 -1 57 1 M END