HMDB0261495 RDKit 3D PE(PGE1/18:2(9Z,12Z)) 132132 0 0 0 0 0 0 0 0999 V2000 16.9483 0.1362 1.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6633 1.4369 0.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2343 1.3411 -0.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1129 0.1564 -1.1446 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6878 0.0322 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7215 -0.1566 -0.5851 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9332 -1.2174 -0.4372 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9196 -2.3401 -1.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7034 -2.6676 -2.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5930 -2.0071 -2.0453 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1439 -0.8051 -1.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0068 -1.1292 -0.4471 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8122 -1.7488 -1.0355 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0551 -1.0386 -2.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5009 0.3018 -1.6649 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5895 0.2601 -0.4976 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3516 -0.6245 -0.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5158 -0.6268 0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8317 -1.3787 1.4652 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3966 0.1595 0.6634 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6237 0.1203 1.8702 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8120 -0.0979 1.5063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0294 -1.2974 0.7861 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3485 -1.5914 0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -0.7708 0.8137 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7267 -2.8040 -0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2579 -2.9840 -0.1771 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5036 -3.2889 1.2519 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 -3.5293 1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8466 -2.4416 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2689 -1.8309 0.4251 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3438 -0.7618 0.8080 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7887 0.2533 1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6777 0.2670 2.8997 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3372 1.3903 0.8131 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4983 1.4062 -0.2117 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.1337 2.0563 -1.3766 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7743 -0.0370 -0.4127 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.2021 -0.3313 -0.7759 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1521 0.5593 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1 0 50 51 2 0 50 52 1 0 50 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 38 32 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 15 83 1 0 16 84 1 0 16 85 1 0 17 86 1 0 17 87 1 0 21 88 1 1 22 89 1 0 22 90 1 0 26 91 1 0 26 92 1 0 27 93 1 0 27 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 29 98 1 0 30 99 1 0 30100 1 0 31101 1 0 31102 1 0 32103 1 1 35104 1 0 35105 1 0 36106 1 1 37107 1 0 38108 1 6 39109 1 0 40110 1 0 41111 1 1 42112 1 0 43113 1 0 43114 1 0 44115 1 0 44116 1 0 45117 1 0 45118 1 0 46119 1 0 46120 1 0 47121 1 0 47122 1 0 47123 1 0 48124 1 0 48125 1 0 52126 1 0 54127 1 0 54128 1 0 55129 1 0 55130 1 0 56131 1 0 56132 1 0 M END