HMDB0289165 RDKit 3D PC(DiMe(13,5)/18:2(9Z,11E)+=O(13)) 150150 0 0 0 0 0 0 0 0999 V2000 -7.7554 -4.1966 -2.5189 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2839 -3.8739 -2.6976 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1706 -2.8504 -3.8164 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9339 -1.5955 -3.4785 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8801 -0.5290 -4.5225 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5438 -0.0105 -4.8206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5473 -0.4605 -4.2093 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3709 1.0271 -5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1711 1.5357 -6.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 2.5713 -7.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8772 3.1320 -7.4746 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6226 2.7355 -6.8589 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 2.2362 -7.8959 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6437 1.8730 -7.0366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 1.4363 -7.8999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0459 1.0765 -7.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2438 -0.0515 -6.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -0.2050 -5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0127 -1.4712 -4.4384 C 0 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66 1 0 2 67 1 0 3 68 1 0 3 69 1 0 4 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 8 74 1 0 9 75 1 0 10 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 15 84 1 0 15 85 1 0 16 86 1 0 16 87 1 0 17 88 1 0 17 89 1 0 18 90 1 0 18 91 1 0 22 92 1 6 23 93 1 0 23 94 1 0 27 95 1 0 27 96 1 0 28 97 1 0 28 98 1 0 29 99 1 0 29100 1 0 30101 1 0 30102 1 0 31103 1 0 31104 1 0 32105 1 0 32106 1 0 33107 1 0 33108 1 0 34109 1 0 34110 1 0 35111 1 0 35112 1 0 36113 1 0 36114 1 0 37115 1 0 37116 1 0 38117 1 0 38118 1 0 42119 1 0 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 45125 1 0 45126 1 0 46127 1 0 46128 1 0 46129 1 0 48130 1 0 48131 1 0 48132 1 0 50133 1 0 50134 1 0 50135 1 0 51136 1 0 51137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 60142 1 0 60143 1 0 60144 1 0 61145 1 0 61146 1 0 61147 1 0 62148 1 0 62149 1 0 62150 1 0 M CHG 2 55 -1 59 1 M END