HMDB0011302 RDKit 3D PC(P-18:1(9Z)/14:0) 127126 0 0 0 0 0 0 0 0999 V2000 2.3899 1.3600 8.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7103 0.8966 8.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 -0.5847 8.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0732 -1.0029 7.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4382 -0.4010 6.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5254 -0.6631 5.0405 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3394 -2.1128 4.6709 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3764 -2.0980 3.4695 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0937 -3.4469 2.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9593 -4.0589 2.8785 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6748 -3.3877 3.3108 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1526 -3.2813 2.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4904 -2.7373 2.0669 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8501 -1.3867 2.4994 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7148 -1.0627 3.9579 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1231 0.3994 4.2293 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4852 0.6279 3.7651 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6512 1.6570 2.9076 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7042 2.4147 2.5013 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7866 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1 0 17 81 1 0 18 82 1 0 20 83 1 0 20 84 1 0 21 85 1 0 22 86 1 0 22 87 1 0 28 88 1 0 28 89 1 0 29 90 1 0 29 91 1 0 31 92 1 0 31 93 1 0 31 94 1 0 32 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 33100 1 0 37101 1 0 37102 1 0 38103 1 0 38104 1 0 39105 1 0 39106 1 0 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 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 48123 1 0 48124 1 0 49125 1 0 49126 1 0 49127 1 0 M CHG 2 26 -1 30 1 M END