HMDB0113201 RDKit 3D PE-NMe(18:3(6Z,9Z,12Z)/18:3(6Z,9Z,12Z)) 124123 0 0 0 0 0 0 0 0999 V2000 0.7883 -1.1550 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0207 -0.2900 4.4129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.0501 2.9938 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2289 -0.9570 1.9448 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3184 -1.9387 1.8714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3667 -2.8575 2.9998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2374 -4.1622 2.8512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0315 -4.8805 1.5965 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7984 -5.7109 1.5457 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8631 -5.4964 0.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8708 -4.4363 -0.3635 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8663 -4.9929 -1.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0984 -4.7337 -2.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3132 -3.8753 -2.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5405 -4.6886 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -4.1658 -2.2455 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4494 -3.0348 -2.9613 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8415 -1.7060 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9269 -1.2170 -3.4566 O 0 0 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92 1 0 32 93 1 0 32 94 1 0 32 95 1 0 36 96 1 0 36 97 1 0 37 98 1 0 37 99 1 0 38100 1 0 38101 1 0 39102 1 0 39103 1 0 40104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 1 0 44109 1 0 45110 1 0 45111 1 0 46112 1 0 47113 1 0 48114 1 0 48115 1 0 49116 1 0 49117 1 0 50118 1 0 50119 1 0 51120 1 0 51121 1 0 52122 1 0 52123 1 0 52124 1 0 M END