HMDB0113259 RDKit 3D PE-NMe(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)) 122121 0 0 0 0 0 0 0 0999 V2000 -14.8751 2.8547 -0.8111 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9030 4.0007 -0.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5648 3.7397 -0.9877 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4517 3.7538 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3967 4.0697 1.1281 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6258 5.3183 1.3418 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5461 5.5117 2.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8228 4.4196 2.7269 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4849 4.3168 2.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8844 3.2908 1.6437 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 1.9420 1.5887 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8049 1.0111 2.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2345 -0.0775 2.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3508 -0.4742 0.5808 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0144 -0.2869 -0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8708 -0.6544 -1.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4223 -0.1725 -1.8954 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5729 -0.9705 -1.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9867 -2.1200 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38 99 1 0 39100 1 0 39101 1 0 40102 1 0 41103 1 0 42104 1 0 42105 1 0 43106 1 0 44107 1 0 45108 1 0 45109 1 0 46110 1 0 47111 1 0 48112 1 0 48113 1 0 49114 1 0 49115 1 0 50116 1 0 50117 1 0 51118 1 0 51119 1 0 52120 1 0 52121 1 0 52122 1 0 M END