HMDB0113194 RDKit 3D PE-NMe(18:3(6Z,9Z,12Z)/14:1(9Z)) 116115 0 0 0 0 0 0 0 0999 V2000 3.8314 -0.9397 7.6051 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9663 -1.7780 7.0827 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9252 -1.0113 6.2344 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2764 -0.3989 5.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7094 -1.4737 4.1815 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -1.6126 3.8583 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4158 -0.6614 4.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7834 -0.0741 3.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 0.9415 3.4185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1366 1.4278 2.1184 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9693 2.4514 2.2736 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 2.8041 0.8821 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5035 3.8067 0.7855 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 4.0130 -0.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6922 4.7962 -1.0768 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 3.3310 -1.6225 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2867 3.4834 -2.9816 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0216 4.1691 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 3.3257 -3.1612 O 0 0 0 0 0 0 0 0 0 0 0 0 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