HMDB0114246 RDKit 3D PE-NMe2(20:2(11Z,14Z)/18:1(9Z)) 139138 0 0 0 0 0 0 0 0999 V2000 -8.9259 1.3514 2.8921 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4168 1.3173 2.6621 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6946 2.2270 3.6534 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2079 2.1109 3.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4199 2.9958 4.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0102 2.8278 4.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2348 3.8234 3.7069 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6913 5.1895 3.5927 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4476 5.7243 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 6.1492 1.4192 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 6.1256 1.7536 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6332 5.3555 0.7148 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4919 6.1412 -0.5552 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3656 5.5411 -1.6712 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2747 6.4381 -2.8648 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9867 6.5637 -3.5506 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4635 5.4853 -4.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1615 4.1275 -3.9855 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1132 3.8707 -2.9335 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 2.4109 -2.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6624 1.6428 -3.4588 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8786 1.7772 -2.1081 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7869 0.3413 -2.1621 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -0.1848 -1.4165 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6974 -0.0471 0.0861 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4976 -0.6449 0.5594 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5258 -0.6551 2.2566 P 0 0 0 0 0 5 0 0 0 0 0 0 1.8826 -0.2237 2.7613 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6976 0.3847 2.7775 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1497 -2.2319 2.7871 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3478 -2.9318 2.9009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1678 -4.3523 3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5432 -4.5269 4.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -4.0955 5.7383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7487 -3.8875 4.6047 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4974 -1.6052 -1.6132 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 -2.1457 -2.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4661 -1.3050 -2.6477 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6944 -3.5986 -2.4283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8163 -4.0992 -3.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1609 -3.7245 -2.7346 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2643 -4.2894 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5842 -3.8450 -3.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7465 -4.3725 -3.8815 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0900 -3.9065 -3.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2296 -2.4540 -3.3773 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4504 -1.7263 -2.3356 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6100 -2.1527 -0.9159 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5787 -1.4637 -0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5424 -1.6787 1.3465 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1774 -2.8839 2.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -3.3834 2.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0938 -4.0195 1.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4702 -5.4187 0.6333 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8657 -5.6603 0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2175 0.4959 3.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2383 2.2799 3.4195 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5026 1.2811 1.9517 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 0.2886 2.7395 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2238 1.6635 1.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 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