HMDB0113606 RDKit 3D PE-NMe(22:4(7Z,10Z,13Z,16Z)/20:2(11Z,14Z)) 142141 0 0 0 0 0 0 0 0999 V2000 18.2095 0.3590 -2.7221 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9827 1.1442 -2.1624 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2654 1.5642 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2113 2.3776 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8600 1.8937 0.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9521 1.4835 -0.9556 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8131 2.2170 -1.1351 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5197 3.3491 -0.3234 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4536 3.5374 0.5921 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5013 2.7723 0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2904 1.3948 0.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3593 0.4901 1.6845 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3405 -0.1719 2.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0006 -0.0992 1.4976 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4971 -1.4067 1.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4105 -1.9195 1.5784 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -1.2802 2.6049 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1489 -1.0155 2.2654 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6459 -0.2955 3.4668 C 0 0 0 0 0 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1.9511 2.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 29 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 26 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 2 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 8 73 1 0 9 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 16 83 1 0 17 84 1 0 17 85 1 0 18 86 1 0 18 87 1 0 19 88 1 0 19 89 1 0 20 90 1 0 20 91 1 0 21 92 1 0 21 93 1 0 25 94 1 0 25 95 1 0 26 96 1 0 27 97 1 0 27 98 1 0 31 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 36105 1 0 36106 1 0 36107 1 0 40108 1 0 40109 1 0 41110 1 0 41111 1 0 42112 1 0 42113 1 0 43114 1 0 43115 1 0 44116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 46121 1 0 47122 1 0 47123 1 0 48124 1 0 48125 1 0 49126 1 0 50127 1 0 51128 1 0 51129 1 0 52130 1 0 53131 1 0 54132 1 0 54133 1 0 55134 1 0 55135 1 0 56136 1 0 56137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 58142 1 0 M END