HMDB0113353 RDKit 3D PE-NMe(20:2(11Z,14Z)/20:3(8Z,11Z,14Z)) 138137 0 0 0 0 0 0 0 0999 V2000 15.0637 2.7198 0.2419 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6902 4.1396 -0.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5181 5.0038 1.1137 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4590 4.4974 2.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0884 4.4020 1.3907 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0847 3.9226 2.3422 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4148 2.8239 2.2116 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6163 1.9241 1.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0516 0.5912 1.5373 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3694 -0.4817 1.2783 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1160 -0.5055 0.4907 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3941 -1.3459 -0.6842 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 -2.4238 -0.9487 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6585 -2.9617 -0.1639 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3364 -3.1505 -0.8267 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5866 -1.9979 -1.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2103 -1.1653 -2.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4412 -0.0496 -2.9857 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8775 1.0035 -2.1378 C 0 0 0 0 0 0 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1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 23 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 15 81 1 0 16 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 23 90 1 0 24 91 1 0 24 92 1 0 28 93 1 0 28 94 1 0 29 95 1 0 29 96 1 0 30 97 1 0 30 98 1 0 31 99 1 0 31100 1 0 32101 1 0 32102 1 0 33103 1 0 33104 1 0 34105 1 0 34106 1 0 35107 1 0 35108 1 0 36109 1 0 36110 1 0 37111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 41116 1 0 42117 1 0 42118 1 0 43119 1 0 43120 1 0 44121 1 0 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