HMDB0113096 RDKit 3D PE-NMe(18:0/20:3(5Z,8Z,11Z)) 136135 0 0 0 0 0 0 0 0999 V2000 12.9973 -1.4879 3.6709 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4422 -1.9903 2.3636 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3947 -1.0531 1.7824 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0406 0.2778 1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0546 1.2821 0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8021 2.5615 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0246 3.6845 0.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 3.3359 -1.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8028 4.5060 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5636 4.4878 -2.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6964 3.3014 -2.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2343 3.0878 -3.4262 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 1.9979 -4.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1414 0.8428 -3.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -0.4364 -3.4368 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2514 -0.7762 -3.6582 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1638 0.0430 -4.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0462 -0.0229 -3.0607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8855 0.8264 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 23 45 1 0 45 46 1 0 46 47 1 0 47 48 2 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 6 67 1 0 7 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 16 81 1 0 17 82 1 0 17 83 1 0 18 84 1 0 18 85 1 0 19 86 1 0 19 87 1 0 23 88 1 0 24 89 1 0 24 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 40116 1 0 41117 1 0 41118 1 0 42119 1 0 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 44125 1 0 45126 1 0 45127 1 0 49128 1 0 51129 1 0 51130 1 0 52131 1 0 52132 1 0 53133 1 0 54134 1 0 54135 1 0 54136 1 0 M END