HMDB0008875 RDKit 3D PE(14:1(9Z)/22:1(13Z)) 129128 0 0 0 0 0 0 0 0999 V2000 -13.3023 4.7130 1.6482 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9582 3.9555 0.5385 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3756 2.5684 0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8771 2.6471 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3890 1.2821 -0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4486 0.7488 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7106 1.3733 1.6592 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2423 1.4072 1.4802 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6834 2.1719 0.3503 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9955 1.7664 -1.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5851 0.3751 -1.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1173 0.1158 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3031 1.0176 -2.1967 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8659 0.6398 -2.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0836 1.2679 -1.2745 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4131 -0.4510 -2.6812 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1815 -1.0495 -2.7327 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6406 -1.5738 -1.4391 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5433 -2.6641 -0.9256 C 0 0 0 0 0 0 0 0 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10 69 1 0 10 70 1 0 11 71 1 0 11 72 1 0 12 73 1 0 12 74 1 0 13 75 1 0 13 76 1 0 17 77 1 0 17 78 1 0 18 79 1 6 19 80 1 0 19 81 1 0 23 82 1 0 25 83 1 0 25 84 1 0 26 85 1 0 26 86 1 0 27 87 1 0 27 88 1 0 31 89 1 0 31 90 1 0 32 91 1 0 32 92 1 0 33 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 35 97 1 0 35 98 1 0 36 99 1 0 36100 1 0 37101 1 0 37102 1 0 38103 1 0 38104 1 0 39105 1 0 39106 1 0 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 43112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 50125 1 0 50126 1 0 51127 1 0 51128 1 0 51129 1 0 M END