HMDB0008138 RDKit 3D PC(18:2(9Z,12Z)/18:2(9Z,12Z)) 134133 0 0 0 0 0 0 0 0999 V2000 4.3276 -3.6954 3.9377 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2422 -3.7023 5.0534 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7262 -2.8737 6.1904 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8427 -2.8213 7.3456 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4912 -2.2035 7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -2.8678 6.2521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0099 -2.4004 5.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0411 -1.0795 4.6652 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6199 -0.0013 5.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6295 0.7039 4.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2537 0.5161 3.5435 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1219 1.7951 2.7067 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7851 2.9403 3.3996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6895 4.2200 2.6159 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2424 4.6106 2.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1348 5.9063 1.6382 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7633 5.9505 0.2975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2115 5.0028 -0.7015 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5834 3.8039 -0.7748 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2512 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44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 49 2 0 49 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 7 67 1 0 8 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 72 1 0 11 73 1 0 12 74 1 0 12 75 1 0 13 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 21 86 1 0 21 87 1 0 22 88 1 1 23 89 1 0 23 90 1 0 29 91 1 0 29 92 1 0 30 93 1 0 30 94 1 0 32 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 33100 1 0 34101 1 0 34102 1 0 34103 1 0 38104 1 0 38105 1 0 39106 1 0 39107 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 46119 1 0 47120 1 0 47121 1 0 48122 1 0 49123 1 0 50124 1 0 50125 1 0 51126 1 0 51127 1 0 52128 1 0 52129 1 0 53130 1 0 53131 1 0 54132 1 0 54133 1 0 54134 1 0 M CHG 2 27 -1 31 1 M END