HMDB0008170 RDKit 3D PC(18:3(6Z,9Z,12Z)/18:1(9Z)) 134133 0 0 0 0 0 0 0 0999 V2000 5.6900 -4.8510 1.9056 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4021 -3.8558 2.7876 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5666 -3.5640 4.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2285 -2.9923 3.6729 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -1.6725 2.8946 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0642 -0.6807 3.6949 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5827 0.4655 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2287 0.9792 3.7786 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3511 2.2473 3.0419 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9321 3.3825 3.4446 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 3.7305 4.6745 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0115 2.7886 5.7306 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8078 2.4467 6.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4699 2.9404 5.6262 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2421 1.7583 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 0.7515 6.1544 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2754 -0.4437 5.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5705 -0.1555 4.9712 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6173 -0.0797 5.6313 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6479 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0 43 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 1 0 48 49 1 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 13 75 1 0 14 76 1 0 14 77 1 0 15 78 1 0 15 79 1 0 16 80 1 0 16 81 1 0 17 82 1 0 17 83 1 0 21 84 1 0 21 85 1 0 22 86 1 6 23 87 1 0 23 88 1 0 29 89 1 0 29 90 1 0 30 91 1 0 30 92 1 0 32 93 1 0 32 94 1 0 32 95 1 0 33 96 1 0 33 97 1 0 33 98 1 0 34 99 1 0 34100 1 0 34101 1 0 38102 1 0 38103 1 0 39104 1 0 39105 1 0 40106 1 0 40107 1 0 41108 1 0 41109 1 0 42110 1 0 42111 1 0 43112 1 0 43113 1 0 44114 1 0 44115 1 0 45116 1 0 46117 1 0 47118 1 0 47119 1 0 48120 1 0 48121 1 0 49122 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