HMDB0008070 RDKit 3D PC(18:1(11Z)/18:1(11Z)) 138137 0 0 0 0 0 0 0 0999 V2000 0.7087 0.4611 6.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1299 1.3012 7.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5058 1.5019 7.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2894 2.1960 5.7916 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6311 2.4248 5.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4183 3.1278 3.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 4.4248 3.9614 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5794 4.7152 3.4451 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2462 3.8141 2.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5649 3.6145 3.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4532 2.6794 2.5119 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7465 2.4604 3.2298 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7344 1.5799 2.6241 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7021 0.1341 2.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6208 -0.6990 1.9946 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4184 -0.7902 2.8621 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -1.6509 2.2467 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8666 -1.1790 0.9312 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3386 -1.7065 -0.1096 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.1774 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0 25 26 2 0 25 27 1 0 25 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 31 34 1 0 22 35 1 0 35 36 1 0 36 37 2 0 36 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 44 45 1 0 45 46 1 0 46 47 1 0 47 48 2 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 6 67 1 0 7 68 1 0 8 69 1 0 9 70 1 0 9 71 1 0 10 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 12 77 1 0 13 78 1 0 13 79 1 0 14 80 1 0 14 81 1 0 15 82 1 0 15 83 1 0 16 84 1 0 16 85 1 0 17 86 1 0 17 87 1 0 21 88 1 0 21 89 1 0 22 90 1 1 23 91 1 0 23 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 32 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 34105 1 0 38106 1 0 38107 1 0 39108 1 0 39109 1 0 40110 1 0 40111 1 0 41112 1 0 41113 1 0 42114 1 0 42115 1 0 43116 1 0 43117 1 0 44118 1 0 44119 1 0 45120 1 0 45121 1 0 46122 1 0 46123 1 0 47124 1 0 48125 1 0 49126 1 0 49127 1 0 50128 1 0 50129 1 0 51130 1 0 51131 1 0 52132 1 0 52133 1 0 53134 1 0 53135 1 0 54136 1 0 54137 1 0 54138 1 0 M CHG 2 27 -1 31 1 M END