HMDB0009835 RDKit 3D PI(18:1(9Z)/16:1(9Z)) 136136 0 0 0 0 0 0 0 0999 V2000 1.4980 -5.9907 -7.6803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8983 -5.4365 -6.4334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0981 -4.1809 -6.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9245 -3.0476 -7.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0944 -2.7254 -6.2655 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6403 -2.3276 -4.8686 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8503 -2.0571 -4.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2054 -2.7076 -2.9849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -3.8183 -2.3651 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1028 -3.4454 -0.9535 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2363 -2.1512 -1.0459 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -1.7761 0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0555 -0.6501 0.6983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3847 0.7482 0.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4769 1.1594 -0.9643 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8321 2.6120 -0.9748 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6923 3.0054 -1.7998 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 3.5475 -0.1259 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6801 4.9016 -0.2163 C 0 0 2 0 0 0 0 0 0 0 0 0 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0 37 38 1 0 38 39 1 0 39 40 1 0 19 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 43 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 54 56 1 0 56 57 1 0 56 47 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 6 70 1 0 7 71 1 0 8 72 1 0 9 73 1 0 9 74 1 0 10 75 1 0 10 76 1 0 11 77 1 0 11 78 1 0 12 79 1 0 12 80 1 0 13 81 1 0 13 82 1 0 14 83 1 0 14 84 1 0 15 85 1 0 15 86 1 0 19 87 1 6 20 88 1 0 20 89 1 0 24 90 1 0 24 91 1 0 25 92 1 0 25 93 1 0 26 94 1 0 26 95 1 0 27 96 1 0 27 97 1 0 28 98 1 0 28 99 1 0 29100 1 0 29101 1 0 30102 1 0 30103 1 0 31104 1 0 32105 1 0 33106 1 0 33107 1 0 34108 1 0 34109 1 0 35110 1 0 35111 1 0 36112 1 0 36113 1 0 37114 1 0 37115 1 0 38116 1 0 38117 1 0 39118 1 0 39119 1 0 40120 1 0 40121 1 0 40122 1 0 41123 1 0 41124 1 0 45125 1 0 47126 1 6 48127 1 0 49128 1 0 50129 1 0 51130 1 0 52131 1 0 53132 1 0 54133 1 6 55134 1 0 56135 1 0 57136 1 0 M END