HMDB0011356 RDKit 3D PE(P-16:0/22:1(13Z)) 136135 0 0 0 0 0 0 0 0999 V2000 -10.7397 -0.8826 3.9965 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8986 0.2091 3.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1188 -0.3662 2.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1936 -1.4644 2.6207 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4286 -2.0533 1.4464 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3762 -2.6499 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6017 -3.2054 -0.7187 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5620 -3.8460 -1.6809 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5750 -2.9035 -2.1388 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7985 -2.5854 -3.3942 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1356 -3.0513 -4.6045 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6389 -2.0589 -5.5277 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6376 -1.0454 -5.5128 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5207 0.0980 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1322 -0.2163 -3.2132 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0531 1.0235 -2.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1561 2.0911 -2.7875 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7191 1.8118 -2.9821 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9684 1.3353 -1.7710 C 0 0 0 0 0 0 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0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 25 44 1 0 44 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 46 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 2 57 1 0 3 58 1 0 3 59 1 0 4 60 1 0 4 61 1 0 5 62 1 0 5 63 1 0 6 64 1 0 6 65 1 0 7 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 18 86 1 0 18 87 1 0 19 88 1 0 19 89 1 0 20 90 1 0 20 91 1 0 21 92 1 0 21 93 1 0 25 94 1 6 26 95 1 0 26 96 1 0 28 97 1 0 29 98 1 0 30 99 1 0 30100 1 0 31101 1 0 31102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 34107 1 0 34108 1 0 35109 1 0 35110 1 0 36111 1 0 36112 1 0 37113 1 0 37114 1 0 38115 1 0 38116 1 0 39117 1 0 39118 1 0 40119 1 0 40120 1 0 41121 1 0 41122 1 0 42123 1 0 42124 1 0 43125 1 0 43126 1 0 43127 1 0 44128 1 0 44129 1 0 48130 1 0 50131 1 0 50132 1 0 51133 1 0 51134 1 0 52135 1 0 52136 1 0 M END