HMDB0261976 RDKit 3D PE(20:1(11Z)/18:1(12Z)-2OH(9,10)) 137136 0 0 0 0 0 0 0 0999 V2000 -15.1975 4.7316 -0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3747 3.3701 -0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2314 2.4690 -0.4809 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4114 1.1048 0.1544 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2483 0.1879 -0.2118 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1532 -0.0080 -1.6582 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1127 0.3442 -2.3561 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9369 0.9739 -1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7158 0.0905 -1.9924 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.9710 -1.1308 -1.3922 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4987 0.7962 -1.5016 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.5036 1.0777 -0.1433 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1867 0.1713 -1.9569 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0501 -1.2336 -1.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8358 -1.9710 -1.8267 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4935 -1.5816 -1.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1802 -1.5274 0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7685 -0.5234 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3583 0.9141 0.7029 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8839 1.0867 0.9577 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3911 2.2414 0.7673 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 0.1011 1.3735 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7228 0.1761 1.6462 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0765 -0.7433 0.7385 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4456 -0.7289 1.1352 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3438 -1.5621 0.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9036 -2.2585 -0.5053 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7774 -1.6474 0.8029 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3371 -0.4407 1.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3858 0.8418 0.7178 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1732 0.9736 -0.5228 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8013 0.2410 -1.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8602 0.5836 -2.8164 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2312 0.0870 -2.4027 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2511 -1.3953 -2.2246 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6194 -1.8364 -1.7615 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6369 -1.4194 -2.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6561 -0.6200 -2.4794 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8196 -0.0761 -1.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 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22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 2 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 23 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 0 2 60 1 0 3 61 1 0 3 62 1 0 4 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 6 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 6 10 72 1 0 11 73 1 6 12 74 1 0 13 75 1 0 13 76 1 0 14 77 1 0 14 78 1 0 15 79 1 0 15 80 1 0 16 81 1 0 16 82 1 0 17 83 1 0 17 84 1 0 18 85 1 0 18 86 1 0 19 87 1 0 19 88 1 0 23 89 1 1 24 90 1 0 24 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 35106 1 0 35107 1 0 36108 1 0 36109 1 0 37110 1 0 38111 1 0 39112 1 0 39113 1 0 40114 1 0 40115 1 0 41116 1 0 41117 1 0 42118 1 0 42119 1 0 43120 1 0 43121 1 0 44122 1 0 44123 1 0 45124 1 0 45125 1 0 46126 1 0 46127 1 0 46128 1 0 47129 1 0 47130 1 0 51131 1 0 53132 1 0 53133 1 0 54134 1 0 54135 1 0 55136 1 0 55137 1 0 M END