HMDB0287092 RDKit 3D PC(20:1(11Z)/18:1(12Z)-2OH(9,10)) 146145 0 0 0 0 0 0 0 0999 V2000 -0.9321 -5.4790 -7.8021 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0199 -4.3295 -8.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3461 -3.5142 -6.8799 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8658 -2.9057 -6.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3883 -2.0958 -4.9993 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5664 -1.4934 -4.3422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9133 -1.7332 -3.0963 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2039 -2.6229 -2.1642 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0947 -3.7548 -1.6720 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2117 -3.2307 -1.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3173 -4.7017 -0.7844 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2480 -5.1776 -1.5482 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8177 -3.9909 0.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0405 -4.9086 1.3608 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -4.1989 2.5866 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -3.6178 3.4508 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 -2.9013 4.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0265 -2.3114 5.5612 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9514 -1.3141 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1 0 18 88 1 0 18 89 1 0 19 90 1 0 19 91 1 0 23 92 1 6 24 93 1 0 24 94 1 0 28 95 1 0 28 96 1 0 29 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 38114 1 0 39115 1 0 39116 1 0 40117 1 0 40118 1 0 41119 1 0 41120 1 0 42121 1 0 42122 1 0 43123 1 0 43124 1 0 44125 1 0 44126 1 0 45127 1 0 45128 1 0 46129 1 0 46130 1 0 46131 1 0 47132 1 0 47133 1 0 53134 1 0 53135 1 0 54136 1 0 54137 1 0 56138 1 0 56139 1 0 56140 1 0 57141 1 0 57142 1 0 57143 1 0 58144 1 0 58145 1 0 58146 1 0 M CHG 2 51 -1 55 1 M END