HMDB0061441 RDKit 3D PC(MonoMe(11,3)/MonoMe(11,5)) 145146 0 0 0 0 0 0 0 0999 V2000 -12.5340 3.7497 -2.7924 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4707 2.4197 -2.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0090 2.1055 -1.8828 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8351 0.8079 -1.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4522 0.8732 0.2049 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7973 1.9494 0.9813 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2154 3.2642 1.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3066 3.8841 1.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3080 5.3103 2.2824 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3967 2.9156 2.2637 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2553 3.1979 3.1637 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1486 3.9119 2.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 4.1996 3.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8716 4.9074 2.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2822 4.0549 1.6016 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7915 2.7874 2.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2051 1.8288 1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0576 2.4203 0.4561 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5427 1.3918 -0.5259 C 0 0 0 0 0 0 0 0 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90 1 0 18 91 1 0 19 92 1 0 19 93 1 0 20 94 1 0 20 95 1 0 24 96 1 0 25 97 1 0 25 98 1 0 29 99 1 0 29100 1 0 30101 1 0 30102 1 0 31103 1 0 31104 1 0 32105 1 0 32106 1 0 33107 1 0 33108 1 0 34109 1 0 34110 1 0 35111 1 0 35112 1 0 36113 1 0 36114 1 0 37115 1 0 37116 1 0 38117 1 0 38118 1 0 42119 1 0 42120 1 0 43121 1 0 43122 1 0 44123 1 0 44124 1 0 44125 1 0 45126 1 0 47127 1 0 47128 1 0 47129 1 0 48130 1 0 48131 1 0 52132 1 0 54133 1 0 54134 1 0 55135 1 0 55136 1 0 57137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 58142 1 0 59143 1 0 59144 1 0 59145 1 0 M CHG 1 56 1 M END