HMDB0061444 RDKit 3D PC(MonoMe(11,5)/DiMe(11,3)) 148149 0 0 0 0 0 0 0 0999 V2000 -2.3149 3.5418 -2.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8249 2.3094 -3.3912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9278 1.3577 -3.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6244 0.8876 -2.5216 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7517 -0.0928 -2.8653 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3722 -0.5222 -1.5705 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4415 -1.3982 -1.4893 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7071 -1.5357 -0.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7631 -2.3688 0.4624 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7967 -0.7427 0.5561 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7791 -0.6413 2.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 0.2293 2.5726 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 0.2554 4.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5932 0.7715 4.6799 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2531 2.2037 4.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9383 2.4868 5.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5134 3.9001 4.8613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1975 4.1751 5.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8417 5.6148 5.2928 C 0 0 0 0 0 0 0 0 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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 16 87 1 0 16 88 1 0 17 89 1 0 17 90 1 0 18 91 1 0 18 92 1 0 19 93 1 0 19 94 1 0 20 95 1 0 20 96 1 0 24 97 1 0 24 98 1 0 25 99 1 0 26100 1 0 26101 1 0 30102 1 0 32103 1 0 32104 1 0 33105 1 0 33106 1 0 35107 1 0 35108 1 0 35109 1 0 36110 1 0 36111 1 0 36112 1 0 37113 1 0 37114 1 0 37115 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 47128 1 0 47129 1 0 48130 1 0 48131 1 0 49132 1 0 49133 1 0 50134 1 0 50135 1 0 54136 1 0 54137 1 0 55138 1 0 55139 1 0 56140 1 0 56141 1 0 56142 1 0 58143 1 0 58144 1 0 58145 1 0 60146 1 0 60147 1 0 60148 1 0 M CHG 1 34 1 M END