HMDB0061434 RDKit 3D PC(DiMe(9,5)/MonoMe(9,5)) 142143 0 0 0 0 0 0 0 0999 V2000 -6.2288 -6.9728 2.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6376 -5.8397 2.8389 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5258 -5.1174 2.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9231 -4.4872 0.8406 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0105 -3.4663 0.9392 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6685 -2.3212 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 -1.2551 2.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7682 -0.4371 2.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3646 0.8289 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5753 -1.0430 3.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5016 -0.5233 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5938 0.4698 3.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2844 1.7010 2.8968 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2748 2.6987 2.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 2.1614 1.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5032 3.2698 0.7926 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3422 2.7710 -0.3845 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3156 3.8496 -0.7624 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2076 3.5280 -1.8744 C 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 8 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 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 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 37 43 2 0 43 44 1 0 43 45 1 0 45 46 1 0 22 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 55 56 1 0 55 57 1 0 55 58 1 0 10 59 1 0 59 6 1 0 45 35 2 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 0 3 66 1 0 4 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 7 71 1 0 9 72 1 0 9 73 1 0 9 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 15 84 1 0 16 85 1 0 16 86 1 0 17 87 1 0 17 88 1 0 18 89 1 0 18 90 1 0 22 91 1 0 23 92 1 0 23 93 1 0 27 94 1 0 27 95 1 0 28 96 1 0 28 97 1 0 29 98 1 0 29 99 1 0 30100 1 0 30101 1 0 31102 1 0 31103 1 0 32104 1 0 32105 1 0 33106 1 0 33107 1 0 34108 1 0 34109 1 0 38110 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 42120 1 0 44121 1 0 44122 1 0 44123 1 0 46124 1 0 46125 1 0 46126 1 0 47127 1 0 47128 1 0 51129 1 0 53130 1 0 53131 1 0 54132 1 0 54133 1 0 56134 1 0 56135 1 0 56136 1 0 57137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 58142 1 0 M CHG 1 55 1 M END