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26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 -6.0573 -3.8448 3.7464 -2.1711 6.4578 -2.7743 1.9579 -3.7939 4.0276 6.9949 -0.8726 -1.69 -1.8518 -0.1026 0.1359 -3.8229 -3.1635 1.0678 1.3116 -1.6706 -2.9072 -4.8766 -2.9362 -0.5789 3.294 -3.109 -1.9249 -0.7653 -2.0142 -2.2672 5.1012 5.3304 6.1676 -3.4755 4.6332 6.444 -1.0253 -2.1909 -0.7856 0.3071 0.5464 -0.3757 -4.3072 1.6009 0.7224 0.9898 2.0041 -4.7616 -4.5476 -5.1243 0.4119 -4.1019 -0.9301 -1.9318 0.0819 -6.715 3.9162 -3.2576 -1.5367 -2.2562 -4.2035 -3.7922 -3.4199 4.9339 4.8711 3.5472 6.53 5.634 7.3768 0.821 3.6925 0.6043 -5.8063 -1.5898 2.3455 1.4305 -1.2059 1.0248 -0.6286 0.7986 2.1165 -0.3054 0.4485 1.0125 1.3025 -0.0315 1.3934 1.9165 -1.7201 -2.2523 1.4939 3.5164 -2.6089 0.9975 -3.6169 4.6121 -3.976 -4.4715 5.809 0.1749 -1.0996 0.4162 -6.2517 -1.9972 1.6351 2.9773 2.0568 0.4441 -0.5647 0.0418 1.4205 1.3797 1.0568 2.414 2.9468 1.9475 -1.2924 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18337110060398373818 4073 2 18411976963128028538 4144715 1 18341894096137341032 463206 1 17541664250057525210 6058803 2 17970084424566253732 6679774 75 17608687965913878042 6697151 62 17766556138242112807 70251023 43 17469044823042016115 79837 15 18338528434449786691 9961470 85 18337946784531551266 9981440 41 18264779757627926993 Shape Multipoles 8 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 686.61 13.46 7.77 1.57 26.23 5.43 0.44 0.94 -4.58 -13.84 -4.3 1.46 -1 0.46 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 1482.731 Shape Volume 7 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 376.2 Conformer RMSD 7 2012.11.26 1 Diverse Conformer ID List 6 2012.11.26 1 145 63 66 73 50 27 56 74 114 128 18 42 142 12 75 32 61 62 131 120 58 16 89 65 111 43 122 22 46 117 5 21 112 126 152 52 144 106 141 24 35 99 41 138 71 60 134 140 123 100 86 104 54 28 51 91 132 109 136 98 76 57 36 139 113 146 17 135 72 67 45 107 147 125 68 53 94 37 64 102 133 124 14 118 26 96 130 148 79 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36 1 0 1 0 0 0 0 1 2