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-0.9267 0.0237 -1.156 -2.5303 -2.119 1.3949 0.4036 -0.5552 -1.1442 2.0611 -0.2626 -0.576 1.5766 1.9552 -1.6258 0.4698 -0.6609 -1.6503 -0.6597 0.4676 -0.4038 -1.311 -1.7046 -0.6422 -0.9997 0.1803 0.7718 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 0051053A00000008 Energy MMFF94 NoEstat 7 1.7.2 Szybki openeye.com 2012.11.26 97.4818 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 60.944 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 10 15 18260830423730175008 10835480 77 18336824175112437613 11186622 174 18342178822303853278 11578080 2 17558253591545176744 12107698 1 18113619001740831824 12128747 34 17386565756989762154 12236239 1 16845579673435118609 12516196 113 8646767794289725229 12596602 18 14129639790448624101 12838862 33 18200864141846302568 13150687 139 18411700959011783959 13402501 40 18333732407547810164 13533116 47 16988567849714407294 13583140 156 18114475529983568290 13673619 4 11239994551296357243 13911987 19 18131915944779103579 14117953 113 18411703179784085324 14725015 67 18187918465544056864 14767858 380 17275102817110518571 14856354 85 15913323611868141045 15131766 46 17171820360439874148 15142383 8 18113056043972435812 15183329 4 18040433274518673400 15849732 13 18260548926830274396 17492 54 17703787007744328991 19319366 153 17846492596133419911 20157964 124 18341614785137981230 20554085 129 17095525063255484795 20567600 254 18334292063434888343 20715895 44 18413672422056626948 21133410 90 17346032402217886160 21344244 246 18059576836740851910 21403212 168 18408599254453828778 21521721 280 18201722855889911747 23227448 37 18339083807980865982 23559900 14 17774437304535020456 249057 3 18413109489747356972 2838139 119 18335699468414984925 335352 9 18343587348449119044 3633792 109 18130512924960564386 4258327 124 18265064694263745700 4325135 7 18202281403464716935 484989 97 17916865862579212855 54039377 194 12035990376125643608 57527293 21 17684122383830886627 6371009 1 18343588434095241136 6669772 16 18334576811140515795 Shape Multipoles 8 1.8.3 OEShape openeye.com 2012.11.26 612.24 20.46 2.74 1.42 5.21 0.74 -0.58 -8.34 2.46 0.97 1.03 -1.41 0.27 1.2 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 1309.167 Shape Volume 7 1.8.3 OEShape openeye.com 2012.11.26 340.7 Conformer RMSD 7 2009.12.11 1 Diverse Conformer ID List 6 2012.02.08 8 242 199 221 78 179 184 159 72 96 15 172 130 65 49 93 88 118 160 76 120 191 238 80 42 177 228 146 68 144 75 17 136 201 158 19 60 38 125 112 187 106 100 205 87 195 110 145 202 162 135 173 234 209 168 58 182 113 214 107 43 71 74 34 217 229 203 61 215 189 16 5 170 67 141 149 69 108 11 35 92 133 4 222 155 216 208 86 14 124 235 223 232 66 147 206 102 163 20 161 95 233 115 154 7 196 204 83 105 94 101 50 31 55 138 25 29 213 89 37 45 200 62 46 126 48 134 13 140 143 54 227 36 188 10 22 175 237 231 117 171 137 119 166 99 28 44 174 180 152 224 39 167 230 181 77 185 122 32 178 211 98 218 24 64 226 26 85 70 9 240 12 225 21 220 90 23 194 148 97 236 128 132 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