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-0.7875 0.3507 1.5701 1.4718 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2009.12.11 00958FA800000002 Energy MMFF94 NoEstat 7 2.1.0 Szybki TK OpenEye Scientific Software 2019.06.18 92.0056 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 40.61 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 10 15 18114462353498507672 10162869 55 18337105765372523447 10299344 5 13183022917353237037 10411042 1 17910116808045005174 10533779 1 17344334800317366064 10835480 77 18410576188775765891 10951579 204 17242460412683329655 11061554 47 17749100051617206237 11135609 127 18338796844453345020 11315181 36 18060703888906406035 12082328 90 18273215262845083133 12089408 11 16702305637745990955 12522641 24 17895464857520280178 12592606 108 11674881113140045289 13811026 1 18260831497124008373 14118638 360 17917437488208057169 14251764 18 16630809906913251027 14429380 56 18202280308105884776 14444916 359 10879995766109277061 14675020 138 16949997024260571426 150020 25 18409735053701203947 15183329 4 16515689923025825619 15320294 125 14345787271389894922 15840311 113 18273216413743324908 15979999 66 17489864952045838161 16120349 18 18272647965619893232 19301679 30 13334997375926737960 20105231 36 10447931676557596605 20157964 124 18344149185652757886 20554085 129 17240198833076143154 20812841 46 18335134277211211354 21150785 3 16558752325670709953 21360443 126 15697997465790917284 3633792 109 18336831892540700075 437795 160 17604431911923068987 44389302 135 15285624509852050120 4760202 170 18335412466443794277 4874694 18 18334573551571522323 4918590 53 18334868216729811921 5219985 9 16128655241642630577 6201320 215 13912865503694529759 67123 10 18343863330014977751 99344 41 18333450954504917171 Shape Multipoles 8 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 571.99 32.56 2.19 1.17 39.37 0.6 0.25 -10.78 -0.82 -5.03 0.12 0.31 -0.13 2.56 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 1218.347 Shape Volume 7 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 315.5 Conformer RMSD 7 2009.12.11 0.8 Diverse Conformer ID List 6 2012.02.08 2 198 245 15 239 66 196 174 161 9 221 202 306 144 247 188 215 310 280 249 191 57 276 53 173 299 189 165 321 32 236 292 34 6 219 79 304 275 179 242 177 317 251 138 117 277 305 233 17 31 154 195 114 248 59 86 262 27 212 4 26 229 303 136 80 28 61 64 281 24 120 71 193 142 109 51 41 217 11 207 185 279 67 98 263 73 82 308 241 295 113 148 78 168 140 204 166 68 266 29 16 48 255 3 172 55 293 162 302 286 176 274 65 101 270 260 226 222 115 56 103 1 107 297 318 171 291 105 316 88 39 92 62 132 209 77 231 205 237 121 46 127 149 37 145 84 181 85 228 128 314 258 213 211 192 97 49 289 10 155 45 307 319 206 210 170 313 8 296 290 284 157 203 197 272 238 47 163 111 152 19 273 160 118 250 43 143 141 95 76 264 278 269 240 167 122 5 235 70 89 268 158 159 102 243 63 22 96 137 110 14 23 320 300 94 151 42 267 232 224 169 312 83 259 227 40 298 294 131 7 214 106 123 69 252 135 20 271 256 130 283 52 301 216 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0 0 0 0 0 0 0 1 1