Number of particles = 310 A = 1 Angstrom (basic length-scale) H0(1,1) = 13.0962 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 78.7315 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.63587 A .NO_VELOCITY. entry_count = 7 auxiliary[0] = id auxiliary[1] = v_mass_metal auxiliary[2] = v_csym_metal auxiliary[3] = v_particle_eng_metal 63.546000 Cu 0.0589695 0.0054238 8.58804e-18 160 63.546 0.420339 -3.4074 63.546000 Cu 0.0185904 0.0385918 1 165 63.546 0.0916949 -3.42654 63.546000 Cu 0.208898 0.0463668 0 166 63.546 0.0477371 -3.41522 63.546000 Cu 0.132195 0.026063 0.5 167 63.546 0.048575 -3.41146 63.546000 Cu 0.245031 0.014997 0 169 63.546 0.361693 -3.39401 63.546000 Cu 0.324881 0.0338185 0.5 172 63.546 0.0878276 -3.41618 63.546000 Cu 0.44111 0.019757 1 170 63.546 0.0468905 -3.41618 63.546000 Cu 0.364097 0.00233681 0.5 171 63.546 0.348982 -3.40474 63.546000 Cu 0.558969 0.0054238 0.5 173 63.546 0.420339 -3.4074 63.546000 Cu 0.403041 0.0522001 1 183 63.546 0.00936052 -3.42033 63.546000 Cu 0.51859 0.0385918 0.5 185 63.546 0.0916949 -3.42654 63.546000 Cu 0.632195 0.026063 1 187 63.546 0.048575 -3.41146 63.546000 Cu 0.864097 0.00233681 0 159 63.546 0.348982 -3.40474 63.546000 Cu 0.94111 0.019757 0.5 161 63.546 0.0468905 -3.41618 63.546000 Cu 0.903041 0.0522001 0.5 163 63.546 0.00936052 -3.42033 63.546000 Cu 0.824881 0.0338185 1 188 63.546 0.0878276 -3.41618 63.546000 Cu 0.745031 0.014997 0.5 189 63.546 0.361693 -3.39401 63.546000 Cu 0.708898 0.0463668 0.5 190 63.546 0.0477371 -3.41522 63.546000 Cu 0.0947481 0.0585254 0.5 168 63.546 0.00821754 -3.42101 63.546000 Cu 0.0576566 0.0907618 0.5 177 63.546 0.00175796 -3.42248 63.546000 Cu 0.172149 0.0782065 1 179 63.546 0.00714226 -3.4201 63.546000 Cu 0.28725 0.0655189 0.5 181 63.546 0.016643 -3.41947 63.546000 Cu 0.250221 0.09745 0.5 182 63.546 0.00330849 -3.4215 63.546000 Cu 0.365379 0.0844106 8.94588e-19 180 63.546 0.00161665 -3.42273 63.546000 Cu 0.594748 0.0585254 1 184 63.546 0.00821754 -3.42101 63.546000 Cu 0.480351 0.0712276 0.5 186 63.546 0.0171765 -3.42492 63.546000 Cu 0.443182 0.103573 0.5 201 63.546 0.00302779 -3.42379 63.546000 Cu 0.557657 0.0907618 1 203 63.546 0.00175796 -3.42248 63.546000 Cu 0.672149 0.0782065 0.5 205 63.546 0.00714226 -3.4201 63.546000 Cu 0.980351 0.0712276 1 162 63.546 0.0171765 -3.42492 63.546000 Cu 0.865379 0.0844106 0.5 164 63.546 0.00161665 -3.42273 63.546000 Cu 0.943182 0.103573 0 175 63.546 0.00302779 -3.42379 63.546000 Cu 0.750221 0.09745 4.77113e-19 204 63.546 0.00330849 -3.4215 63.546000 Cu 0.78725 0.0655189 0 207 63.546 0.016643 -3.41947 63.546000 Cu 0.135477 0.110223 6.83465e-17 176 63.546 0.0013821 -3.42158 63.546000 Cu 0.0211193 0.122946 0.5 178 63.546 0.000596983 -3.42258 63.546000 Cu 0.0995741 0.142305 2.41002e-16 195 63.546 0.000116767 -3.42225 63.546000 Cu 0.292401 0.148729 8.93991e-17 196 63.546 9.10058e-05 -3.42277 63.546000 Cu 0.213906 0.129503 0.5 197 63.546 0.000737671 -3.42215 63.546000 Cu 0.328484 0.116576 2.42254e-16 199 63.546 0.000324498 -3.42295 63.546000 Cu 0.521119 0.122946 1.20948e-16 200 63.546 0.000596983 -3.42258 63.546000 Cu 0.406823 0.135795 0.5 202 63.546 0.000517321 -3.42319 63.546000 Cu 0.635477 0.110223 0.5 206 63.546 0.0013821 -3.42158 63.546000 Cu 0.485229 0.155099 3.22648e-17 219 63.546 0.00033368 -3.42275 63.546000 Cu 0.599574 0.142305 0.5 221 63.546 0.000116767 -3.42225 63.546000 Cu 0.906823 0.135795 4.83674e-16 174 63.546 0.000517321 -3.42319 63.546000 Cu 0.985229 0.155099 0.5 193 63.546 0.00033368 -3.42275 63.546000 Cu 0.713906 0.129503 1.32459e-16 223 63.546 0.000737671 -3.42215 63.546000 Cu 0.828484 0.116576 0.5 224 63.546 0.000324498 -3.42295 63.546000 Cu 0.792401 0.148729 0.5 225 63.546 9.10058e-05 -3.42277 63.546000 Cu 0.063317 0.174428 4.80394e-16 192 63.546 0.000339929 -3.42253 63.546000 Cu 0.17795 0.16161 0.5 198 63.546 0.000500388 -3.42253 63.546000 Cu 0.0259041 0.20654 0 211 63.546 0.000149826 -3.42261 63.546000 Cu 0.140937 0.193719 0.5 213 63.546 0.000187182 -3.42246 63.546000 Cu 0.25595 0.180857 5.77904e-17 215 63.546 0.000285842 -3.4226 63.546000 Cu 0.333529 0.200081 0.5 218 63.546 0.000104678 -3.42261 63.546000 Cu 0.448561 0.187231 6.46489e-17 216 63.546 0.000356184 -3.4226 63.546000 Cu 0.37074 0.16796 0.5 217 63.546 0.000484995 -3.4228 63.546000 Cu 0.563317 0.174428 0.5 222 63.546 0.000339929 -3.42253 63.546000 Cu 0.525904 0.20654 0.5 237 63.546 0.000149826 -3.42261 63.546000 Cu 0.640937 0.193719 1.97227e-16 239 63.546 0.000187182 -3.42246 63.546000 Cu 0.67795 0.16161 3.10601e-16 220 63.546 0.000500388 -3.42253 63.546000 Cu 0.87074 0.16796 2.40644e-16 191 63.546 0.000484995 -3.4228 63.546000 Cu 0.948561 0.187231 0.5 194 63.546 0.000356184 -3.4226 63.546000 Cu 0.833529 0.200081 1.74325e-16 240 63.546 0.000104678 -3.42261 63.546000 Cu 0.75595 0.180857 0.5 241 63.546 0.000285842 -3.4226 63.546000 Cu 0.218546 0.212948 0 212 63.546 2.56732e-05 -3.42248 63.546000 Cu 0.10367 0.225802 0.5 214 63.546 3.63293e-05 -3.4226 63.546000 Cu 0.0664847 0.25791 0.5 229 63.546 5.56205e-05 -3.4227 63.546000 Cu 0.181391 0.245043 0 231 63.546 1.1339e-05 -3.42265 63.546000 Cu 0.296279 0.232187 0.5 233 63.546 7.12404e-05 -3.42267 63.546000 Cu 0.373961 0.251469 3.50142e-16 232 63.546 1.03758e-05 -3.42268 63.546000 Cu 0.411068 0.219356 1.82556e-16 235 63.546 5.92459e-05 -3.42272 63.546000 Cu 0.60367 0.225802 6.68555e-17 236 63.546 3.63293e-05 -3.4226 63.546000 Cu 0.48883 0.238645 0.5 238 63.546 3.84268e-05 -3.42271 63.546000 Cu 0.566485 0.25791 4.72342e-17 255 63.546 5.56205e-05 -3.4227 63.546000 Cu 0.681391 0.245043 0.5 257 63.546 1.1339e-05 -3.42265 63.546000 Cu 0.98883 0.238645 0 208 63.546 3.84268e-05 -3.42271 63.546000 Cu 0.911068 0.219356 0.5 209 63.546 5.92459e-05 -3.42272 63.546000 Cu 0.873961 0.251469 0.5 210 63.546 1.03758e-05 -3.42268 63.546000 Cu 0.718546 0.212948 0.5 242 63.546 2.56732e-05 -3.42248 63.546000 Cu 0.796279 0.232187 6.56031e-19 259 63.546 7.12404e-05 -3.42267 63.546000 Cu 0.25911 0.264296 0.5 234 63.546 7.56737e-05 -3.42272 63.546000 Cu 0.144314 0.277153 6.01759e-17 228 63.546 7.65137e-06 -3.42276 63.546000 Cu 0.0295339 0.290022 0.5 230 63.546 6.99306e-05 -3.42282 63.546000 Cu 0.107316 0.309257 2.38557e-19 247 63.546 4.56041e-05 -3.42262 63.546000 Cu 0.29998 0.315644 0 248 63.546 0.000214536 -3.42227 63.546000 Cu 0.222154 0.296392 0.5 249 63.546 0.000101473 -3.42241 63.546000 Cu 0.337032 0.283567 0 251 63.546 7.32574e-05 -3.42252 63.546000 Cu 0.529534 0.290022 1 252 63.546 6.99306e-05 -3.42282 63.546000 Cu 0.451701 0.270759 0.5 253 63.546 6.85514e-05 -3.42259 63.546000 Cu 0.4147 0.302866 0.5 254 63.546 0.000115786 -3.42272 63.546000 Cu 0.644314 0.277153 0.5 258 63.546 7.65137e-06 -3.42276 63.546000 Cu 0.607316 0.309257 0.5 273 63.546 4.56041e-05 -3.42262 63.546000 Cu 0.75911 0.264296 0 256 63.546 7.56737e-05 -3.42272 63.546000 Cu 0.9147 0.302866 7.16863e-17 226 63.546 0.000115786 -3.42272 63.546000 Cu 0.951701 0.270759 3.64395e-17 227 63.546 6.85514e-05 -3.42259 63.546000 Cu 0.722154 0.296392 0 275 63.546 0.000101473 -3.42241 63.546000 Cu 0.837032 0.283567 0.5 276 63.546 7.32574e-05 -3.42252 63.546000 Cu 0.79998 0.315644 0.5 277 63.546 0.000214536 -3.42227 63.546000 Cu 0.0703243 0.341355 1 244 63.546 0.000235136 -3.42284 63.546000 Cu 0.185233 0.328445 0.5 250 63.546 0.000617672 -3.42217 63.546000 Cu 0.148385 0.360466 0.5 265 63.546 0.00296219 -3.42134 63.546000 Cu 0.263229 0.347708 1 267 63.546 0.00100422 -3.42173 63.546000 Cu 0.340883 0.367136 0.5 270 63.546 0.00160508 -3.42262 63.546000 Cu 0.455418 0.354337 0 268 63.546 0.00281402 -3.42382 63.546000 Cu 0.37789 0.334985 0.5 269 63.546 0.000407967 -3.42277 63.546000 Cu 0.492512 0.322152 1 271 63.546 0.00045396 -3.42313 63.546000 Cu 0.570324 0.341355 0.5 274 63.546 0.000235136 -3.42284 63.546000 Cu 0.648385 0.360466 1 291 63.546 0.00296219 -3.42134 63.546000 Cu 0.685233 0.328445 0 272 63.546 0.000617672 -3.42217 63.546000 Cu 0.87789 0.334985 8.34949e-19 243 63.546 0.000407967 -3.42277 63.546000 Cu 0.992512 0.322152 0.5 245 63.546 0.00045396 -3.42313 63.546000 Cu 0.955418 0.354337 0.5 246 63.546 0.00281402 -3.42382 63.546000 Cu 0.840883 0.367136 1 292 63.546 0.00160508 -3.42262 63.546000 Cu 0.763229 0.347708 0.5 293 63.546 0.00100422 -3.42173 63.546000 Cu 0.0331983 0.373475 1 263 63.546 0.00165008 -3.42267 63.546000 Cu 0.226466 0.379696 1 264 63.546 0.00683021 -3.41994 63.546000 Cu 0.111541 0.392347 0.5 266 63.546 0.0179431 -3.4193 63.546000 Cu 0.19029 0.411514 1 283 63.546 0.0463999 -3.41445 63.546000 Cu 0.304098 0.399377 0.5 285 63.546 0.00917458 -3.42092 63.546000 Cu 0.380716 0.419281 1 284 63.546 0.0936327 -3.42692 63.546000 Cu 0.418249 0.38666 1 287 63.546 0.0177411 -3.42511 63.546000 Cu 0.611541 0.392347 1 288 63.546 0.0179431 -3.4193 63.546000 Cu 0.533198 0.373475 0.5 289 63.546 0.00165008 -3.42267 63.546000 Cu 0.495982 0.40564 0.5 290 63.546 0.00868366 -3.42052 63.546000 Cu 0.69029 0.411514 0.5 307 63.546 0.0463999 -3.41445 63.546000 Cu 0.995982 0.40564 1 260 63.546 0.00868366 -3.42052 63.546000 Cu 0.918249 0.38666 0.5 261 63.546 0.0177411 -3.42511 63.546000 Cu 0.880716 0.419281 0.5 262 63.546 0.0936327 -3.42692 63.546000 Cu 0.726466 0.379696 0.5 294 63.546 0.00683021 -3.41994 63.546000 Cu 0.804098 0.399377 1 309 63.546 0.00917458 -3.42092 63.546000 Cu 0.154966 0.442854 1 280 63.546 0.368537 -3.39104 63.546000 Cu 0.0746463 0.424018 0.5 281 63.546 0.0928619 -3.41632 63.546000 Cu 0.0361617 0.455466 0.5 282 63.546 0.374275 -3.40498 63.546000 Cu 0.267447 0.431832 0.5 286 63.546 0.0533271 -3.41051 63.546000 Cu 0.229645 0.464993 0.5 299 63.546 5.3542 -3.27507 63.546000 Cu 0.116201 0.472637 1 297 63.546 7.72217 -3.13275 63.546000 Cu 0.341214 0.452447 1 301 63.546 0.426404 -3.40904 63.546000 Cu 0.536162 0.455466 1 302 63.546 0.374275 -3.40498 63.546000 Cu 0.458776 0.43807 0.5 303 63.546 0.0447523 -3.41648 63.546000 Cu 0.419364 0.470689 0.5 304 63.546 0.498155 -3.3954 63.546000 Cu 0.574646 0.424018 1 305 63.546 0.0928619 -3.41632 63.546000 Cu 0.654966 0.442854 0.5 308 63.546 0.368537 -3.39104 63.546000 Cu 0.616201 0.472637 0.5 16 63.546 7.72217 -3.13275 63.546000 Cu 0.841214 0.452447 0.5 5 63.546 0.426404 -3.40904 63.546000 Cu 0.729645 0.464993 1 6 63.546 5.3542 -3.27507 63.546000 Cu 0.919364 0.470689 1 278 63.546 0.498155 -3.3954 63.546000 Cu 0.958776 0.43807 0 279 63.546 0.0447523 -3.41648 63.546000 Cu 0.767447 0.431832 1 306 63.546 0.0533271 -3.41051 63.546000 Cu 0.0394428 0.518692 0.5 2 63.546 0.358568 -3.40324 63.546000 Cu 0.118622 0.501515 1 14 63.546 7.65728 -3.13917 63.546000 Cu 0.305091 0.487072 1 298 63.546 4.67008 -3.43085 63.546000 Cu 0.232424 0.509301 0.5 300 63.546 5.41301 -3.27714 63.546000 Cu 0.00903355 0.487118 0.5 296 63.546 4.02653 -3.3459 63.546000 Cu 0.539443 0.518692 0 3 63.546 0.358568 -3.40324 63.546000 Cu 0.618622 0.501515 0.5 4 63.546 7.65728 -3.13917 63.546000 Cu 0.344861 0.52173 1 17 63.546 0.428805 -3.40726 63.546000 Cu 0.509034 0.487118 1 158 63.546 4.02653 -3.3459 63.546000 Cu 0.421572 0.503478 0.5 310 63.546 0.474666 -3.39002 63.546000 Cu 0.732424 0.509301 1 157 63.546 5.41301 -3.27714 63.546000 Cu 0.805091 0.487072 0.5 1 63.546 4.67008 -3.43085 63.546000 Cu 0.844861 0.52173 0.5 8 63.546 0.428805 -3.40726 63.546000 Cu 0.921572 0.503478 1 295 63.546 0.474666 -3.39002 63.546000 Cu 0.00355882 0.568459 6.24422e-17 11 63.546 0.00930338 -3.41913 63.546000 Cu 0.0804654 0.550134 0.5 12 63.546 0.0937427 -3.41522 63.546000 Cu 0.159082 0.531311 1 15 63.546 0.355351 -3.39492 63.546000 Cu 0.27262 0.542341 0.5 20 63.546 0.0492311 -3.41281 63.546000 Cu 0.197261 0.562632 1.21425e-16 32 63.546 0.0481727 -3.41572 63.546000 Cu 0.312303 0.574737 0.5 34 63.546 0.00904456 -3.4216 63.546000 Cu 0.38704 0.554845 4.25824e-17 18 63.546 0.0963374 -3.42631 63.546000 Cu 0.463394 0.536077 0.5 19 63.546 0.0443573 -3.41448 63.546000 Cu 0.580465 0.550134 1.74564e-16 21 63.546 0.0937427 -3.41522 63.546000 Cu 0.503559 0.568459 0.5 24 63.546 0.00930338 -3.41913 63.546000 Cu 0.659082 0.531311 0.5 9 63.546 0.355351 -3.39492 63.546000 Cu 0.77262 0.542341 0 7 63.546 0.0492311 -3.41281 63.546000 Cu 0.963394 0.536077 1 10 63.546 0.0443573 -3.41448 63.546000 Cu 0.88704 0.554845 0.5 13 63.546 0.0963374 -3.42631 63.546000 Cu 0.697261 0.562632 0.5 23 63.546 0.0481727 -3.41572 63.546000 Cu 0.812303 0.574737 2.38915e-16 25 63.546 0.00904456 -3.4216 63.546000 Cu 0.0438217 0.600591 1.5202e-16 29 63.546 0.00177026 -3.42208 63.546000 Cu 0.23661 0.5944 8.49262e-17 33 63.546 0.00785154 -3.42023 63.546000 Cu 0.120421 0.581767 0.5 35 63.546 0.019111 -3.41885 63.546000 Cu 0.160081 0.613589 0.5 49 63.546 0.0032168 -3.42107 63.546000 Cu 0.276016 0.626325 1.21187e-16 50 63.546 0.00116032 -3.42175 63.546000 Cu 0.620421 0.581767 1.19934e-16 22 63.546 0.019111 -3.41885 63.546000 Cu 0.427747 0.58742 3.26763e-16 36 63.546 0.0185215 -3.42487 63.546000 Cu 0.467736 0.619694 1.29119e-16 37 63.546 0.00298037 -3.42383 63.546000 Cu 0.543822 0.600591 0.5 38 63.546 0.00177026 -3.42208 63.546000 Cu 0.352093 0.606911 0.5 39 63.546 0.00189354 -3.42291 63.546000 Cu 0.660081 0.613589 3.61831e-16 40 63.546 0.0032168 -3.42107 63.546000 Cu 0.852093 0.606911 1.54823e-16 26 63.546 0.00189354 -3.42291 63.546000 Cu 0.927747 0.58742 0.5 27 63.546 0.0185215 -3.42487 63.546000 Cu 0.73661 0.5944 0.5 28 63.546 0.00785154 -3.42023 63.546000 Cu 0.967736 0.619694 0.5 31 63.546 0.00298037 -3.42383 63.546000 Cu 0.776016 0.626325 0.5 42 63.546 0.00116032 -3.42175 63.546000 Cu 0.0837267 0.632663 1.19815e-16 30 63.546 0.000235322 -3.4225 63.546000 Cu 0.00751206 0.65183 0.5 46 63.546 0.000521788 -3.42314 63.546000 Cu 0.199692 0.645544 0.5 53 63.546 0.000573923 -3.42196 63.546000 Cu 0.123534 0.664711 2.40525e-16 66 63.546 3.60443e-05 -3.42255 63.546000 Cu 0.239572 0.677561 0.5 68 63.546 0.000188775 -3.42229 63.546000 Cu 0.315602 0.658325 0 51 63.546 0.000167988 -3.42226 63.546000 Cu 0.0474261 0.683919 0.5 48 63.546 9.9461e-05 -3.42281 63.546000 Cu 0.583727 0.632663 0.5 43 63.546 0.000235322 -3.4225 63.546000 Cu 0.391756 0.639014 0.5 52 63.546 0.00041658 -3.42296 63.546000 Cu 0.507512 0.65183 3.48293e-16 54 63.546 0.000521788 -3.42314 63.546000 Cu 0.623534 0.664711 0.5 56 63.546 3.60443e-05 -3.42255 63.546000 Cu 0.431506 0.671102 0.5 57 63.546 6.04126e-05 -3.42273 63.546000 Cu 0.547426 0.683919 4.96615e-16 55 63.546 9.9461e-05 -3.42281 63.546000 Cu 0.699692 0.645544 1.19994e-16 41 63.546 0.000573923 -3.42196 63.546000 Cu 0.891756 0.639014 4.83018e-16 44 63.546 0.00041658 -3.42296 63.546000 Cu 0.931506 0.671102 7.24079e-16 45 63.546 6.04126e-05 -3.42273 63.546000 Cu 0.815602 0.658325 0.5 47 63.546 0.000167988 -3.42226 63.546000 Cu 0.739572 0.677561 6.04145e-16 58 63.546 0.000188775 -3.42229 63.546000 Cu 0.0870042 0.715992 0.5 64 63.546 1.95368e-05 -3.42269 63.546000 Cu 0.163232 0.696762 3.15193e-16 67 63.546 2.50946e-05 -3.42266 63.546000 Cu 0.279124 0.709599 0.5 72 63.546 3.34258e-05 -3.4226 63.546000 Cu 0.202774 0.72882 1.10929e-17 84 63.546 3.08686e-06 -3.42252 63.546000 Cu 0.010622 0.735223 4.1324e-16 63 63.546 2.32035e-05 -3.42265 63.546000 Cu 0.355408 0.690358 2.79111e-16 69 63.546 4.69233e-05 -3.42248 63.546000 Cu 0.394901 0.722411 1.76174e-16 70 63.546 5.8323e-06 -3.42261 63.546000 Cu 0.471203 0.703163 0.5 71 63.546 2.99049e-05 -3.42269 63.546000 Cu 0.587004 0.715992 4.07336e-17 73 63.546 1.95368e-05 -3.42269 63.546000 Cu 0.663232 0.696762 0.5 61 63.546 2.50946e-05 -3.42266 63.546000 Cu 0.510622 0.735223 0.5 76 63.546 2.32035e-05 -3.42265 63.546000 Cu 0.779124 0.709599 5.33711e-16 59 63.546 3.34258e-05 -3.4226 63.546000 Cu 0.855408 0.690358 0.5 60 63.546 4.69233e-05 -3.42248 63.546000 Cu 0.971203 0.703163 6.55614e-16 62 63.546 2.99049e-05 -3.42269 63.546000 Cu 0.894901 0.722411 0.5 65 63.546 5.8323e-06 -3.42261 63.546000 Cu 0.702774 0.72882 0.5 75 63.546 3.08686e-06 -3.42252 63.546000 Cu 0.0500529 0.767296 4.53973e-16 81 63.546 8.22072e-05 -3.42256 63.546000 Cu 0.242245 0.760862 2.4464e-16 85 63.546 0.000118167 -3.42258 63.546000 Cu 0.126427 0.748045 0.5 87 63.546 2.5504e-05 -3.42252 63.546000 Cu 0.165613 0.780093 0.5 101 63.546 7.65377e-05 -3.42251 63.546000 Cu 0.318557 0.741644 0.5 86 63.546 1.21518e-05 -3.42251 63.546000 Cu 0.626427 0.748045 4.39541e-17 74 63.546 2.5504e-05 -3.42252 63.546000 Cu 0.43441 0.754474 2.05755e-17 88 63.546 0.000106025 -3.42267 63.546000 Cu 0.473445 0.78656 7.18652e-17 89 63.546 0.000106416 -3.42291 63.546000 Cu 0.550053 0.767296 0.5 90 63.546 8.22072e-05 -3.42256 63.546000 Cu 0.357906 0.773708 0.5 91 63.546 7.45056e-05 -3.4229 63.546000 Cu 0.665613 0.780093 2.95274e-16 92 63.546 7.65377e-05 -3.42251 63.546000 Cu 0.818557 0.741644 0 77 63.546 1.21518e-05 -3.42251 63.546000 Cu 0.857906 0.773708 1.42657e-16 78 63.546 7.45056e-05 -3.4229 63.546000 Cu 0.93441 0.754474 0.5 79 63.546 0.000106025 -3.42267 63.546000 Cu 0.742245 0.760862 0.5 80 63.546 0.000118167 -3.42258 63.546000 Cu 0.973445 0.78656 0.5 83 63.546 0.000106416 -3.42291 63.546000 Cu 0.0889611 0.799352 0 82 63.546 0.000102487 -3.42241 63.546000 Cu 0.0124924 0.818667 0.5 98 63.546 0.000639038 -3.4229 63.546000 Cu 0.281218 0.792929 1.97585e-16 102 63.546 8.7458e-05 -3.42275 63.546000 Cu 0.204638 0.812131 0.5 105 63.546 0.000556581 -3.42205 63.546000 Cu 0.12815 0.831368 1.89474e-16 118 63.546 0.00120347 -3.42164 63.546000 Cu 0.320493 0.825014 8.07515e-17 103 63.546 0.0003696 -3.42258 63.546000 Cu 0.588961 0.799352 0.5 95 63.546 0.000102487 -3.42241 63.546000 Cu 0.396832 0.805824 0.5 104 63.546 0.000401436 -3.42326 63.546000 Cu 0.512492 0.818667 1.20173e-16 106 63.546 0.000639038 -3.4229 63.546000 Cu 0.62815 0.831368 0.5 108 63.546 0.00120347 -3.42164 63.546000 Cu 0.436479 0.837993 0.5 109 63.546 0.00283326 -3.42368 63.546000 Cu 0.704638 0.812131 0 93 63.546 0.000556581 -3.42205 63.546000 Cu 0.781218 0.792929 0.5 94 63.546 8.7458e-05 -3.42275 63.546000 Cu 0.896832 0.805824 1.66811e-16 96 63.546 0.000401436 -3.42326 63.546000 Cu 0.936479 0.837993 1.52676e-16 97 63.546 0.00283326 -3.42368 63.546000 Cu 0.820493 0.825014 0.5 99 63.546 0.0003696 -3.42258 63.546000 Cu 0.052263 0.850785 0.5 100 63.546 0.00181744 -3.42273 63.546000 Cu 0.0917841 0.882973 0.5 116 63.546 0.00861902 -3.4214 63.546000 Cu 0.16785 0.863314 3.34218e-16 119 63.546 0.00725201 -3.42017 63.546000 Cu 0.244193 0.844106 0.5 120 63.546 0.0031699 -3.42106 63.546000 Cu 0.283906 0.875965 0.5 124 63.546 0.0181802 -3.41909 63.546000 Cu 0.552263 0.850785 0 107 63.546 0.00181744 -3.42273 63.546000 Cu 0.360562 0.857111 7.75309e-17 121 63.546 0.00177968 -3.42213 63.546000 Cu 0.40045 0.889284 3.19785e-16 122 63.546 0.00994082 -3.41949 63.546000 Cu 0.476661 0.870294 0.5 123 63.546 0.0185827 -3.42487 63.546000 Cu 0.591784 0.882973 2.65037e-16 125 63.546 0.00861902 -3.4214 63.546000 Cu 0.744193 0.844106 2.08618e-16 110 63.546 0.0031699 -3.42106 63.546000 Cu 0.783906 0.875965 1.05502e-16 111 63.546 0.0181802 -3.41909 63.546000 Cu 0.860562 0.857111 0.5 112 63.546 0.00177968 -3.42213 63.546000 Cu 0.66785 0.863314 0.5 113 63.546 0.00725201 -3.42017 63.546000 Cu 0.976661 0.870294 1.46593e-16 114 63.546 0.0185827 -3.42487 63.546000 Cu 0.90045 0.889284 0.5 117 63.546 0.00994082 -3.41949 63.546000 Cu 0.016719 0.902905 4.98106e-16 115 63.546 0.0969797 -3.42632 63.546000 Cu 0.0584303 0.936058 4.53198e-16 133 63.546 0.432044 -3.40736 63.546000 Cu 0.206572 0.895101 4.61846e-16 136 63.546 0.05008 -3.41564 63.546000 Cu 0.244226 0.92644 4.84807e-16 137 63.546 0.368502 -3.39437 63.546000 Cu 0.13094 0.915421 0.5 139 63.546 0.0497887 -3.41195 63.546000 Cu 0.323206 0.907616 0.5 138 63.546 0.0951938 -3.41553 63.546000 Cu 0.63094 0.915421 4.49381e-16 126 63.546 0.0497887 -3.41195 63.546000 Cu 0.516719 0.902905 0.5 128 63.546 0.0969797 -3.42632 63.546000 Cu 0.440085 0.921714 7.74653e-16 140 63.546 0.0469285 -3.4149 63.546000 Cu 0.55843 0.936058 0.5 142 63.546 0.432044 -3.40736 63.546000 Cu 0.363725 0.939097 0.5 143 63.546 0.363735 -3.40365 63.546000 Cu 0.706572 0.895101 0.5 127 63.546 0.05008 -3.41564 63.546000 Cu 0.823206 0.907616 6.83286e-16 129 63.546 0.0951938 -3.41553 63.546000 Cu 0.863725 0.939097 4.34173e-16 130 63.546 0.363735 -3.40365 63.546000 Cu 0.940085 0.921714 0.5 131 63.546 0.0469285 -3.4149 63.546000 Cu 0.744226 0.92644 0.5 132 63.546 0.368502 -3.39437 63.546000 Cu 0.0967407 0.970732 1.9836e-16 134 63.546 4.69914 -3.42902 63.546000 Cu 0.170567 0.948515 0.5 151 63.546 5.41707 -3.27509 63.546000 Cu 0.284227 0.956248 2.22514e-16 152 63.546 7.6765 -3.13758 63.546000 Cu 0.170797 0.992951 0.5 155 63.546 5.41086 -3.27494 63.546000 Cu 0.284435 0.985158 1 153 63.546 7.70097 -3.13809 63.546000 Cu 0.481238 0.954341 4.95423e-16 141 63.546 0.498582 -3.39227 63.546000 Cu 0.596741 0.970732 0.5 147 63.546 4.69914 -3.42902 63.546000 Cu 0.392805 0.970721 0.5 154 63.546 4.06127 -3.34566 63.546000 Cu 0.481479 0.987145 1.21604e-16 156 63.546 0.489339 -3.39292 63.546000 Cu 0.981479 0.987145 0.5 149 63.546 0.489339 -3.39292 63.546000 Cu 0.981238 0.954341 0.5 135 63.546 0.498582 -3.39227 63.546000 Cu 0.670567 0.948515 2.41181e-16 144 63.546 5.41707 -3.27509 63.546000 Cu 0.670797 0.992951 4.17474e-19 145 63.546 5.41086 -3.27494 63.546000 Cu 0.784227 0.956248 0.5 146 63.546 7.6765 -3.13758 63.546000 Cu 0.892805 0.970721 5.83987e-16 148 63.546 4.06127 -3.34566 63.546000 Cu 0.784435 0.985158 0.5 150 63.546 7.70097 -3.13809