Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.2645 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.1856 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.58593 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 0.00158746 0.0571181 4.9555e-17 223 63.546 0.0457004 -3.52505 63.546000 Cu 0.0808457 0.0269176 0 226 63.546 0.681082 -3.41389 63.546000 Cu 0.189661 0.0480064 4.14974e-16 227 63.546 0.0950421 -3.49101 63.546000 Cu 0.167226 0.0215498 0.5 228 63.546 0.496164 -3.45823 63.546000 Cu 0.0976667 0.0523873 0.5 229 63.546 0.0762285 -3.50087 63.546000 Cu 0.261951 0.019786 1 230 63.546 0.57155 -3.48913 63.546000 Cu 0.382979 0.0389947 1 231 63.546 0.062195 -3.51261 63.546000 Cu 0.367308 0.0163673 0.5 232 63.546 3.61404 -3.42742 63.546000 Cu 0.283983 0.0433167 0.5 233 63.546 0.121695 -3.51885 63.546000 Cu 0.466414 0.0115054 1 234 63.546 8.95556 -3.2843 63.546000 Cu 0.485405 0.0337187 0.5 237 63.546 0.616958 -3.44991 63.546000 Cu 0.501587 0.0571181 1 255 63.546 0.0457004 -3.52505 63.546000 Cu 0.667226 0.0215498 0.5 213 63.546 0.496164 -3.45823 63.546000 Cu 0.689661 0.0480064 1.66322e-16 218 63.546 0.0950421 -3.49101 63.546000 Cu 0.580846 0.0269176 0 235 63.546 0.681082 -3.41389 63.546000 Cu 0.597667 0.0523873 0.5 257 63.546 0.0762285 -3.50087 63.546000 Cu 0.761951 0.019786 7.31987e-17 212 63.546 0.57155 -3.48913 63.546000 Cu 0.966414 0.0115054 1 214 63.546 8.95556 -3.2843 63.546000 Cu 0.867308 0.0163673 0.5 215 63.546 3.61404 -3.42742 63.546000 Cu 0.783983 0.0433167 0.5 220 63.546 0.121695 -3.51885 63.546000 Cu 0.882979 0.0389947 4.33568e-17 222 63.546 0.062195 -3.51261 63.546000 Cu 0.985405 0.0337187 0.5 224 63.546 0.616958 -3.44991 63.546000 Cu 0.0379379 0.10568 3.02349e-19 244 63.546 0.001287 -3.52073 63.546000 Cu 0.0191426 0.0813435 0.5 245 63.546 0.0058387 -3.52444 63.546000 Cu 0.114828 0.07695 0 247 63.546 0.00992465 -3.51661 63.546000 Cu 0.230346 0.0962709 1.58703e-16 248 63.546 0.00206966 -3.51974 63.546000 Cu 0.210498 0.0723537 0.5 249 63.546 0.0191433 -3.51309 63.546000 Cu 0.133918 0.101058 0.5 250 63.546 0.0032936 -3.51999 63.546000 Cu 0.30608 0.0673241 2.87232e-16 251 63.546 0.00735712 -3.52018 63.546000 Cu 0.423134 0.0861335 3.02349e-19 252 63.546 0.00759613 -3.5248 63.546000 Cu 0.403391 0.0621776 0.5 253 63.546 0.0243121 -3.52653 63.546000 Cu 0.326907 0.0912242 0.5 254 63.546 0.00232228 -3.5213 63.546000 Cu 0.346362 0.115238 0 273 63.546 0.00150589 -3.52219 63.546000 Cu 0.442331 0.110364 0.5 275 63.546 0.00115719 -3.52167 63.546000 Cu 0.710498 0.0723537 0.5 221 63.546 0.0191433 -3.51309 63.546000 Cu 0.730346 0.0962709 3.32584e-19 239 63.546 0.00206966 -3.51974 63.546000 Cu 0.614828 0.07695 9.07047e-20 256 63.546 0.00992465 -3.51661 63.546000 Cu 0.519143 0.0813435 0.5 258 63.546 0.0058387 -3.52444 63.546000 Cu 0.537938 0.10568 2.15575e-17 277 63.546 0.001287 -3.52073 63.546000 Cu 0.633918 0.101058 0.5 278 63.546 0.0032936 -3.51999 63.546000 Cu 0.80608 0.0673241 1.45793e-16 219 63.546 0.00735712 -3.52018 63.546000 Cu 0.903391 0.0621776 0.5 225 63.546 0.0243121 -3.52653 63.546000 Cu 0.846362 0.115238 1.0945e-17 240 63.546 0.00150589 -3.52219 63.546000 Cu 0.826907 0.0912242 0.5 241 63.546 0.00232228 -3.5213 63.546000 Cu 0.923134 0.0861335 3.9003e-17 243 63.546 0.00759613 -3.5248 63.546000 Cu 0.942331 0.110364 0.5 246 63.546 0.00115719 -3.52167 63.546000 Cu 0.0767977 0.15389 0 266 63.546 0.000169801 -3.52096 63.546000 Cu 0.0573408 0.129841 0.5 267 63.546 0.000798763 -3.52039 63.546000 Cu 0.153536 0.125047 1 269 63.546 0.000462812 -3.52123 63.546000 Cu 0.249973 0.120168 0.5 271 63.546 0.000358247 -3.52199 63.546000 Cu 0.173038 0.149046 0.5 272 63.546 4.48201e-05 -3.52165 63.546000 Cu 0.192391 0.173071 2.0085e-16 290 63.546 6.19143e-05 -3.52158 63.546000 Cu 0.269321 0.144179 2.43875e-16 270 63.546 0.000233575 -3.52207 63.546000 Cu 0.461431 0.134574 1 274 63.546 0.000214596 -3.52062 63.546000 Cu 0.365498 0.13934 0.5 276 63.546 0.000320021 -3.52171 63.546000 Cu 0.28855 0.168234 0.5 292 63.546 0.000113967 -3.52153 63.546000 Cu 0.38463 0.163444 0 294 63.546 2.2319e-05 -3.52119 63.546000 Cu 0.4807 0.158679 0.5 296 63.546 0.000122685 -3.52077 63.546000 Cu 0.653536 0.125047 0 238 63.546 0.000462812 -3.52123 63.546000 Cu 0.692391 0.173071 1 259 63.546 6.19143e-05 -3.52158 63.546000 Cu 0.673038 0.149046 0.5 260 63.546 4.48201e-05 -3.52165 63.546000 Cu 0.557341 0.129841 0.5 279 63.546 0.000798763 -3.52039 63.546000 Cu 0.576798 0.15389 1.01589e-16 298 63.546 0.000169801 -3.52096 63.546000 Cu 0.749973 0.120168 0.5 242 63.546 0.000358247 -3.52199 63.546000 Cu 0.769321 0.144179 1 261 63.546 0.000233575 -3.52207 63.546000 Cu 0.88463 0.163444 1 262 63.546 2.2319e-05 -3.52119 63.546000 Cu 0.865498 0.13934 0.5 263 63.546 0.000320021 -3.52171 63.546000 Cu 0.78855 0.168234 0.5 264 63.546 0.000113967 -3.52153 63.546000 Cu 0.961431 0.134574 1.88908e-16 265 63.546 0.000214596 -3.52062 63.546000 Cu 0.9807 0.158679 0.5 268 63.546 0.000122685 -3.52077 63.546000 Cu 0.115432 0.201955 1.11264e-17 287 63.546 9.77094e-06 -3.52154 63.546000 Cu 0.0961833 0.177919 0.5 288 63.546 3.17712e-05 -3.52141 63.546000 Cu 0.0192241 0.206788 0.5 289 63.546 1.50198e-05 -3.52147 63.546000 Cu 0.211616 0.197125 0.5 293 63.546 4.09432e-05 -3.52154 63.546000 Cu 0.0384564 0.230831 1.35845e-16 308 63.546 2.06757e-06 -3.52143 63.546000 Cu 0.134644 0.226005 0.5 310 63.546 1.56798e-05 -3.52142 63.546000 Cu 0.230792 0.221194 7.55872e-18 312 63.546 1.21636e-05 -3.52137 63.546000 Cu 0.307751 0.192315 0 291 63.546 2.13213e-05 -3.52144 63.546000 Cu 0.499977 0.182739 2.42514e-16 295 63.546 5.73856e-05 -3.52127 63.546000 Cu 0.403839 0.187529 0.5 297 63.546 1.69999e-05 -3.52127 63.546000 Cu 0.326914 0.216399 0.5 314 63.546 6.78619e-06 -3.52136 63.546000 Cu 0.423058 0.211602 9.07047e-18 316 63.546 2.88381e-05 -3.52138 63.546000 Cu 0.730792 0.221194 4.36834e-16 280 63.546 1.21636e-05 -3.52137 63.546000 Cu 0.711616 0.197125 0.5 281 63.546 4.09432e-05 -3.52154 63.546000 Cu 0.596183 0.177919 0.5 299 63.546 3.17712e-05 -3.52141 63.546000 Cu 0.538456 0.230831 1.17584e-16 317 63.546 2.06757e-06 -3.52143 63.546000 Cu 0.519224 0.206788 0.5 318 63.546 1.50198e-05 -3.52147 63.546000 Cu 0.615432 0.201955 1 320 63.546 9.77094e-06 -3.52154 63.546000 Cu 0.634644 0.226005 0.5 321 63.546 1.56798e-05 -3.52142 63.546000 Cu 0.999977 0.182739 0 286 63.546 5.73856e-05 -3.52127 63.546000 Cu 0.807751 0.192315 1.81409e-19 282 63.546 2.13213e-05 -3.52144 63.546000 Cu 0.923058 0.211602 1.51174e-19 283 63.546 2.88381e-05 -3.52138 63.546000 Cu 0.903839 0.187529 0.5 284 63.546 1.69999e-05 -3.52127 63.546000 Cu 0.826914 0.216399 0.5 285 63.546 6.78619e-06 -3.52136 63.546000 Cu 0.153856 0.250055 0 309 63.546 2.13783e-05 -3.52125 63.546000 Cu 0.0576898 0.254866 0.5 311 63.546 1.62553e-05 -3.52134 63.546000 Cu 0.24997 0.24526 0.5 315 63.546 2.60754e-07 -3.52121 63.546000 Cu 0.0769155 0.278912 3.50664e-16 330 63.546 4.44065e-05 -3.52138 63.546000 Cu 0.173041 0.274117 0.5 332 63.546 6.93284e-06 -3.52128 63.546000 Cu 0.346086 0.240465 0 313 63.546 1.9492e-05 -3.52129 63.546000 Cu 0.442253 0.235655 0.5 319 63.546 2.10258e-05 -3.52139 63.546000 Cu 0.269151 0.269324 1.28045e-16 334 63.546 9.36974e-06 -3.52132 63.546000 Cu 0.384519 0.288564 1.34243e-17 335 63.546 1.09036e-05 -3.52155 63.546000 Cu 0.365284 0.264518 0.5 336 63.546 2.54837e-05 -3.52139 63.546000 Cu 0.288336 0.293391 0.5 337 63.546 4.61864e-05 -3.52153 63.546000 Cu 0.46148 0.259693 2.9993e-17 338 63.546 1.82863e-06 -3.52142 63.546000 Cu 0.480724 0.28373 0.5 341 63.546 1.78174e-05 -3.52151 63.546000 Cu 0.653856 0.250055 4.10741e-16 300 63.546 2.13783e-05 -3.52125 63.546000 Cu 0.673041 0.274117 0.5 303 63.546 6.93284e-06 -3.52128 63.546000 Cu 0.576916 0.278912 8.15133e-17 339 63.546 4.44065e-05 -3.52138 63.546000 Cu 0.55769 0.254866 0.5 340 63.546 1.62553e-05 -3.52134 63.546000 Cu 0.74997 0.24526 0.5 302 63.546 2.60754e-07 -3.52121 63.546000 Cu 0.769151 0.269324 2.42816e-16 301 63.546 9.36974e-06 -3.52132 63.546000 Cu 0.846086 0.240465 4.88596e-17 304 63.546 1.9492e-05 -3.52129 63.546000 Cu 0.96148 0.259693 6.09536e-17 305 63.546 1.82863e-06 -3.52142 63.546000 Cu 0.942253 0.235655 0.5 306 63.546 2.10258e-05 -3.52139 63.546000 Cu 0.865284 0.264518 0.5 307 63.546 2.54837e-05 -3.52139 63.546000 Cu 0.788336 0.293391 0.5 324 63.546 4.61864e-05 -3.52153 63.546000 Cu 0.884519 0.288564 4.23289e-19 326 63.546 1.09036e-05 -3.52155 63.546000 Cu 0.980724 0.28373 0.5 328 63.546 1.78174e-05 -3.52151 63.546000 Cu 0.192207 0.298194 0 331 63.546 1.29737e-05 -3.52143 63.546000 Cu 0.0961148 0.302985 0.5 333 63.546 1.90597e-05 -3.52135 63.546000 Cu 0.019277 0.331834 0.5 349 63.546 0.00011949 -3.52075 63.546000 Cu 0.11532 0.327073 9.33956e-17 351 63.546 2.58453e-05 -3.52123 63.546000 Cu 0.230677 0.346334 0 352 63.546 0.000253668 -3.52204 63.546000 Cu 0.211413 0.322277 0.5 353 63.546 0.000107715 -3.52167 63.546000 Cu 0.13448 0.351165 0.5 354 63.546 0.000306794 -3.52163 63.546000 Cu 0.307568 0.317444 1.52686e-17 355 63.546 7.87984e-05 -3.52167 63.546000 Cu 0.423154 0.336625 1.34545e-16 356 63.546 0.00015484 -3.52088 63.546000 Cu 0.403815 0.3126 0.5 357 63.546 1.83708e-05 -3.52145 63.546000 Cu 0.32697 0.341467 0.5 358 63.546 4.53737e-05 -3.52155 63.546000 Cu 0.499992 0.307782 1.77479e-17 359 63.546 4.76192e-05 -3.52129 63.546000 Cu 0.692207 0.298194 1.30736e-16 322 63.546 1.29737e-05 -3.52143 63.546000 Cu 0.711413 0.322277 0.5 325 63.546 0.000107715 -3.52167 63.546000 Cu 0.730677 0.346334 0 343 63.546 0.000253668 -3.52204 63.546000 Cu 0.61532 0.327073 1 360 63.546 2.58453e-05 -3.52123 63.546000 Cu 0.596115 0.302985 0.5 361 63.546 1.90597e-05 -3.52135 63.546000 Cu 0.519277 0.331834 0.5 362 63.546 0.00011949 -3.52075 63.546000 Cu 0.63448 0.351165 0.5 382 63.546 0.000306794 -3.52163 63.546000 Cu 0.999992 0.307782 1.77237e-16 327 63.546 4.76192e-05 -3.52129 63.546000 Cu 0.807568 0.317444 1 323 63.546 7.87984e-05 -3.52167 63.546000 Cu 0.903815 0.3126 0.5 329 63.546 1.83708e-05 -3.52145 63.546000 Cu 0.82697 0.341467 0.5 345 63.546 4.53737e-05 -3.52155 63.546000 Cu 0.923154 0.336625 0 347 63.546 0.00015484 -3.52088 63.546000 Cu 0.038515 0.35593 1.27591e-16 348 63.546 0.000184586 -3.52061 63.546000 Cu 0.0769035 0.404356 6.47329e-17 370 63.546 0.00731883 -3.525 63.546000 Cu 0.0576626 0.380127 0.5 371 63.546 0.0011064 -3.52179 63.546000 Cu 0.153645 0.375253 1 373 63.546 0.00136209 -3.52215 63.546000 Cu 0.173139 0.399266 0.5 376 63.546 0.00197843 -3.52131 63.546000 Cu 0.250024 0.370327 0.5 375 63.546 0.000288573 -3.522 63.546000 Cu 0.269635 0.394231 1 374 63.546 0.00188033 -3.51978 63.546000 Cu 0.346486 0.365453 0 377 63.546 0.000510392 -3.52118 63.546000 Cu 0.46204 0.384813 4.19056e-17 378 63.546 0.00130801 -3.5207 63.546000 Cu 0.442623 0.360668 0.5 379 63.546 0.000675651 -3.52022 63.546000 Cu 0.366053 0.389443 0.5 380 63.546 0.00305263 -3.51997 63.546000 Cu 0.480833 0.409148 0.5 400 63.546 0.00589355 -3.52453 63.546000 Cu 0.653645 0.375253 3.72313e-16 342 63.546 0.00136209 -3.52215 63.546000 Cu 0.673139 0.399266 0.5 364 63.546 0.00197843 -3.52131 63.546000 Cu 0.538515 0.35593 0 381 63.546 0.000184586 -3.52061 63.546000 Cu 0.557663 0.380127 0.5 383 63.546 0.0011064 -3.52179 63.546000 Cu 0.576904 0.404356 1 402 63.546 0.00731883 -3.525 63.546000 Cu 0.846486 0.365453 1 344 63.546 0.000510392 -3.52118 63.546000 Cu 0.750024 0.370327 0.5 346 63.546 0.000288573 -3.522 63.546000 Cu 0.942623 0.360668 0.5 350 63.546 0.000675651 -3.52022 63.546000 Cu 0.769635 0.394231 7.23521e-17 365 63.546 0.00188033 -3.51978 63.546000 Cu 0.866053 0.389443 0.5 367 63.546 0.00305263 -3.51997 63.546000 Cu 0.96204 0.384813 0 369 63.546 0.00130801 -3.5207 63.546000 Cu 0.980833 0.409148 0.5 372 63.546 0.00589355 -3.52453 63.546000 Cu 0.116998 0.451481 7.18079e-17 391 63.546 0.0624111 -3.51282 63.546000 Cu 0.0966092 0.428306 0.5 392 63.546 0.024074 -3.52636 63.546000 Cu 0.0145903 0.456756 0.5 393 63.546 0.624299 -3.44956 63.546000 Cu 0.193903 0.423176 1.56103e-16 394 63.546 0.00743723 -3.52002 63.546000 Cu 0.216019 0.447178 0.5 397 63.546 0.121989 -3.51895 63.546000 Cu 0.41911 0.463549 2.87232e-17 201 63.546 0.694287 -3.41282 63.546000 Cu 0.332754 0.468915 0.5 208 63.546 0.497817 -3.45807 63.546000 Cu 0.310304 0.44248 1 395 63.546 0.0942744 -3.49102 63.546000 Cu 0.289458 0.418139 0.5 396 63.546 0.0190199 -3.51309 63.546000 Cu 0.385159 0.413532 0 398 63.546 0.0103756 -3.51668 63.546000 Cu 0.498439 0.43336 2.27941e-16 399 63.546 0.0450427 -3.52494 63.546000 Cu 0.40232 0.438104 0.5 401 63.546 0.0754153 -3.50097 63.546000 Cu 0.616998 0.451481 2.93793e-16 3 63.546 0.0624111 -3.51282 63.546000 Cu 0.51459 0.456756 0.5 9 63.546 0.624299 -3.44956 63.546000 Cu 0.693903 0.423176 4.9041e-17 363 63.546 0.00743723 -3.52002 63.546000 Cu 0.716019 0.447178 0.5 385 63.546 0.121989 -3.51895 63.546000 Cu 0.596609 0.428306 0.5 403 63.546 0.024074 -3.52636 63.546000 Cu 0.998439 0.43336 3.37421e-17 390 63.546 0.0450427 -3.52494 63.546000 Cu 0.885159 0.413532 0 366 63.546 0.0103756 -3.51668 63.546000 Cu 0.789458 0.418139 0.5 368 63.546 0.0190199 -3.51309 63.546000 Cu 0.810304 0.44248 3.62395e-16 386 63.546 0.0942744 -3.49102 63.546000 Cu 0.91911 0.463549 4.44876e-16 387 63.546 0.694287 -3.41282 63.546000 Cu 0.90232 0.438104 0.5 388 63.546 0.0754153 -3.50097 63.546000 Cu 0.832754 0.468915 0.5 389 63.546 0.497817 -3.45807 63.546000 Cu 0.0321905 0.510984 1 2 63.546 9.22031 -3.2878 63.546000 Cu 0.237518 0.519546 5.64516e-16 4 63.546 0.583945 -3.48624 63.546000 Cu 0.13175 0.516002 0.5 5 63.546 3.7003 -3.42503 63.546000 Cu 0.246948 0.495125 0.5 207 63.546 1.10509 -3.49576 63.546000 Cu 0.0334842 0.478991 7.30475e-17 408 63.546 8.9746 -3.28444 63.546000 Cu 0.150435 0.495103 0 409 63.546 6.69466 -3.23216 63.546000 Cu 0.132617 0.474126 0.5 410 63.546 3.6228 -3.42738 63.546000 Cu 0.238029 0.470701 1 411 63.546 0.570316 -3.48896 63.546000 Cu 0.332285 0.521333 0.5 6 63.546 0.571022 -3.45029 63.546000 Cu 0.447335 0.494429 0.5 7 63.546 7.96496 -3.40341 63.546000 Cu 0.418501 0.526761 3.48608e-17 8 63.546 0.877586 -3.39763 63.546000 Cu 0.348064 0.495134 1 412 63.546 2.24898 -3.49434 63.546000 Cu 0.632617 0.474126 0.5 1 63.546 3.6228 -3.42738 63.546000 Cu 0.53219 0.510984 6.18606e-17 10 63.546 9.22031 -3.2878 63.546000 Cu 0.63175 0.516002 0.5 12 63.546 3.7003 -3.42503 63.546000 Cu 0.737518 0.519546 1 14 63.546 0.583945 -3.48624 63.546000 Cu 0.533484 0.478991 2.59446e-16 199 63.546 8.9746 -3.28444 63.546000 Cu 0.738029 0.470701 0 384 63.546 0.570316 -3.48896 63.546000 Cu 0.650435 0.495103 4.9549e-16 404 63.546 6.69466 -3.23216 63.546000 Cu 0.746948 0.495125 0.5 405 63.546 1.10509 -3.49576 63.546000 Cu 0.832285 0.521333 0.5 16 63.546 0.571022 -3.45029 63.546000 Cu 0.918501 0.526761 1 18 63.546 0.877586 -3.39763 63.546000 Cu 0.848064 0.495134 1 406 63.546 2.24898 -3.49434 63.546000 Cu 0.947335 0.494429 0.5 407 63.546 7.96496 -3.40341 63.546000 Cu 0.013937 0.53338 0.5 20 63.546 0.749868 -3.44499 63.546000 Cu 0.115981 0.538606 1 22 63.546 0.0565037 -3.51385 63.546000 Cu 0.19303 0.567006 0 23 63.546 0.00615898 -3.52064 63.546000 Cu 0.215033 0.543007 0.5 24 63.546 0.115923 -3.51921 63.546000 Cu 0.0957861 0.561862 0.5 25 63.546 0.022334 -3.52671 63.546000 Cu 0.076237 0.585841 0 42 63.546 0.00734806 -3.52436 63.546000 Cu 0.309505 0.547775 0 26 63.546 0.0988488 -3.49058 63.546000 Cu 0.288705 0.572062 0.5 27 63.546 0.0181122 -3.51336 63.546000 Cu 0.384489 0.576683 0 28 63.546 0.00981394 -3.51668 63.546000 Cu 0.401641 0.552145 0.5 29 63.546 0.0736418 -3.50044 63.546000 Cu 0.497696 0.556836 7.31382e-17 30 63.546 0.0404189 -3.52465 63.546000 Cu 0.480207 0.581072 0.5 33 63.546 0.00484007 -3.5241 63.546000 Cu 0.615981 0.538606 2.18719e-16 11 63.546 0.0565037 -3.51385 63.546000 Cu 0.513937 0.53338 0.5 13 63.546 0.749868 -3.44499 63.546000 Cu 0.715033 0.543007 0.5 17 63.546 0.115923 -3.51921 63.546000 Cu 0.576237 0.585841 0 31 63.546 0.00734806 -3.52436 63.546000 Cu 0.595786 0.561862 0.5 32 63.546 0.022334 -3.52671 63.546000 Cu 0.69303 0.567006 7.2987e-17 34 63.546 0.00615898 -3.52064 63.546000 Cu 0.809505 0.547775 1 15 63.546 0.0988488 -3.49058 63.546000 Cu 0.997696 0.556836 1.84403e-16 19 63.546 0.0404189 -3.52465 63.546000 Cu 0.901641 0.552145 0.5 21 63.546 0.0736418 -3.50044 63.546000 Cu 0.788705 0.572062 0.5 36 63.546 0.0181122 -3.51336 63.546000 Cu 0.884489 0.576683 3.98012e-16 38 63.546 0.00981394 -3.51668 63.546000 Cu 0.980207 0.581072 0.5 40 63.546 0.00484007 -3.5241 63.546000 Cu 0.153243 0.614955 9.04628e-17 43 63.546 0.00159941 -3.522 63.546000 Cu 0.172482 0.590921 0.5 44 63.546 0.00235124 -3.52109 63.546000 Cu 0.0572898 0.610081 0.5 45 63.546 0.00110821 -3.52136 63.546000 Cu 0.249683 0.619887 0.5 47 63.546 0.000399966 -3.52198 63.546000 Cu 0.0383852 0.63432 1.94501e-16 62 63.546 0.00026276 -3.52062 63.546000 Cu 0.134326 0.63909 0.5 64 63.546 0.000279024 -3.52169 63.546000 Cu 0.230527 0.643926 1.55226e-16 66 63.546 0.000294608 -3.52205 63.546000 Cu 0.269058 0.595974 7.63129e-17 46 63.546 0.00184121 -3.51992 63.546000 Cu 0.346195 0.624769 1 48 63.546 0.000430456 -3.5213 63.546000 Cu 0.365588 0.600779 0.5 49 63.546 0.00327561 -3.52014 63.546000 Cu 0.461666 0.605401 9.07047e-20 50 63.546 0.00149877 -3.5206 63.546000 Cu 0.44245 0.629572 0.5 53 63.546 0.000857013 -3.52046 63.546000 Cu 0.672482 0.590921 0.5 37 63.546 0.00235124 -3.52109 63.546000 Cu 0.538385 0.63432 1 51 63.546 0.00026276 -3.52062 63.546000 Cu 0.55729 0.610081 0.5 52 63.546 0.00110821 -3.52136 63.546000 Cu 0.653243 0.614955 4.25707e-17 54 63.546 0.00159941 -3.522 63.546000 Cu 0.730527 0.643926 1 55 63.546 0.000294608 -3.52205 63.546000 Cu 0.749683 0.619887 0.5 56 63.546 0.000399966 -3.52198 63.546000 Cu 0.634326 0.63909 0.5 57 63.546 0.000279024 -3.52169 63.546000 Cu 0.769058 0.595974 1 35 63.546 0.00184121 -3.51992 63.546000 Cu 0.961666 0.605401 1.54319e-16 39 63.546 0.00149877 -3.5206 63.546000 Cu 0.865588 0.600779 0.5 41 63.546 0.00327561 -3.52014 63.546000 Cu 0.846195 0.624769 1 58 63.546 0.000430456 -3.5213 63.546000 Cu 0.94245 0.629572 0.5 60 63.546 0.000857013 -3.52046 63.546000 Cu 0.115337 0.663236 1.08271e-16 63 63.546 5.01022e-05 -3.52127 63.546000 Cu 0.0192121 0.658454 0.5 65 63.546 0.000137383 -3.5208 63.546000 Cu 0.211424 0.668032 0.5 69 63.546 8.61647e-05 -3.52156 63.546000 Cu 0.0961382 0.687361 0.5 84 63.546 2.33612e-05 -3.52132 63.546000 Cu 0.192255 0.692169 1.11869e-17 86 63.546 5.31982e-06 -3.52149 63.546000 Cu 0.307554 0.672866 1 67 63.546 9.33572e-05 -3.52158 63.546000 Cu 0.32682 0.648793 0.5 68 63.546 7.22662e-05 -3.52164 63.546000 Cu 0.423081 0.653648 2.17752e-16 70 63.546 0.000121589 -3.52095 63.546000 Cu 0.499965 0.682548 1.45702e-16 71 63.546 2.50063e-05 -3.52128 63.546000 Cu 0.403743 0.677714 0.5 73 63.546 3.53818e-05 -3.52138 63.546000 Cu 0.288393 0.696986 0.5 88 63.546 1.2954e-05 -3.52161 63.546000 Cu 0.384546 0.701814 1.80805e-16 90 63.546 2.04356e-05 -3.52162 63.546000 Cu 0.519212 0.658454 0.5 72 63.546 0.000137383 -3.5208 63.546000 Cu 0.615337 0.663236 2.72114e-19 74 63.546 5.01022e-05 -3.52127 63.546000 Cu 0.692255 0.692169 0 75 63.546 5.31982e-06 -3.52149 63.546000 Cu 0.711424 0.668032 0.5 76 63.546 8.61647e-05 -3.52156 63.546000 Cu 0.596138 0.687361 0.5 77 63.546 2.33612e-05 -3.52132 63.546000 Cu 0.923081 0.653648 2.41879e-19 59 63.546 0.000121589 -3.52095 63.546000 Cu 0.82682 0.648793 0.5 61 63.546 7.22662e-05 -3.52164 63.546000 Cu 0.807554 0.672866 1 78 63.546 9.33572e-05 -3.52158 63.546000 Cu 0.884546 0.701814 1.36662e-16 79 63.546 2.04356e-05 -3.52162 63.546000 Cu 0.903743 0.677714 0.5 80 63.546 3.53818e-05 -3.52138 63.546000 Cu 0.788393 0.696986 0.5 81 63.546 1.2954e-05 -3.52161 63.546000 Cu 0.999965 0.682548 4.10136e-16 82 63.546 2.50063e-05 -3.52128 63.546000 Cu 0.0768979 0.711481 1.9955e-17 83 63.546 8.83872e-06 -3.52143 63.546000 Cu 0.173075 0.716301 0.5 89 63.546 8.6951e-06 -3.5214 63.546000 Cu 0.0385401 0.759696 0 103 63.546 2.18997e-06 -3.52135 63.546000 Cu 0.0577187 0.735594 0.5 104 63.546 4.39002e-06 -3.52137 63.546000 Cu 0.153893 0.740415 1 106 63.546 3.89025e-06 -3.52124 63.546000 Cu 0.134708 0.76452 0.5 109 63.546 4.52855e-06 -3.52135 63.546000 Cu 0.250042 0.74523 0.5 108 63.546 8.20315e-07 -3.52116 63.546000 Cu 0.26923 0.721117 5.98651e-18 87 63.546 6.02998e-06 -3.52141 63.546000 Cu 0.46154 0.730767 7.96538e-16 91 63.546 5.70347e-06 -3.52145 63.546000 Cu 0.480728 0.706651 0.5 92 63.546 5.57053e-06 -3.52155 63.546000 Cu 0.36538 0.725939 0.5 93 63.546 6.85831e-06 -3.52147 63.546000 Cu 0.34619 0.750047 5.79301e-17 111 63.546 1.68998e-06 -3.52118 63.546000 Cu 0.442359 0.754869 0.5 113 63.546 1.10923e-06 -3.52126 63.546000 Cu 0.576898 0.711481 4.04241e-17 94 63.546 8.83872e-06 -3.52143 63.546000 Cu 0.653893 0.740415 0 95 63.546 3.89025e-06 -3.52124 63.546000 Cu 0.673075 0.716301 0.5 96 63.546 8.6951e-06 -3.5214 63.546000 Cu 0.557719 0.735594 0.5 97 63.546 4.39002e-06 -3.52137 63.546000 Cu 0.53854 0.759696 2.78463e-17 114 63.546 2.18997e-06 -3.52135 63.546000 Cu 0.634708 0.76452 0.5 116 63.546 4.52855e-06 -3.52135 63.546000 Cu 0.750042 0.74523 0.5 101 63.546 8.20315e-07 -3.52116 63.546000 Cu 0.980728 0.706651 0.5 85 63.546 5.57053e-06 -3.52155 63.546000 Cu 0.76923 0.721117 1.25717e-16 98 63.546 6.02998e-06 -3.52141 63.546000 Cu 0.84619 0.750047 0 99 63.546 1.68998e-06 -3.52118 63.546000 Cu 0.86538 0.725939 0.5 100 63.546 6.85831e-06 -3.52147 63.546000 Cu 0.96154 0.730767 1.16253e-16 102 63.546 5.70347e-06 -3.52145 63.546000 Cu 0.942359 0.754869 0.5 105 63.546 1.10923e-06 -3.52126 63.546000 Cu 0.23085 0.769338 0 107 63.546 5.64413e-06 -3.5213 63.546000 Cu 0.0193394 0.7838 0.5 124 63.546 5.35849e-06 -3.52155 63.546000 Cu 0.115516 0.788636 0 126 63.546 1.05668e-05 -3.52162 63.546000 Cu 0.192503 0.817585 4.29577e-16 127 63.546 8.87088e-05 -3.52169 63.546000 Cu 0.211674 0.793463 0.5 128 63.546 1.08265e-05 -3.52159 63.546000 Cu 0.0962826 0.812741 0.5 129 63.546 2.13817e-05 -3.52152 63.546000 Cu 7.84262e-05 0.80791 1 123 63.546 2.25819e-05 -3.52137 63.546000 Cu 0.326995 0.774152 0.5 110 63.546 1.18722e-05 -3.52128 63.546000 Cu 0.423151 0.778969 0 112 63.546 1.68721e-05 -3.52139 63.546000 Cu 0.307802 0.798278 1.13865e-16 130 63.546 3.23017e-06 -3.52149 63.546000 Cu 0.28863 0.822416 0.5 131 63.546 5.96681e-05 -3.52166 63.546000 Cu 0.403924 0.803091 0.5 133 63.546 1.77835e-05 -3.52141 63.546000 Cu 0.500078 0.80791 1 134 63.546 2.25819e-05 -3.52137 63.546000 Cu 0.615516 0.788636 7.89736e-17 115 63.546 1.05668e-05 -3.52162 63.546000 Cu 0.519339 0.7838 0.5 117 63.546 5.35849e-06 -3.52155 63.546000 Cu 0.73085 0.769338 7.85805e-17 118 63.546 5.64413e-06 -3.5213 63.546000 Cu 0.711674 0.793463 0.5 121 63.546 1.08265e-05 -3.52159 63.546000 Cu 0.596283 0.812741 0.5 136 63.546 2.13817e-05 -3.52152 63.546000 Cu 0.692503 0.817585 0 138 63.546 8.87088e-05 -3.52169 63.546000 Cu 0.807802 0.798278 1 119 63.546 3.23017e-06 -3.52149 63.546000 Cu 0.826995 0.774152 0.5 120 63.546 1.18722e-05 -3.52128 63.546000 Cu 0.923151 0.778969 6.52469e-17 122 63.546 1.68721e-05 -3.52139 63.546000 Cu 0.903924 0.803091 0.5 125 63.546 1.77835e-05 -3.52141 63.546000 Cu 0.78863 0.822416 0.5 140 63.546 5.96681e-05 -3.52166 63.546000 Cu 0.0769793 0.836814 0 146 63.546 8.4413e-05 -3.52095 63.546000 Cu 0.153795 0.865684 2.77314e-16 147 63.546 0.000455731 -3.52123 63.546000 Cu 0.173192 0.841664 0.5 148 63.546 8.2243e-05 -3.5216 63.546000 Cu 0.0575932 0.860886 0.5 149 63.546 0.000698563 -3.52028 63.546000 Cu 0.250318 0.870562 0.5 151 63.546 0.000354126 -3.52198 63.546000 Cu 0.384723 0.827219 1.0552e-17 132 63.546 3.20497e-05 -3.52124 63.546000 Cu 0.480814 0.832003 0.5 137 63.546 0.000121333 -3.52082 63.546000 Cu 0.269491 0.846528 3.66447e-17 150 63.546 0.000310995 -3.52205 63.546000 Cu 0.346727 0.875489 0 152 63.546 0.00142539 -3.52198 63.546000 Cu 0.365681 0.851355 0.5 153 63.546 0.000216318 -3.5216 63.546000 Cu 0.461658 0.856129 9.5633e-17 154 63.546 0.000216681 -3.52062 63.546000 Cu 0.442703 0.880355 0.5 157 63.546 0.000932175 -3.52158 63.546000 Cu 0.576979 0.836814 0 135 63.546 8.4413e-05 -3.52095 63.546000 Cu 0.673192 0.841664 0.5 141 63.546 8.2243e-05 -3.5216 63.546000 Cu 0.557593 0.860886 0.5 156 63.546 0.000698563 -3.52028 63.546000 Cu 0.653795 0.865684 7.86107e-19 158 63.546 0.000455731 -3.52123 63.546000 Cu 0.750318 0.870562 0.5 160 63.546 0.000354126 -3.52198 63.546000 Cu 0.769491 0.846528 0 139 63.546 0.000310995 -3.52205 63.546000 Cu 0.884723 0.827219 0 142 63.546 3.20497e-05 -3.52124 63.546000 Cu 0.961658 0.856129 0 143 63.546 0.000216681 -3.52062 63.546000 Cu 0.980814 0.832003 0.5 144 63.546 0.000121333 -3.52082 63.546000 Cu 0.865681 0.851355 0.5 145 63.546 0.000216318 -3.5216 63.546000 Cu 0.846727 0.875489 9.37282e-18 162 63.546 0.00142539 -3.52198 63.546000 Cu 0.942703 0.880355 0.5 164 63.546 0.000932175 -3.52158 63.546000 Cu 0.0383645 0.885044 1.77479e-17 166 63.546 0.00150215 -3.52064 63.546000 Cu 0.115517 0.913762 3.63272e-16 167 63.546 0.010162 -3.5167 63.546000 Cu 0.134432 0.889679 0.5 168 63.546 0.00304854 -3.52003 63.546000 Cu 0.0198002 0.909382 0.5 169 63.546 0.00496902 -3.52411 63.546000 Cu 0.230943 0.894484 4.34778e-17 170 63.546 0.00169456 -3.51989 63.546000 Cu 0.211314 0.91839 0.5 173 63.546 0.0182869 -3.51343 63.546000 Cu 0.0983519 0.938316 0.5 188 63.546 0.0727126 -3.50057 63.546000 Cu 0.00228812 0.933607 0 186 63.546 0.0394995 -3.52449 63.546000 Cu 0.306995 0.923456 1 171 63.546 0.00623197 -3.52063 63.546000 Cu 0.327484 0.899527 0.5 172 63.546 0.00216023 -3.52109 63.546000 Cu 0.423739 0.904611 2.66974e-17 174 63.546 0.00728564 -3.52447 63.546000 Cu 0.404221 0.928586 0.5 177 63.546 0.0217391 -3.5265 63.546000 Cu 0.502288 0.933607 2.11644e-19 175 63.546 0.0394995 -3.52449 63.546000 Cu 0.538365 0.885044 4.73176e-17 155 63.546 0.00150215 -3.52064 63.546000 Cu 0.730943 0.894484 3.93054e-18 159 63.546 0.00169456 -3.51989 63.546000 Cu 0.634432 0.889679 0.5 161 63.546 0.00304854 -3.52003 63.546000 Cu 0.5198 0.909382 0.5 176 63.546 0.00496902 -3.52411 63.546000 Cu 0.615517 0.913762 6.65168e-19 178 63.546 0.010162 -3.5167 63.546000 Cu 0.711314 0.91839 0.5 180 63.546 0.0182869 -3.51343 63.546000 Cu 0.598352 0.938316 0.5 181 63.546 0.0727126 -3.50057 63.546000 Cu 0.923739 0.904611 2.08621e-18 163 63.546 0.00728564 -3.52447 63.546000 Cu 0.827484 0.899527 0.5 165 63.546 0.00216023 -3.52109 63.546000 Cu 0.806995 0.923456 1 182 63.546 0.00623197 -3.52063 63.546000 Cu 0.904221 0.928586 0.5 184 63.546 0.0217391 -3.5265 63.546000 Cu 0.151904 0.995329 2.50194e-16 216 63.546 2.25388 -3.49399 63.546000 Cu 0.0526466 0.996138 0.5 217 63.546 8.24767 -3.40288 63.546000 Cu 0.0814943 0.963689 5.51152e-16 187 63.546 0.894347 -3.39642 63.546000 Cu 0.19052 0.942685 1.49572e-16 190 63.546 0.097942 -3.49054 63.546000 Cu 0.167742 0.969118 0.5 193 63.546 0.57296 -3.44975 63.546000 Cu 0.253024 0.995356 0.5 209 63.546 1.10654 -3.49579 63.546000 Cu 0.262445 0.970916 0 191 63.546 0.588115 -3.48603 63.546000 Cu 0.284958 0.947461 0.5 192 63.546 0.116146 -3.51925 63.546000 Cu 0.384046 0.951851 0 194 63.546 0.0562569 -3.51421 63.546000 Cu 0.467892 0.979497 3.62819e-19 195 63.546 9.23724 -3.28835 63.546000 Cu 0.486044 0.957075 0.5 196 63.546 0.759142 -3.44467 63.546000 Cu 0.368285 0.974478 0.5 197 63.546 3.70919 -3.42502 63.546000 Cu 0.349554 0.99537 0 210 63.546 6.69484 -3.23298 63.546000 Cu 0.651904 0.995329 2.93611e-16 211 63.546 2.25388 -3.49399 63.546000 Cu 0.552647 0.996138 0.5 236 63.546 8.24767 -3.40288 63.546000 Cu 0.69052 0.942685 1.20849e-16 179 63.546 0.097942 -3.49054 63.546000 Cu 0.581494 0.963689 0 198 63.546 0.894347 -3.39642 63.546000 Cu 0.667742 0.969118 0.5 200 63.546 0.57296 -3.44975 63.546000 Cu 0.753024 0.995356 0.5 205 63.546 1.10654 -3.49579 63.546000 Cu 0.884046 0.951851 0 183 63.546 0.0562569 -3.51421 63.546000 Cu 0.784958 0.947461 0.5 185 63.546 0.116146 -3.51925 63.546000 Cu 0.986044 0.957075 0.5 189 63.546 0.759142 -3.44467 63.546000 Cu 0.762445 0.970916 1.63027e-16 202 63.546 0.588115 -3.48603 63.546000 Cu 0.849554 0.99537 5.5088e-17 203 63.546 6.69484 -3.23298 63.546000 Cu 0.868285 0.974478 0.5 204 63.546 3.70919 -3.42502 63.546000 Cu 0.967892 0.979497 1.14076e-16 206 63.546 9.23724 -3.28835