Number of particles = 432 A = 1 Angstrom (basic length-scale) H0(1,1) = 10.865 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.0301 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.11733 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 0.0498468 0.0155584 0.25 221 63.546 1.08746 -3.4502 63.546000 Cu 0.291943 0.00840706 0.25 222 63.546 4.62843 -3.42863 63.546000 Cu 0.0498468 0.0155584 0.75 223 63.546 1.08746 -3.4502 63.546000 Cu 0.291943 0.00840706 0.75 224 63.546 4.62843 -3.42863 63.546000 Cu 0.219344 0.0295248 2.05174e-16 225 63.546 0.256186 -3.52169 63.546000 Cu 0.461252 0.0194147 3.53482e-16 232 63.546 0.444315 -3.48418 63.546000 Cu 0.461252 0.0194147 0.5 233 63.546 0.444315 -3.48418 63.546000 Cu 0.39239 0.0418679 0.25 234 63.546 0.101985 -3.55708 63.546000 Cu 0.219344 0.0295248 0.5 236 63.546 0.256186 -3.52169 63.546000 Cu 0.39239 0.0418679 0.75 238 63.546 0.101985 -3.55708 63.546000 Cu 0.998995 0.0382713 1.02256e-15 226 63.546 0.0897198 -3.5182 63.546000 Cu 0.998995 0.0382713 0.5 227 63.546 0.0897198 -3.5182 63.546000 Cu 0.675869 0.00862759 4.83823e-16 231 63.546 4.18017 -3.45034 63.546000 Cu 0.622251 0.0325886 0.25 235 63.546 0.0822264 -3.51322 63.546000 Cu 0.837146 0.0223197 0.25 239 63.546 0.320665 -3.47782 63.546000 Cu 0.675869 0.00862759 0.5 240 63.546 4.18017 -3.45034 63.546000 Cu 0.622251 0.0325886 0.75 241 63.546 0.0822264 -3.51322 63.546000 Cu 0.837146 0.0223197 0.75 242 63.546 0.320665 -3.47782 63.546000 Cu 0.167314 0.0521419 0.25 229 63.546 0.0307554 -3.5302 63.546000 Cu 0.167314 0.0521419 0.75 237 63.546 0.0307554 -3.5302 63.546000 Cu 0.336633 0.0650924 9.65952e-16 244 63.546 0.0146762 -3.5423 63.546000 Cu 0.112674 0.0749359 1.05138e-15 245 63.546 0.00859628 -3.53457 63.546000 Cu 0.112674 0.0749359 0.5 246 63.546 0.00859628 -3.53457 63.546000 Cu 0.336633 0.0650924 0.5 256 63.546 0.0146762 -3.5423 63.546000 Cu 0.502547 0.0788388 0.25 254 63.546 0.00261465 -3.54 63.546000 Cu 0.502547 0.0788388 0.75 258 63.546 0.00261465 -3.54 63.546000 Cu 0.94568 0.0611941 0.25 228 63.546 0.0242724 -3.53202 63.546000 Cu 0.94568 0.0611941 0.75 230 63.546 0.0242724 -3.53202 63.546000 Cu 0.889243 0.0840249 8.59933e-16 243 63.546 0.00751251 -3.53763 63.546000 Cu 0.889243 0.0840249 0.5 249 63.546 0.00751251 -3.53763 63.546000 Cu 0.782842 0.0465057 4.66789e-16 251 63.546 0.0456069 -3.53265 63.546000 Cu 0.559097 0.055559 1.38079e-15 252 63.546 0.0182743 -3.54602 63.546000 Cu 0.559097 0.055559 0.5 253 63.546 0.0182743 -3.54602 63.546000 Cu 0.723913 0.0696957 0.25 255 63.546 0.0060193 -3.54428 63.546000 Cu 0.782842 0.0465057 0.5 259 63.546 0.0456069 -3.53265 63.546000 Cu 0.723913 0.0696957 0.75 260 63.546 0.0060193 -3.54428 63.546000 Cu 0.0564219 0.0977893 0.25 247 63.546 0.00205534 -3.53839 63.546000 Cu 0.280327 0.0882594 0.25 248 63.546 0.00509678 -3.54132 63.546000 Cu 0.0564219 0.0977893 0.75 250 63.546 0.00205534 -3.53839 63.546000 Cu 0.280327 0.0882594 0.75 257 63.546 0.00509678 -3.54132 63.546000 Cu 0.446258 0.102059 7.68066e-16 263 63.546 0.00102701 -3.54042 63.546000 Cu 0.2237 0.111353 8.42051e-16 264 63.546 0.00189477 -3.54126 63.546000 Cu 0.2237 0.111353 0.5 265 63.546 0.00189477 -3.54126 63.546000 Cu 0.389827 0.125203 0.25 267 63.546 0.000281711 -3.54052 63.546000 Cu 0.446258 0.102059 0.5 275 63.546 0.00102701 -3.54042 63.546000 Cu 0.389827 0.125203 0.75 276 63.546 0.000281711 -3.54052 63.546000 Cu 0.000588073 0.120763 5.66537e-16 261 63.546 0.000434566 -3.53911 63.546000 Cu 0.000588073 0.120763 0.5 268 63.546 0.000434566 -3.53911 63.546000 Cu 0.667763 0.0929007 1.15477e-15 271 63.546 0.000872884 -3.54056 63.546000 Cu 0.667763 0.0929007 0.5 272 63.546 0.000872884 -3.54056 63.546000 Cu 0.611933 0.116051 0.25 273 63.546 0.000206396 -3.54014 63.546000 Cu 0.833657 0.106988 0.25 274 63.546 0.00226064 -3.53832 63.546000 Cu 0.611933 0.116051 0.75 277 63.546 0.000206396 -3.54014 63.546000 Cu 0.833657 0.106988 0.75 278 63.546 0.00226064 -3.53832 63.546000 Cu 0.777984 0.130013 4.32382e-16 291 63.546 0.000790317 -3.53896 63.546000 Cu 0.777984 0.130013 0.5 292 63.546 0.000790317 -3.53896 63.546000 Cu 0.167471 0.134453 0.25 266 63.546 0.000824135 -3.54072 63.546000 Cu 0.167471 0.134453 0.75 270 63.546 0.000824135 -3.54072 63.546000 Cu 0.111325 0.157567 2.64751e-16 279 63.546 0.000296524 -3.54051 63.546000 Cu 0.333641 0.148332 6.29419e-16 284 63.546 5.49655e-05 -3.54041 63.546000 Cu 0.333641 0.148332 0.5 285 63.546 5.49655e-05 -3.54041 63.546000 Cu 0.277482 0.171451 0.25 286 63.546 1.27312e-05 -3.54023 63.546000 Cu 0.499763 0.162246 0.25 287 63.546 7.3658e-05 -3.53992 63.546000 Cu 0.111325 0.157567 0.5 288 63.546 0.000296524 -3.54051 63.546000 Cu 0.277482 0.171451 0.75 290 63.546 1.27312e-05 -3.54023 63.546000 Cu 0.499763 0.162246 0.75 295 63.546 7.3658e-05 -3.53992 63.546000 Cu 0.944738 0.143797 0.25 262 63.546 9.82264e-05 -3.53949 63.546000 Cu 0.944738 0.143797 0.75 269 63.546 9.82264e-05 -3.53949 63.546000 Cu 0.888727 0.166851 6.7103e-16 280 63.546 4.90843e-05 -3.5398 63.546000 Cu 0.888727 0.166851 0.5 281 63.546 4.90843e-05 -3.5398 63.546000 Cu 0.555735 0.139151 3.72296e-16 283 63.546 0.000117902 -3.54008 63.546000 Cu 0.72206 0.153048 0.25 293 63.546 0.000222944 -3.53947 63.546000 Cu 0.555735 0.139151 0.5 294 63.546 0.000117902 -3.54008 63.546000 Cu 0.72206 0.153048 0.75 296 63.546 0.000222944 -3.53947 63.546000 Cu 0.055074 0.180674 0.25 282 63.546 6.74537e-05 -3.54027 63.546000 Cu 0.055074 0.180674 0.75 289 63.546 6.74537e-05 -3.54027 63.546000 Cu 0.221288 0.194552 9.95189e-16 297 63.546 1.70787e-05 -3.53992 63.546000 Cu 0.443733 0.185332 8.06372e-16 304 63.546 2.53051e-05 -3.53973 63.546000 Cu 0.443733 0.185332 0.5 305 63.546 2.53051e-05 -3.53973 63.546000 Cu 0.3876 0.20841 0.25 306 63.546 2.59501e-05 -3.53975 63.546000 Cu 0.221288 0.194552 0.5 308 63.546 1.70787e-05 -3.53992 63.546000 Cu 0.3876 0.20841 0.75 310 63.546 2.59501e-05 -3.53975 63.546000 Cu 0.998923 0.203774 4.60857e-16 298 63.546 2.04144e-05 -3.5401 63.546000 Cu 0.998923 0.203774 0.5 299 63.546 2.04144e-05 -3.5401 63.546000 Cu 0.66617 0.176105 8.02728e-16 303 63.546 4.44226e-05 -3.53959 63.546000 Cu 0.610098 0.19918 0.25 307 63.546 9.20173e-06 -3.53981 63.546000 Cu 0.832619 0.189926 0.25 311 63.546 2.24967e-05 -3.53994 63.546000 Cu 0.66617 0.176105 0.5 312 63.546 4.44226e-05 -3.53959 63.546000 Cu 0.610098 0.19918 0.75 313 63.546 9.20173e-06 -3.53981 63.546000 Cu 0.832619 0.189926 0.75 314 63.546 2.24967e-05 -3.53994 63.546000 Cu 0.776475 0.213021 7.36201e-16 323 63.546 1.79956e-05 -3.54001 63.546000 Cu 0.776475 0.213021 0.5 331 63.546 1.79956e-05 -3.54001 63.546000 Cu 0.165238 0.217644 0.25 301 63.546 2.21896e-05 -3.53994 63.546000 Cu 0.165238 0.217644 0.75 309 63.546 2.21896e-05 -3.53994 63.546000 Cu 0.33174 0.231504 4.57552e-16 316 63.546 2.39796e-06 -3.53998 63.546000 Cu 0.109408 0.240734 7.20353e-16 317 63.546 3.57571e-06 -3.53991 63.546000 Cu 0.109408 0.240734 0.5 318 63.546 3.57571e-06 -3.53991 63.546000 Cu 0.275942 0.254592 0.25 320 63.546 8.47273e-06 -3.53993 63.546000 Cu 0.498245 0.245366 0.25 326 63.546 7.23279e-06 -3.53997 63.546000 Cu 0.33174 0.231504 0.5 328 63.546 2.39796e-06 -3.53998 63.546000 Cu 0.275942 0.254592 0.75 329 63.546 8.47273e-06 -3.53993 63.546000 Cu 0.498245 0.245366 0.75 330 63.546 7.23279e-06 -3.53997 63.546000 Cu 0.942912 0.226873 0.25 300 63.546 1.67687e-05 -3.5401 63.546000 Cu 0.942912 0.226873 0.75 302 63.546 1.67687e-05 -3.5401 63.546000 Cu 0.887123 0.249975 8.52814e-16 315 63.546 3.91208e-06 -3.53997 63.546000 Cu 0.887123 0.249975 0.5 321 63.546 3.91208e-06 -3.53997 63.546000 Cu 0.553992 0.222269 4.11703e-16 324 63.546 5.10525e-05 -3.54007 63.546000 Cu 0.553992 0.222269 0.5 325 63.546 5.10525e-05 -3.54007 63.546000 Cu 0.720583 0.236118 0.25 327 63.546 7.20423e-06 -3.54013 63.546000 Cu 0.720583 0.236118 0.75 332 63.546 7.20423e-06 -3.54013 63.546000 Cu 0.664832 0.259221 4.02466e-16 343 63.546 1.12819e-06 -3.54004 63.546000 Cu 0.664832 0.259221 0.5 344 63.546 1.12819e-06 -3.54004 63.546000 Cu 0.0536579 0.263829 0.25 319 63.546 6.23314e-06 -3.54002 63.546000 Cu 0.0536579 0.263829 0.75 322 63.546 6.23314e-06 -3.54002 63.546000 Cu 0.442491 0.268462 8.51373e-16 335 63.546 7.89719e-06 -3.53999 63.546000 Cu 0.220273 0.27769 9.77053e-16 336 63.546 9.07846e-06 -3.54009 63.546000 Cu 0.220273 0.27769 0.5 337 63.546 9.07846e-06 -3.54009 63.546000 Cu 0.164474 0.300784 0.25 338 63.546 2.86343e-05 -3.53994 63.546000 Cu 0.386829 0.291558 0.25 339 63.546 1.0355e-05 -3.53979 63.546000 Cu 0.164474 0.300784 0.75 342 63.546 2.86343e-05 -3.53994 63.546000 Cu 0.442491 0.268462 0.5 347 63.546 7.89719e-06 -3.53999 63.546000 Cu 0.386829 0.291558 0.75 348 63.546 1.0355e-05 -3.53979 63.546000 Cu 0.99798 0.286934 5.09078e-16 333 63.546 9.62364e-06 -3.5401 63.546000 Cu 0.99798 0.286934 0.5 340 63.546 9.62364e-06 -3.5401 63.546000 Cu 0.609084 0.282319 0.25 345 63.546 4.59173e-06 -3.5399 63.546000 Cu 0.831453 0.273076 0.25 346 63.546 9.67543e-06 -3.53995 63.546000 Cu 0.609084 0.282319 0.75 349 63.546 4.59173e-06 -3.5399 63.546000 Cu 0.831453 0.273076 0.75 350 63.546 9.67543e-06 -3.53995 63.546000 Cu 0.775664 0.296183 5.99673e-16 363 63.546 8.41689e-06 -3.54012 63.546000 Cu 0.775664 0.296183 0.5 364 63.546 8.41689e-06 -3.54012 63.546000 Cu 0.108809 0.323872 5.70435e-16 351 63.546 4.87124e-05 -3.53999 63.546000 Cu 0.0530413 0.346943 0.25 354 63.546 0.000122933 -3.5394 63.546000 Cu 0.331158 0.314637 6.08233e-16 356 63.546 2.16803e-05 -3.53959 63.546000 Cu 0.331158 0.314637 0.5 357 63.546 2.16803e-05 -3.53959 63.546000 Cu 0.27561 0.3377 0.25 358 63.546 0.000249397 -3.53931 63.546000 Cu 0.497779 0.328515 0.25 359 63.546 5.91843e-05 -3.53999 63.546000 Cu 0.108809 0.323872 0.5 360 63.546 4.87124e-05 -3.53999 63.546000 Cu 0.0530413 0.346943 0.75 361 63.546 0.000122933 -3.5394 63.546000 Cu 0.27561 0.3377 0.75 362 63.546 0.000249397 -3.53931 63.546000 Cu 0.497779 0.328515 0.75 367 63.546 5.91843e-05 -3.53999 63.546000 Cu 0.942158 0.310052 0.25 334 63.546 4.90504e-05 -3.54041 63.546000 Cu 0.942158 0.310052 0.75 341 63.546 4.90504e-05 -3.54041 63.546000 Cu 0.886343 0.33317 9.79087e-16 352 63.546 0.000204687 -3.54028 63.546000 Cu 0.886343 0.33317 0.5 353 63.546 0.000204687 -3.54028 63.546000 Cu 0.553432 0.305416 7.99338e-16 355 63.546 1.5094e-05 -3.53989 63.546000 Cu 0.719948 0.319301 0.25 365 63.546 2.83818e-05 -3.54026 63.546000 Cu 0.553432 0.305416 0.5 366 63.546 1.5094e-05 -3.53989 63.546000 Cu 0.719948 0.319301 0.75 368 63.546 2.83818e-05 -3.54026 63.546000 Cu 0.664028 0.342424 7.29676e-16 375 63.546 0.000100759 -3.54023 63.546000 Cu 0.664028 0.342424 0.5 384 63.546 0.000100759 -3.54023 63.546000 Cu 0.219936 0.360739 1.00824e-15 369 63.546 0.000947532 -3.5389 63.546000 Cu 0.164605 0.38377 0.25 373 63.546 0.00251201 -3.5383 63.546000 Cu 0.44205 0.351625 4.72976e-16 376 63.546 0.00010263 -3.54001 63.546000 Cu 0.44205 0.351625 0.5 377 63.546 0.00010263 -3.54001 63.546000 Cu 0.386231 0.374738 0.25 378 63.546 0.000271238 -3.54013 63.546000 Cu 0.219936 0.360739 0.5 380 63.546 0.000947532 -3.5389 63.546000 Cu 0.164605 0.38377 0.75 381 63.546 0.00251201 -3.5383 63.546000 Cu 0.386231 0.374738 0.75 382 63.546 0.000271238 -3.54013 63.546000 Cu 0.997482 0.369976 7.67558e-16 370 63.546 0.000496219 -3.53911 63.546000 Cu 0.997482 0.369976 0.5 371 63.546 0.000496219 -3.53911 63.546000 Cu 0.608132 0.365564 0.25 379 63.546 0.000368275 -3.54048 63.546000 Cu 0.830407 0.356276 0.25 383 63.546 0.000540738 -3.54065 63.546000 Cu 0.608132 0.365564 0.75 385 63.546 0.000368275 -3.54048 63.546000 Cu 0.830407 0.356276 0.75 386 63.546 0.000540738 -3.54065 63.546000 Cu 0.774522 0.379396 9.10442e-16 395 63.546 0.00152825 -3.54138 63.546000 Cu 0.552103 0.388736 7.23235e-16 396 63.546 0.00129106 -3.54051 63.546000 Cu 0.552103 0.388736 0.5 397 63.546 0.00129106 -3.54051 63.546000 Cu 0.774522 0.379396 0.5 403 63.546 0.00152825 -3.54138 63.546000 Cu 0.33067 0.397896 4.54416e-16 388 63.546 0.000951555 -3.54056 63.546000 Cu 0.109441 0.406758 6.31114e-16 389 63.546 0.00763053 -3.53763 63.546000 Cu 0.109441 0.406758 0.5 390 63.546 0.00763053 -3.53763 63.546000 Cu 0.0536589 0.42962 0.25 391 63.546 0.0244154 -3.53212 63.546000 Cu 0.275056 0.421128 0.25 392 63.546 0.00649439 -3.5441 63.546000 Cu 0.0536589 0.42962 0.75 394 63.546 0.0244154 -3.53212 63.546000 Cu 0.496254 0.411969 0.25 398 63.546 0.00306474 -3.54017 63.546000 Cu 0.33067 0.397896 0.5 400 63.546 0.000951555 -3.54056 63.546000 Cu 0.275056 0.421128 0.75 401 63.546 0.00649439 -3.5441 63.546000 Cu 0.496254 0.411969 0.75 402 63.546 0.00306474 -3.54017 63.546000 Cu 0.942005 0.392967 0.25 372 63.546 0.00223345 -3.53833 63.546000 Cu 0.942005 0.392967 0.75 374 63.546 0.00223345 -3.53833 63.546000 Cu 0.886341 0.415841 8.63322e-16 387 63.546 0.00930222 -3.53471 63.546000 Cu 0.886341 0.415841 0.5 393 63.546 0.00930222 -3.53471 63.546000 Cu 0.718413 0.402518 0.25 399 63.546 0.00458661 -3.54132 63.546000 Cu 0.718413 0.402518 0.75 404 63.546 0.00458661 -3.54132 63.546000 Cu 0.662611 0.425697 6.37725e-16 415 63.546 0.0132706 -3.5425 63.546000 Cu 0.662611 0.425697 0.5 416 63.546 0.0132706 -3.5425 63.546000 Cu 0.440238 0.435263 7.04167e-16 407 63.546 0.0182577 -3.54586 63.546000 Cu 0.216716 0.444357 5.45265e-16 408 63.546 0.046715 -3.53264 63.546000 Cu 0.216716 0.444357 0.5 409 63.546 0.046715 -3.53264 63.546000 Cu 0.162612 0.468583 0.25 410 63.546 0.328176 -3.47829 63.546000 Cu 0.377604 0.458275 0.25 411 63.546 0.0795048 -3.51371 63.546000 Cu 0.162612 0.468583 0.75 414 63.546 0.328176 -3.47829 63.546000 Cu 0.440238 0.435263 0.5 419 63.546 0.0182577 -3.54586 63.546000 Cu 0.377604 0.458275 0.75 420 63.546 0.0795048 -3.51371 63.546000 Cu 0.000695385 0.452574 6.1247e-16 405 63.546 0.0911999 -3.51797 63.546000 Cu 0.000695385 0.452574 0.5 412 63.546 0.0911999 -3.51797 63.546000 Cu 0.539006 0.471406 0.5 209 63.546 0.420247 -3.4858 63.546000 Cu 0.94969 0.475289 0.25 406 63.546 1.06251 -3.4496 63.546000 Cu 0.94969 0.475289 0.75 413 63.546 1.06251 -3.4496 63.546000 Cu 0.607175 0.448925 0.25 417 63.546 0.0943676 -3.55608 63.546000 Cu 0.832215 0.438664 0.25 418 63.546 0.0311202 -3.53064 63.546000 Cu 0.607175 0.448925 0.75 421 63.546 0.0943676 -3.55608 63.546000 Cu 0.832215 0.438664 0.75 422 63.546 0.0311202 -3.53064 63.546000 Cu 0.539006 0.471406 7.35438e-16 426 63.546 0.420247 -3.4858 63.546000 Cu 0.78022 0.461292 5.25095e-16 431 63.546 0.244003 -3.52257 63.546000 Cu 0.78022 0.461292 0.5 432 63.546 0.244003 -3.52257 63.546000 Cu 0.324548 0.508761 7.71287e-16 5 63.546 4.16189 -3.45017 63.546000 Cu 0.324548 0.508761 0.5 14 63.546 4.16189 -3.45017 63.546000 Cu 0.10768 0.495504 5.9569e-16 423 63.546 7.74589 -3.50428 63.546000 Cu 0.324407 0.48223 5.43316e-16 427 63.546 4.15746 -3.45009 63.546000 Cu 0.324407 0.48223 0.5 428 63.546 4.15746 -3.45009 63.546000 Cu 0.10768 0.495504 0.5 430 63.546 7.74589 -3.50428 63.546000 Cu 0.500141 0.495478 0.75 7 63.546 6.71459 -3.5445 63.546000 Cu 0.500141 0.495478 0.25 429 63.546 6.71459 -3.5445 63.546000 Cu 0.708259 0.508493 0.25 1 63.546 4.62461 -3.42857 63.546000 Cu 0.950534 0.515676 0.25 2 63.546 1.09631 -3.45067 63.546000 Cu 0.708259 0.508493 0.75 3 63.546 4.62461 -3.42857 63.546000 Cu 0.950534 0.515676 0.75 4 63.546 1.09631 -3.45067 63.546000 Cu 0.708332 0.482477 0.75 6 63.546 4.62258 -3.43025 63.546000 Cu 0.539099 0.519547 8.61882e-16 10 63.546 0.438491 -3.48446 63.546000 Cu 0.539099 0.519547 0.5 11 63.546 0.438491 -3.48446 63.546000 Cu 0.708332 0.482477 0.25 216 63.546 4.62258 -3.43025 63.546000 Cu 0.871679 0.495493 3.55431e-16 424 63.546 8.06176 -3.36411 63.546000 Cu 0.871679 0.495493 0.5 425 63.546 8.06176 -3.36411 63.546000 Cu 0.163191 0.522462 0.25 8 63.546 0.318461 -3.47767 63.546000 Cu 0.378158 0.532739 0.25 12 63.546 0.0802828 -3.5135 63.546000 Cu 0.163191 0.522462 0.75 15 63.546 0.318461 -3.47767 63.546000 Cu 0.378158 0.532739 0.75 16 63.546 0.0802828 -3.5135 63.546000 Cu 0.0012116 0.538395 8.68238e-16 17 63.546 0.0891805 -3.51826 63.546000 Cu 0.0012116 0.538395 0.5 18 63.546 0.0891805 -3.51826 63.546000 Cu 0.0544132 0.56133 0.25 20 63.546 0.0240829 -3.5321 63.546000 Cu 0.0544132 0.56133 0.75 24 63.546 0.0240829 -3.5321 63.546000 Cu 0.217375 0.546653 7.93067e-16 25 63.546 0.0450674 -3.53286 63.546000 Cu 0.441102 0.555726 9.26205e-16 27 63.546 0.0169768 -3.54607 63.546000 Cu 0.441102 0.555726 0.5 28 63.546 0.0169768 -3.54607 63.546000 Cu 0.217375 0.546653 0.5 31 63.546 0.0450674 -3.53286 63.546000 Cu 0.780841 0.529616 9.1951e-16 9 63.546 0.251203 -3.52233 63.546000 Cu 0.607852 0.542006 0.25 13 63.546 0.101178 -3.55713 63.546000 Cu 0.832758 0.552259 0.25 19 63.546 0.0283422 -3.53076 63.546000 Cu 0.780841 0.529616 0.5 21 63.546 0.251203 -3.52233 63.546000 Cu 0.607852 0.542006 0.75 22 63.546 0.101178 -3.55713 63.546000 Cu 0.832758 0.552259 0.75 23 63.546 0.0283422 -3.53076 63.546000 Cu 0.27619 0.569853 0.25 29 63.546 0.00586753 -3.54427 63.546000 Cu 0.27619 0.569853 0.75 32 63.546 0.00586753 -3.54427 63.546000 Cu 0.110834 0.584166 5.92046e-16 41 63.546 0.00711049 -3.53749 63.546000 Cu 0.332294 0.593064 6.74336e-16 43 63.546 0.000812006 -3.54049 63.546000 Cu 0.332294 0.593064 0.5 44 63.546 0.000812006 -3.54049 63.546000 Cu 0.166435 0.607125 0.25 45 63.546 0.00181898 -3.53816 63.546000 Cu 0.110834 0.584166 0.5 47 63.546 0.00711049 -3.53749 63.546000 Cu 0.166435 0.607125 0.75 48 63.546 0.00181898 -3.53816 63.546000 Cu 0.497564 0.579017 0.25 30 63.546 0.00208163 -3.54005 63.546000 Cu 0.497564 0.579017 0.75 38 63.546 0.00208163 -3.54005 63.546000 Cu 0.663482 0.565248 5.97215e-16 26 63.546 0.0141577 -3.54236 63.546000 Cu 0.663482 0.565248 0.5 37 63.546 0.0141577 -3.54236 63.546000 Cu 0.887382 0.575065 6.98319e-16 33 63.546 0.0076324 -3.53485 63.546000 Cu 0.887382 0.575065 0.5 34 63.546 0.0076324 -3.53485 63.546000 Cu 0.719808 0.58842 0.25 35 63.546 0.00484507 -3.54135 63.546000 Cu 0.943713 0.597928 0.25 36 63.546 0.00182303 -3.53851 63.546000 Cu 0.719808 0.58842 0.75 39 63.546 0.00484507 -3.54135 63.546000 Cu 0.943713 0.597928 0.75 40 63.546 0.00182303 -3.53851 63.546000 Cu 0.553949 0.602234 7.48235e-16 42 63.546 0.000770587 -3.54036 63.546000 Cu 0.553949 0.602234 0.5 54 63.546 0.000770587 -3.54036 63.546000 Cu 0.388256 0.616202 0.25 46 63.546 0.000213199 -3.54008 63.546000 Cu 0.388256 0.616202 0.75 55 63.546 0.000213199 -3.54008 63.546000 Cu 0.0554384 0.643937 0.25 57 63.546 0.000121053 -3.53938 63.546000 Cu 0.0554384 0.643937 0.75 60 63.546 0.000121053 -3.53938 63.546000 Cu 0.444481 0.639281 6.87471e-16 61 63.546 0.000160265 -3.54002 63.546000 Cu 0.222115 0.630142 4.86111e-16 62 63.546 0.000524702 -3.53887 63.546000 Cu 0.222115 0.630142 0.5 63 63.546 0.000524702 -3.53887 63.546000 Cu 0.444481 0.639281 0.5 70 63.546 0.000160265 -3.54002 63.546000 Cu 0.999585 0.620907 6.15606e-16 49 63.546 0.000425887 -3.53922 63.546000 Cu 0.999585 0.620907 0.5 58 63.546 0.000425887 -3.53922 63.546000 Cu 0.776598 0.611507 7.7366e-16 50 63.546 0.00174486 -3.54108 63.546000 Cu 0.776598 0.611507 0.5 51 63.546 0.00174486 -3.54108 63.546000 Cu 0.610527 0.625359 0.25 52 63.546 0.000213106 -3.54053 63.546000 Cu 0.832776 0.634603 0.25 53 63.546 0.000773414 -3.54058 63.546000 Cu 0.610527 0.625359 0.75 56 63.546 0.000213106 -3.54053 63.546000 Cu 0.832776 0.634603 0.75 59 63.546 0.000773414 -3.54058 63.546000 Cu 0.666587 0.648484 6.76963e-16 66 63.546 2.99988e-05 -3.54036 63.546000 Cu 0.666587 0.648484 0.5 67 63.546 2.99988e-05 -3.54036 63.546000 Cu 0.278046 0.653159 0.25 64 63.546 0.00018319 -3.53945 63.546000 Cu 0.278046 0.653159 0.75 71 63.546 0.00018319 -3.53945 63.546000 Cu 0.33354 0.676206 5.98232e-16 77 63.546 1.56413e-05 -3.53969 63.546000 Cu 0.111172 0.66698 7.65609e-16 78 63.546 4.72598e-05 -3.53992 63.546000 Cu 0.111172 0.66698 0.5 79 63.546 4.72598e-05 -3.53992 63.546000 Cu 0.166718 0.690046 0.25 80 63.546 3.26935e-05 -3.5401 63.546000 Cu 0.33354 0.676206 0.5 86 63.546 1.56413e-05 -3.53969 63.546000 Cu 0.166718 0.690046 0.75 87 63.546 3.26935e-05 -3.5401 63.546000 Cu 0.888756 0.657709 7.46201e-16 65 63.546 0.000294812 -3.54052 63.546000 Cu 0.500253 0.662364 0.25 68 63.546 8.74171e-05 -3.53986 63.546000 Cu 0.722366 0.671599 0.25 69 63.546 5.63934e-05 -3.54037 63.546000 Cu 0.500253 0.662364 0.75 72 63.546 8.74171e-05 -3.53986 63.546000 Cu 0.944508 0.680812 0.25 73 63.546 6.69834e-05 -3.54047 63.546000 Cu 0.888756 0.657709 0.5 74 63.546 0.000294812 -3.54052 63.546000 Cu 0.722366 0.671599 0.75 75 63.546 5.63934e-05 -3.54037 63.546000 Cu 0.944508 0.680812 0.75 76 63.546 6.69834e-05 -3.54047 63.546000 Cu 0.778007 0.6947 8.76204e-16 81 63.546 0.000120345 -3.54005 63.546000 Cu 0.555726 0.685447 6.87132e-16 82 63.546 1.8408e-05 -3.53981 63.546000 Cu 0.555726 0.685447 0.5 83 63.546 1.8408e-05 -3.53981 63.546000 Cu 0.778007 0.6947 0.5 93 63.546 0.000120345 -3.54005 63.546000 Cu 0.388997 0.699273 0.25 84 63.546 3.46435e-05 -3.5398 63.546000 Cu 0.388997 0.699273 0.75 88 63.546 3.46435e-05 -3.5398 63.546000 Cu 0.000157128 0.703905 5.73232e-16 89 63.546 1.06643e-05 -3.54009 63.546000 Cu 0.000157128 0.703905 0.5 90 63.546 1.06643e-05 -3.54009 63.546000 Cu 0.0558285 0.726986 0.25 92 63.546 5.94674e-06 -3.53998 63.546000 Cu 0.0558285 0.726986 0.75 96 63.546 5.94674e-06 -3.53998 63.546000 Cu 0.222384 0.713131 7.82558e-16 97 63.546 2.69314e-06 -3.54 63.546000 Cu 0.44464 0.72235 6.78997e-16 99 63.546 1.91084e-05 -3.54007 63.546000 Cu 0.44464 0.72235 0.5 100 63.546 1.91084e-05 -3.54007 63.546000 Cu 0.277996 0.73621 0.25 101 63.546 2.60391e-06 -3.54005 63.546000 Cu 0.222384 0.713131 0.5 103 63.546 2.69314e-06 -3.54 63.546000 Cu 0.277996 0.73621 0.75 104 63.546 2.60391e-06 -3.54005 63.546000 Cu 0.611306 0.708518 0.25 85 63.546 5.34516e-06 -3.53975 63.546000 Cu 0.833674 0.717776 0.25 91 63.546 9.77552e-05 -3.53981 63.546000 Cu 0.611306 0.708518 0.75 94 63.546 5.34516e-06 -3.53975 63.546000 Cu 0.833674 0.717776 0.75 95 63.546 9.77552e-05 -3.53981 63.546000 Cu 0.666905 0.731592 7.66626e-16 98 63.546 1.37264e-05 -3.5399 63.546000 Cu 0.666905 0.731592 0.5 109 63.546 1.37264e-05 -3.5399 63.546000 Cu 0.111382 0.750067 8.93069e-16 113 63.546 7.44812e-06 -3.53998 63.546000 Cu 0.333643 0.759286 6.14504e-16 115 63.546 1.32549e-06 -3.53998 63.546000 Cu 0.333643 0.759286 0.5 116 63.546 1.32549e-06 -3.53998 63.546000 Cu 0.167012 0.773136 0.25 117 63.546 1.99437e-05 -3.53997 63.546000 Cu 0.389305 0.782362 0.25 118 63.546 1.51446e-05 -3.53993 63.546000 Cu 0.111382 0.750067 0.5 119 63.546 7.44812e-06 -3.53998 63.546000 Cu 0.167012 0.773136 0.75 120 63.546 1.99437e-05 -3.53997 63.546000 Cu 0.389305 0.782362 0.75 127 63.546 1.51446e-05 -3.53993 63.546000 Cu 0.500276 0.745429 0.25 102 63.546 9.54179e-06 -3.54 63.546000 Cu 0.889238 0.740845 7.73405e-16 105 63.546 4.53422e-05 -3.53985 63.546000 Cu 0.889238 0.740845 0.5 106 63.546 4.53422e-05 -3.53985 63.546000 Cu 0.722491 0.754664 0.25 107 63.546 1.88119e-05 -3.54007 63.546000 Cu 0.944783 0.763917 0.25 108 63.546 3.1173e-05 -3.53988 63.546000 Cu 0.500276 0.745429 0.75 110 63.546 9.54179e-06 -3.54 63.546000 Cu 0.722491 0.754664 0.75 111 63.546 1.88119e-05 -3.54007 63.546000 Cu 0.944783 0.763917 0.75 112 63.546 3.1173e-05 -3.53988 63.546000 Cu 0.555847 0.768508 9.74596e-16 114 63.546 1.5923e-05 -3.54003 63.546000 Cu 0.778124 0.777744 8.18576e-16 122 63.546 3.70731e-05 -3.54003 63.546000 Cu 0.778124 0.777744 0.5 123 63.546 3.70731e-05 -3.54003 63.546000 Cu 0.555847 0.768508 0.5 126 63.546 1.5923e-05 -3.54003 63.546000 Cu 0.000535418 0.786983 6.18572e-16 121 63.546 1.65096e-05 -3.53987 63.546000 Cu 0.0564039 0.810066 0.25 129 63.546 3.93948e-05 -3.54016 63.546000 Cu 0.000535418 0.786983 0.5 130 63.546 1.65096e-05 -3.53987 63.546000 Cu 0.0564039 0.810066 0.75 132 63.546 3.93948e-05 -3.54016 63.546000 Cu 0.445204 0.805436 8.15949e-16 133 63.546 7.88079e-06 -3.53987 63.546000 Cu 0.222821 0.796222 6.2264e-16 134 63.546 2.55586e-05 -3.54016 63.546000 Cu 0.222821 0.796222 0.5 135 63.546 2.55586e-05 -3.54016 63.546000 Cu 0.278871 0.819304 0.25 136 63.546 2.73755e-05 -3.54008 63.546000 Cu 0.445204 0.805436 0.5 142 63.546 7.88079e-06 -3.53987 63.546000 Cu 0.278871 0.819304 0.75 143 63.546 2.73755e-05 -3.54008 63.546000 Cu 0.611621 0.791583 0.25 124 63.546 1.33744e-05 -3.53979 63.546000 Cu 0.834074 0.800811 0.25 125 63.546 1.45875e-05 -3.53998 63.546000 Cu 0.611621 0.791583 0.75 128 63.546 1.33744e-05 -3.53979 63.546000 Cu 0.834074 0.800811 0.75 131 63.546 1.45875e-05 -3.53998 63.546000 Cu 0.889917 0.823881 6.04588e-16 137 63.546 4.30423e-05 -3.53993 63.546000 Cu 0.667544 0.814652 7.23659e-16 138 63.546 2.69547e-05 -3.53979 63.546000 Cu 0.667544 0.814652 0.5 139 63.546 2.69547e-05 -3.53979 63.546000 Cu 0.889917 0.823881 0.5 146 63.546 4.30423e-05 -3.53993 63.546000 Cu 0.334888 0.8424 4.14161e-16 149 63.546 8.63746e-05 -3.54025 63.546000 Cu 0.112553 0.833146 7.79422e-16 150 63.546 9.81006e-05 -3.54024 63.546000 Cu 0.112553 0.833146 0.5 151 63.546 9.81006e-05 -3.54024 63.546000 Cu 0.168564 0.85623 0.25 152 63.546 0.000289538 -3.54047 63.546000 Cu 0.39098 0.865516 0.25 156 63.546 0.000373331 -3.54044 63.546000 Cu 0.334888 0.8424 0.5 158 63.546 8.63746e-05 -3.54025 63.546000 Cu 0.168564 0.85623 0.75 159 63.546 0.000289538 -3.54047 63.546000 Cu 0.39098 0.865516 0.75 160 63.546 0.000373331 -3.54044 63.546000 Cu 0.501093 0.828519 0.25 140 63.546 2.59211e-05 -3.53998 63.546000 Cu 0.7233 0.837702 0.25 141 63.546 0.000180185 -3.53938 63.546000 Cu 0.501093 0.828519 0.75 144 63.546 2.59211e-05 -3.53998 63.546000 Cu 0.945957 0.846926 0.25 145 63.546 9.79061e-05 -3.53957 63.546000 Cu 0.7233 0.837702 0.75 147 63.546 0.000180185 -3.53938 63.546000 Cu 0.945957 0.846926 0.75 148 63.546 9.79061e-05 -3.53957 63.546000 Cu 0.779213 0.860728 6.6959e-16 153 63.546 0.000633839 -3.53907 63.546000 Cu 0.556979 0.851602 2.30852e-16 154 63.546 8.71951e-05 -3.53988 63.546000 Cu 0.556979 0.851602 0.5 155 63.546 8.71951e-05 -3.53988 63.546000 Cu 0.779213 0.860728 0.5 165 63.546 0.000633839 -3.53907 63.546000 Cu 0.00169306 0.869948 5.75435e-17 161 63.546 0.000362713 -3.53916 63.546000 Cu 0.00169306 0.869948 0.5 162 63.546 0.000362713 -3.53916 63.546000 Cu 0.0573772 0.892931 0.25 164 63.546 0.00175144 -3.53853 63.546000 Cu 0.0573772 0.892931 0.75 168 63.546 0.00175144 -3.53853 63.546000 Cu 0.224646 0.879319 6.98828e-16 169 63.546 0.00086823 -3.5413 63.546000 Cu 0.447186 0.888664 8.54085e-16 171 63.546 0.00122649 -3.54045 63.546000 Cu 0.447186 0.888664 0.5 172 63.546 0.00122649 -3.54045 63.546000 Cu 0.280949 0.902428 0.25 173 63.546 0.00351591 -3.5414 63.546000 Cu 0.224646 0.879319 0.5 175 63.546 0.00086823 -3.5413 63.546000 Cu 0.280949 0.902428 0.75 176 63.546 0.00351591 -3.5414 63.546000 Cu 0.613031 0.874693 0.25 157 63.546 0.000232676 -3.54011 63.546000 Cu 0.834784 0.88375 0.25 163 63.546 0.00182724 -3.53823 63.546000 Cu 0.613031 0.874693 0.75 166 63.546 0.000232676 -3.54011 63.546000 Cu 0.834784 0.88375 0.75 167 63.546 0.00182724 -3.53823 63.546000 Cu 0.668746 0.897836 6.82132e-16 170 63.546 0.000887671 -3.54066 63.546000 Cu 0.503173 0.911882 0.25 174 63.546 0.00274406 -3.54008 63.546000 Cu 0.890051 0.906723 1.22875e-15 177 63.546 0.00680559 -3.53766 63.546000 Cu 0.890051 0.906723 0.5 178 63.546 0.00680559 -3.53766 63.546000 Cu 0.668746 0.897836 0.5 181 63.546 0.000887671 -3.54066 63.546000 Cu 0.503173 0.911882 0.75 182 63.546 0.00274406 -3.54008 63.546000 Cu 0.113212 0.915796 9.91461e-16 185 63.546 0.00809127 -3.53489 63.546000 Cu 0.336858 0.925601 3.1204e-16 187 63.546 0.0113992 -3.54256 63.546000 Cu 0.336858 0.925601 0.5 188 63.546 0.0113992 -3.54256 63.546000 Cu 0.1675 0.938617 0.25 189 63.546 0.0284129 -3.53088 63.546000 Cu 0.39232 0.948838 0.25 190 63.546 0.0951974 -3.55671 63.546000 Cu 0.113212 0.915796 0.5 191 63.546 0.00809127 -3.53489 63.546000 Cu 0.1675 0.938617 0.75 192 63.546 0.0284129 -3.53088 63.546000 Cu 0.39232 0.948838 0.75 199 63.546 0.0951974 -3.55671 63.546000 Cu 0.999021 0.952518 6.41793e-16 193 63.546 0.0870536 -3.5182 63.546000 Cu 0.999021 0.952518 0.5 202 63.546 0.0870536 -3.5182 63.546000 Cu 0.724448 0.921062 0.25 179 63.546 0.00653421 -3.54427 63.546000 Cu 0.94599 0.929574 0.25 180 63.546 0.0225925 -3.53218 63.546000 Cu 0.724448 0.921062 0.75 183 63.546 0.00653421 -3.54427 63.546000 Cu 0.94599 0.929574 0.75 184 63.546 0.0225925 -3.53218 63.546000 Cu 0.559194 0.935162 7.72897e-16 186 63.546 0.0179017 -3.5459 63.546000 Cu 0.782883 0.944264 6.92133e-16 194 63.546 0.0457395 -3.5328 63.546000 Cu 0.782883 0.944264 0.5 195 63.546 0.0457395 -3.5328 63.546000 Cu 0.559194 0.935162 0.5 198 63.546 0.0179017 -3.5459 63.546000 Cu 0.0498272 0.975232 0.25 201 63.546 1.07635 -3.45049 63.546000 Cu 0.0498272 0.975232 0.75 204 63.546 1.07635 -3.45049 63.546000 Cu 0.460819 0.971308 1.03765e-15 205 63.546 0.421647 -3.48514 63.546000 Cu 0.219432 0.961252 4.43653e-16 206 63.546 0.247001 -3.52297 63.546000 Cu 0.219432 0.961252 0.5 207 63.546 0.247001 -3.52297 63.546000 Cu 0.291815 0.9824 0.25 208 63.546 4.62161 -3.42837 63.546000 Cu 0.460819 0.971308 0.5 213 63.546 0.421647 -3.48514 63.546000 Cu 0.291815 0.9824 0.75 214 63.546 4.62161 -3.42837 63.546000 Cu 0.128649 0.995395 1 217 63.546 8.03466 -3.36337 63.546000 Cu 0.128649 0.995395 0.5 218 63.546 8.03466 -3.36337 63.546000 Cu 0.892443 0.995373 6.75607e-16 219 63.546 7.73906 -3.50601 63.546000 Cu 0.892443 0.995373 0.5 220 63.546 7.73906 -3.50601 63.546000 Cu 0.621981 0.958156 0.25 196 63.546 0.0784698 -3.5136 63.546000 Cu 0.837106 0.968462 0.25 197 63.546 0.321524 -3.47842 63.546000 Cu 0.621981 0.958156 0.75 200 63.546 0.0784698 -3.5136 63.546000 Cu 0.837106 0.968462 0.75 203 63.546 0.321524 -3.47842 63.546000 Cu 0.67543 0.982103 6.33911e-16 210 63.546 4.14894 -3.45009 63.546000 Cu 0.67543 0.982103 0.5 211 63.546 4.14894 -3.45009 63.546000 Cu 0.500005 0.995374 0.25 212 63.546 6.71853 -3.54474 63.546000 Cu 0.500005 0.995374 0.75 215 63.546 6.71853 -3.54474