Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.5656 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 74.2303 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62732 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 0.0992563 0.00491122 1 216 63.546 6.72809 -3.00211 63.546000 Cu 0.00400403 0.00492117 0.5 217 63.546 0.986413 -3.28777 63.546000 Cu 0.0121055 0.0292639 1.14777e-17 226 63.546 0.644766 -3.26267 63.546000 Cu 0.133301 0.0476885 7.74746e-17 227 63.546 0.0589012 -3.28285 63.546000 Cu 0.116437 0.025354 0.5 228 63.546 3.53959 -3.1686 63.546000 Cu 0.0332948 0.052749 0.5 229 63.546 0.142156 -3.27725 63.546000 Cu 0.216952 0.0205107 6.26492e-17 230 63.546 9.29057 -2.98824 63.546000 Cu 0.331217 0.0352635 6.45621e-18 231 63.546 0.688815 -3.16789 63.546000 Cu 0.307338 0.0048754 0.5 232 63.546 7.07531 -3.11417 63.546000 Cu 0.236485 0.0423264 0.5 233 63.546 0.643353 -3.20839 63.546000 Cu 0.252346 0.0657501 1.6571e-16 251 63.546 0.0934211 -3.28204 63.546000 Cu 0.599256 0.00491122 5.6193e-17 211 63.546 6.72809 -3.00211 63.546000 Cu 0.616437 0.025354 0.5 213 63.546 3.53959 -3.1686 63.546000 Cu 0.633301 0.0476885 8.10614e-17 218 63.546 0.0589012 -3.28285 63.546000 Cu 0.406645 0.00492556 4.71065e-17 234 63.546 1.317 -3.24825 63.546000 Cu 0.512106 0.0292639 3.34767e-17 235 63.546 0.644766 -3.26267 63.546000 Cu 0.504004 0.00492117 0.5 236 63.546 0.986413 -3.28777 63.546000 Cu 0.416934 0.0310846 0.5 237 63.546 0.544143 -3.21726 63.546000 Cu 0.347369 0.0614337 0.5 253 63.546 0.0737655 -3.27731 63.546000 Cu 0.438615 0.0571882 5.6193e-17 255 63.546 0.116876 -3.26624 63.546000 Cu 0.533295 0.052749 0.5 257 63.546 0.142156 -3.27725 63.546000 Cu 0.716952 0.0205107 2.63031e-17 212 63.546 9.29057 -2.98824 63.546000 Cu 0.906645 0.00492556 4.06502e-18 214 63.546 1.317 -3.24825 63.546000 Cu 0.807338 0.0048754 0.5 215 63.546 7.07531 -3.11417 63.546000 Cu 0.736485 0.0423264 0.5 220 63.546 0.643353 -3.20839 63.546000 Cu 0.831217 0.0352635 7.55616e-17 222 63.546 0.688815 -3.16789 63.546000 Cu 0.938615 0.0571882 9.23e-17 223 63.546 0.116876 -3.26624 63.546000 Cu 0.916934 0.0310846 0.5 224 63.546 0.544143 -3.21726 63.546000 Cu 0.847369 0.0614337 0.5 225 63.546 0.0737655 -3.27731 63.546000 Cu 0.752346 0.0657501 1.17647e-16 219 63.546 0.0934211 -3.28204 63.546000 Cu 0.0559954 0.076466 1.24581e-16 247 63.546 0.00832314 -3.27964 63.546000 Cu 0.173438 0.0951058 8.0344e-17 248 63.546 0.018449 -3.28403 63.546000 Cu 0.153941 0.0710129 0.5 249 63.546 0.0386063 -3.28534 63.546000 Cu 0.077037 0.100291 0.5 250 63.546 0.00661726 -3.28268 63.546000 Cu 0.269138 0.0904455 0.5 254 63.546 0.00743976 -3.28199 63.546000 Cu 0.0965003 0.124374 9.85171e-17 269 63.546 0.00494836 -3.2836 63.546000 Cu 0.192216 0.119533 0.5 271 63.546 0.00211477 -3.28237 63.546000 Cu 0.287526 0.114968 5.76277e-17 273 63.546 0.00459717 -3.28173 63.546000 Cu 0.653941 0.0710129 0.5 221 63.546 0.0386063 -3.28534 63.546000 Cu 0.5965 0.124374 8.46481e-17 238 63.546 0.00494836 -3.2836 63.546000 Cu 0.364512 0.0862916 1.91295e-16 252 63.546 0.0275634 -3.28168 63.546000 Cu 0.555995 0.076466 1.78622e-16 256 63.546 0.00832314 -3.27964 63.546000 Cu 0.459873 0.0817134 0.5 258 63.546 0.0381286 -3.28133 63.546000 Cu 0.383471 0.110412 0.5 275 63.546 0.0093574 -3.28165 63.546000 Cu 0.48021 0.105545 1.48254e-17 277 63.546 0.00386239 -3.28151 63.546000 Cu 0.577037 0.100291 0.5 278 63.546 0.00661726 -3.28268 63.546000 Cu 0.499978 0.129388 0.5 279 63.546 0.00129806 -3.28349 63.546000 Cu 0.999978 0.129388 0.5 267 63.546 0.00129806 -3.28349 63.546000 Cu 0.673438 0.0951058 8.77567e-17 239 63.546 0.018449 -3.28403 63.546000 Cu 0.787526 0.114968 1.33668e-16 240 63.546 0.00459717 -3.28173 63.546000 Cu 0.769138 0.0904455 0.5 241 63.546 0.00743976 -3.28199 63.546000 Cu 0.692216 0.119533 0.5 242 63.546 0.00211477 -3.28237 63.546000 Cu 0.864512 0.0862916 1.76709e-16 243 63.546 0.0275634 -3.28168 63.546000 Cu 0.98021 0.105545 1.42993e-16 244 63.546 0.00386239 -3.28151 63.546000 Cu 0.959873 0.0817134 0.5 245 63.546 0.0381286 -3.28133 63.546000 Cu 0.883471 0.110412 0.5 246 63.546 0.0093574 -3.28165 63.546000 Cu 0.0193609 0.153415 5.23671e-17 266 63.546 0.00136086 -3.28374 63.546000 Cu 0.211247 0.143899 2.96508e-17 270 63.546 0.000799628 -3.28234 63.546000 Cu 0.115472 0.148596 0.5 272 63.546 0.000788231 -3.28317 63.546000 Cu 0.306977 0.139202 0.5 276 63.546 0.00298053 -3.28221 63.546000 Cu 0.0386314 0.177576 0.5 288 63.546 0.000283904 -3.28327 63.546000 Cu 0.134594 0.172817 5.81059e-17 290 63.546 9.93255e-05 -3.28286 63.546000 Cu 0.249978 0.192167 5.6193e-17 291 63.546 0.000196811 -3.28295 63.546000 Cu 0.230578 0.168084 0.5 292 63.546 0.000794942 -3.2826 63.546000 Cu 0.153839 0.196969 0.5 293 63.546 0.000167329 -3.28283 63.546000 Cu 0.326724 0.163262 5.6193e-17 294 63.546 0.000449632 -3.28273 63.546000 Cu 0.634594 0.172817 7.07792e-17 259 63.546 9.93255e-05 -3.28286 63.546000 Cu 0.615472 0.148596 0.5 260 63.546 0.000788231 -3.28317 63.546000 Cu 0.403226 0.134363 8.84741e-17 274 63.546 0.0012114 -3.2828 63.546000 Cu 0.653839 0.196969 0.5 281 63.546 0.000167329 -3.28283 63.546000 Cu 0.442535 0.182417 1 295 63.546 0.00038384 -3.28338 63.546000 Cu 0.423008 0.158339 0.5 296 63.546 0.000294185 -3.28336 63.546000 Cu 0.34627 0.187301 0.5 297 63.546 8.24967e-05 -3.28319 63.546000 Cu 0.519361 0.153415 5.6193e-17 298 63.546 0.00136086 -3.28374 63.546000 Cu 0.538631 0.177576 0.5 299 63.546 0.000283904 -3.28327 63.546000 Cu 0.711247 0.143899 1.5471e-16 261 63.546 0.000799628 -3.28234 63.546000 Cu 0.826724 0.163262 5.6193e-17 262 63.546 0.000449632 -3.28273 63.546000 Cu 0.806977 0.139202 0.5 263 63.546 0.00298053 -3.28221 63.546000 Cu 0.730578 0.168084 0.5 264 63.546 0.000794942 -3.2826 63.546000 Cu 0.903226 0.134363 1.14777e-16 265 63.546 0.0012114 -3.2828 63.546000 Cu 0.923008 0.158339 0.5 268 63.546 0.000294185 -3.28336 63.546000 Cu 0.749978 0.192167 1.12386e-17 282 63.546 0.000196811 -3.28295 63.546000 Cu 0.84627 0.187301 0.5 284 63.546 8.24967e-05 -3.28319 63.546000 Cu 0.942535 0.182417 5.47583e-17 286 63.546 0.00038384 -3.28338 63.546000 Cu 0.0578234 0.201742 5.6193e-17 287 63.546 2.74607e-05 -3.28294 63.546000 Cu 0.0961578 0.249978 9.80388e-18 309 63.546 2.04412e-05 -3.28296 63.546000 Cu 0.0769925 0.225875 0.5 310 63.546 3.68201e-05 -3.2829 63.546000 Cu 3.47499e-05 0.254779 0.5 311 63.546 1.05758e-07 -3.2829 63.546000 Cu 0.173124 0.221076 1.01626e-16 312 63.546 9.46926e-05 -3.28296 63.546000 Cu 0.288563 0.240314 1.21951e-17 313 63.546 1.06567e-05 -3.28318 63.546000 Cu 0.269341 0.216235 0.5 314 63.546 2.88215e-05 -3.28316 63.546000 Cu 0.192334 0.245159 0.5 315 63.546 2.13423e-05 -3.28308 63.546000 Cu 0.307724 0.2644 0.5 336 63.546 1.92084e-05 -3.2831 63.546000 Cu 0.596158 0.249978 1 300 63.546 2.04412e-05 -3.28296 63.546000 Cu 0.365593 0.211374 8.79958e-17 316 63.546 0.000111393 -3.28326 63.546000 Cu 0.480893 0.230666 4.73456e-17 317 63.546 1.15625e-05 -3.28299 63.546000 Cu 0.461775 0.206537 0.5 318 63.546 0.000138661 -3.28314 63.546000 Cu 0.384766 0.235475 0.5 319 63.546 4.59276e-05 -3.28313 63.546000 Cu 0.557823 0.201742 2.84552e-17 320 63.546 2.74607e-05 -3.28294 63.546000 Cu 0.576992 0.225875 0.5 321 63.546 3.68201e-05 -3.2829 63.546000 Cu 0.403916 0.259579 5.6193e-17 338 63.546 2.62773e-05 -3.28296 63.546000 Cu 0.500035 0.254779 0.5 340 63.546 1.05758e-07 -3.2829 63.546000 Cu 0.673124 0.221076 6.93445e-18 280 63.546 9.46926e-05 -3.28296 63.546000 Cu 0.865593 0.211374 0 283 63.546 0.000111393 -3.28326 63.546000 Cu 0.769341 0.216235 0.5 285 63.546 2.88215e-05 -3.28316 63.546000 Cu 0.961775 0.206537 0.5 289 63.546 0.000138661 -3.28314 63.546000 Cu 0.692334 0.245159 0.5 302 63.546 2.13423e-05 -3.28308 63.546000 Cu 0.788563 0.240314 5.6193e-17 304 63.546 1.06567e-05 -3.28318 63.546000 Cu 0.903916 0.259579 5.6193e-17 305 63.546 2.62773e-05 -3.28296 63.546000 Cu 0.884766 0.235475 0.5 306 63.546 4.59276e-05 -3.28313 63.546000 Cu 0.807724 0.2644 0.5 307 63.546 1.92084e-05 -3.2831 63.546000 Cu 0.980893 0.230666 2.63031e-18 308 63.546 1.15625e-05 -3.28299 63.546000 Cu 0.0191705 0.278892 0 330 63.546 1.27806e-05 -3.28302 63.546000 Cu 0.134467 0.298188 5.6193e-17 331 63.546 0.00012886 -3.28323 63.546000 Cu 0.115296 0.274084 0.5 332 63.546 4.89842e-05 -3.28316 63.546000 Cu 0.038299 0.303025 0.5 333 63.546 0.000137012 -3.28316 63.546000 Cu 0.211501 0.269245 1 334 63.546 1.29515e-05 -3.2832 63.546000 Cu 0.326942 0.288483 5.6193e-17 335 63.546 9.51706e-05 -3.28296 63.546000 Cu 0.230729 0.293325 0.5 337 63.546 2.10187e-05 -3.28315 63.546000 Cu 0.0575209 0.327139 1.86513e-17 351 63.546 0.000353677 -3.28335 63.546000 Cu 0.153784 0.322253 0.5 353 63.546 7.23731e-05 -3.28315 63.546000 Cu 0.250062 0.317389 5.6193e-17 355 63.546 0.000207378 -3.28295 63.546000 Cu 0.615296 0.274084 0.5 303 63.546 4.89842e-05 -3.28316 63.546000 Cu 0.634467 0.298188 4.06502e-17 322 63.546 0.00012886 -3.28323 63.546000 Cu 0.653784 0.322253 0.5 325 63.546 7.23731e-05 -3.28315 63.546000 Cu 0.51917 0.278892 1 339 63.546 1.27806e-05 -3.28302 63.546000 Cu 0.423073 0.283682 0.5 341 63.546 4.49973e-05 -3.28292 63.546000 Cu 0.346217 0.312587 0.5 357 63.546 0.000187116 -3.28285 63.546000 Cu 0.442231 0.307819 2.63031e-18 359 63.546 2.62628e-05 -3.28296 63.546000 Cu 0.557521 0.327139 5.6193e-17 360 63.546 0.000353677 -3.28335 63.546000 Cu 0.538299 0.303025 0.5 361 63.546 0.000137012 -3.28316 63.546000 Cu 0.461405 0.331981 0.5 362 63.546 0.000303704 -3.28323 63.546000 Cu 0.711501 0.269245 5.6193e-17 301 63.546 1.29515e-05 -3.2832 63.546000 Cu 0.750062 0.317389 4.39979e-17 323 63.546 0.000207378 -3.28295 63.546000 Cu 0.730729 0.293325 0.5 324 63.546 2.10187e-05 -3.28315 63.546000 Cu 0.826942 0.288483 5.6193e-17 326 63.546 9.51706e-05 -3.28296 63.546000 Cu 0.942231 0.307819 5.6193e-17 327 63.546 2.62628e-05 -3.28296 63.546000 Cu 0.923073 0.283682 0.5 328 63.546 4.49973e-05 -3.28292 63.546000 Cu 0.846217 0.312587 0.5 329 63.546 0.000187116 -3.28285 63.546000 Cu 0.961405 0.331981 0.5 349 63.546 0.000303704 -3.28323 63.546000 Cu 0.173324 0.346293 5.6193e-17 352 63.546 0.000444577 -3.28282 63.546000 Cu 0.0769959 0.351212 0.5 354 63.546 0.000286841 -3.28341 63.546000 Cu 0.269459 0.341474 0.5 358 63.546 0.000730157 -3.28262 63.546000 Cu 4.69682e-05 0.380166 0.5 371 63.546 0.0013468 -3.28353 63.546000 Cu 0.0967812 0.375192 5.6193e-17 373 63.546 0.00111364 -3.28281 63.546000 Cu 0.212471 0.394568 6.45621e-18 374 63.546 0.00480786 -3.28168 63.546000 Cu 0.193042 0.370352 0.5 375 63.546 0.00281439 -3.28221 63.546000 Cu 0.116546 0.399128 0.5 376 63.546 0.00959611 -3.28157 63.546000 Cu 0.288795 0.365652 1.43471e-18 377 63.546 0.000800357 -3.28227 63.546000 Cu 0.307793 0.390006 0.5 380 63.546 0.00201671 -3.28236 63.546000 Cu 0.596781 0.375192 5.6193e-17 342 63.546 0.00111364 -3.28281 63.546000 Cu 0.365442 0.336739 9.08652e-18 356 63.546 8.87421e-05 -3.28285 63.546000 Cu 0.616546 0.399128 0.5 364 63.546 0.00959611 -3.28157 63.546000 Cu 0.403509 0.385176 5.6193e-17 378 63.546 0.00501358 -3.28359 63.546000 Cu 0.384539 0.360956 0.5 379 63.546 0.000791252 -3.28316 63.546000 Cu 0.480664 0.356133 5.6193e-17 381 63.546 0.00123709 -3.28378 63.546000 Cu 0.576996 0.351212 0.5 382 63.546 0.000286841 -3.28341 63.546000 Cu 0.500047 0.380166 0.5 383 63.546 0.0013468 -3.28353 63.546000 Cu 0.673324 0.346293 3.08464e-17 343 63.546 0.000444577 -3.28282 63.546000 Cu 0.788795 0.365652 6.07362e-17 344 63.546 0.000800357 -3.28227 63.546000 Cu 0.769459 0.341474 0.5 345 63.546 0.000730157 -3.28262 63.546000 Cu 0.693042 0.370352 0.5 346 63.546 0.00281439 -3.28221 63.546000 Cu 0.865442 0.336739 5.6193e-17 347 63.546 8.87421e-05 -3.28285 63.546000 Cu 0.980664 0.356133 1.21951e-17 348 63.546 0.00123709 -3.28378 63.546000 Cu 0.884539 0.360956 0.5 350 63.546 0.000791252 -3.28316 63.546000 Cu 0.712471 0.394568 5.6193e-17 365 63.546 0.00480786 -3.28168 63.546000 Cu 0.807793 0.390006 0.5 367 63.546 0.00201671 -3.28236 63.546000 Cu 0.903509 0.385176 5.6193e-17 369 63.546 0.00501358 -3.28359 63.546000 Cu 0.0197715 0.403998 5.6193e-17 370 63.546 0.00381633 -3.28142 63.546000 Cu 0.061345 0.452341 1 391 63.546 0.117274 -3.26623 63.546000 Cu 0.0400956 0.42782 0.5 392 63.546 0.0385044 -3.28135 63.546000 Cu 0.135479 0.42324 5.6193e-17 394 63.546 0.0280676 -3.28172 63.546000 Cu 0.247608 0.443785 1.48015e-16 395 63.546 0.0940431 -3.28218 63.546000 Cu 0.230849 0.419091 0.5 396 63.546 0.00742874 -3.28199 63.546000 Cu 0.152572 0.448095 0.5 397 63.546 0.0745078 -3.2773 63.546000 Cu 0.326523 0.414437 5.83451e-17 398 63.546 0.0189086 -3.2841 63.546000 Cu 0.561345 0.452341 1.62601e-17 5 63.546 0.117274 -3.26623 63.546000 Cu 0.466675 0.456786 0.5 12 63.546 0.142101 -3.27726 63.546000 Cu 0.366678 0.461841 4.85412e-17 205 63.546 0.058616 -3.28274 63.546000 Cu 0.635479 0.42324 5.6193e-17 363 63.546 0.0280676 -3.28172 63.546000 Cu 0.652572 0.448095 0.5 385 63.546 0.0745078 -3.2773 63.546000 Cu 0.44397 0.433072 5.6193e-17 399 63.546 0.00825635 -3.27964 63.546000 Cu 0.422943 0.409249 0.5 400 63.546 0.00671537 -3.28268 63.546000 Cu 0.34605 0.438532 0.5 401 63.546 0.0393518 -3.2853 63.546000 Cu 0.519772 0.403998 7.77137e-17 402 63.546 0.00381633 -3.28142 63.546000 Cu 0.540096 0.42782 0.5 403 63.546 0.0385044 -3.28135 63.546000 Cu 0.826523 0.414437 0 366 63.546 0.0189086 -3.2841 63.546000 Cu 0.730849 0.419091 0.5 368 63.546 0.00742874 -3.28199 63.546000 Cu 0.922943 0.409249 0.5 372 63.546 0.00671537 -3.28268 63.546000 Cu 0.747608 0.443785 1 386 63.546 0.0940431 -3.28218 63.546000 Cu 0.866678 0.461841 1 387 63.546 0.058616 -3.28274 63.546000 Cu 0.84605 0.438532 0.5 388 63.546 0.0393518 -3.2853 63.546000 Cu 0.94397 0.433072 0 390 63.546 0.00825635 -3.27964 63.546000 Cu 0.966675 0.456786 0.5 393 63.546 0.142101 -3.27726 63.546000 Cu 0.263485 0.467207 0.5 210 63.546 0.64241 -3.20856 63.546000 Cu 0.283182 0.520277 9.80388e-17 4 63.546 9.29309 -2.98782 63.546000 Cu 0.192634 0.50463 0.5 209 63.546 7.06996 -3.11474 63.546000 Cu 0.0933453 0.504592 1 409 63.546 1.31698 -3.24837 63.546000 Cu 0.0830499 0.478445 0.5 410 63.546 0.543928 -3.2175 63.546000 Cu 0.168762 0.474269 0 411 63.546 0.686699 -3.16833 63.546000 Cu 0.283038 0.489009 1.91295e-18 412 63.546 9.28905 -2.98807 63.546000 Cu 0.0829497 0.53075 0.5 20 63.546 0.538651 -3.2167 63.546000 Cu 0.58305 0.478445 0.5 2 63.546 0.543928 -3.2175 63.546000 Cu 0.383608 0.525077 0.5 6 63.546 3.51715 -3.1698 63.546000 Cu 0.400721 0.50462 1 7 63.546 6.73031 -3.00162 63.546000 Cu 0.487887 0.528952 1.05212e-17 8 63.546 0.646927 -3.26219 63.546000 Cu 0.495989 0.504606 0.5 9 63.546 0.987456 -3.28778 63.546000 Cu 0.383541 0.484179 0.5 10 63.546 3.53604 -3.16885 63.546000 Cu 0.487883 0.480268 2.46293e-17 203 63.546 0.644516 -3.26267 63.546000 Cu 0.593345 0.504592 1 404 63.546 1.31698 -3.24837 63.546000 Cu 0.58295 0.53075 0.5 13 63.546 0.538651 -3.2167 63.546000 Cu 0.763485 0.467207 0.5 389 63.546 0.64241 -3.20856 63.546000 Cu 0.900721 0.50462 1 1 63.546 6.73031 -3.00162 63.546000 Cu 0.995989 0.504606 0.5 3 63.546 0.987456 -3.28778 63.546000 Cu 0.783182 0.520277 4.78238e-19 14 63.546 9.29309 -2.98782 63.546000 Cu 0.883608 0.525077 0.5 16 63.546 3.51715 -3.1698 63.546000 Cu 0.987887 0.528952 1 18 63.546 0.646927 -3.26219 63.546000 Cu 0.668762 0.474269 0 384 63.546 0.686699 -3.16833 63.546000 Cu 0.692634 0.50463 0.5 405 63.546 7.06996 -3.11474 63.546000 Cu 0.783038 0.489009 4.78238e-19 406 63.546 9.28905 -2.98807 63.546000 Cu 0.883541 0.484179 0.5 407 63.546 3.53604 -3.16885 63.546000 Cu 0.987883 0.480268 1 408 63.546 0.644516 -3.26267 63.546000 Cu 0.0611375 0.556904 1 19 63.546 0.114513 -3.26554 63.546000 Cu 0.168696 0.534936 5.26062e-18 22 63.546 0.693188 -3.1693 63.546000 Cu 0.247361 0.565459 7.41269e-18 23 63.546 0.09753 -3.28221 63.546000 Cu 0.26349 0.542059 0.5 24 63.546 0.634939 -3.20829 63.546000 Cu 0.152309 0.561116 0.5 25 63.546 0.0759426 -3.27708 63.546000 Cu 0.0398495 0.581474 0.5 40 63.546 0.0406652 -3.28148 63.546000 Cu 0.135167 0.585998 5.78668e-17 42 63.546 0.025175 -3.28168 63.546000 Cu 0.230463 0.590145 0.5 44 63.546 0.00839719 -3.28185 63.546000 Cu 0.326142 0.594835 8.0344e-17 46 63.546 0.0206229 -3.28405 63.546000 Cu 0.366691 0.547463 7.34096e-17 26 63.546 0.0599333 -3.28296 63.546000 Cu 0.345858 0.570766 0.5 27 63.546 0.0370561 -3.28505 63.546000 Cu 0.443815 0.57625 6.12145e-17 28 63.546 0.00937988 -3.2796 63.546000 Cu 0.466546 0.552493 0.5 29 63.546 0.143357 -3.27718 63.546000 Cu 0.561137 0.556904 1 30 63.546 0.114513 -3.26554 63.546000 Cu 0.635167 0.585998 4.97368e-17 31 63.546 0.025175 -3.28168 63.546000 Cu 0.652309 0.561116 0.5 32 63.546 0.0759426 -3.27708 63.546000 Cu 0.539849 0.581474 0.5 33 63.546 0.0406652 -3.28148 63.546000 Cu 0.668696 0.534936 1 11 63.546 0.693188 -3.1693 63.546000 Cu 0.866691 0.547463 1 15 63.546 0.0599333 -3.28296 63.546000 Cu 0.76349 0.542059 0.5 17 63.546 0.634939 -3.20829 63.546000 Cu 0.966546 0.552493 0.5 21 63.546 0.143357 -3.27718 63.546000 Cu 0.747361 0.565459 1 34 63.546 0.09753 -3.28221 63.546000 Cu 0.826142 0.594835 1.67383e-17 35 63.546 0.0206229 -3.28405 63.546000 Cu 0.845858 0.570766 0.5 36 63.546 0.0370561 -3.28505 63.546000 Cu 0.730463 0.590145 0.5 37 63.546 0.00839719 -3.28185 63.546000 Cu 0.943815 0.57625 1 38 63.546 0.00937988 -3.2796 63.546000 Cu 0.0195029 0.605325 5.6193e-17 39 63.546 0.00470678 -3.2814 63.546000 Cu 0.212095 0.614708 5.59539e-17 43 63.546 0.00413892 -3.28166 63.546000 Cu 0.116223 0.610178 0.5 45 63.546 0.0105074 -3.28168 63.546000 Cu 0.307378 0.619269 0.5 47 63.546 0.00267709 -3.28231 63.546000 Cu 0.0964995 0.634144 8.10614e-17 62 63.546 0.00140548 -3.28275 63.546000 Cu 0.173175 0.663069 5.6193e-17 63 63.546 0.000529006 -3.2827 63.546000 Cu 0.192778 0.638975 0.5 64 63.546 0.00305219 -3.2822 63.546000 Cu 0.0768548 0.65815 0.5 65 63.546 0.000241898 -3.28336 63.546000 Cu 0.288502 0.64366 3.51505e-17 66 63.546 0.00069985 -3.28228 63.546000 Cu 0.403129 0.624123 5.81059e-17 48 63.546 0.00583663 -3.2835 63.546000 Cu 0.422627 0.600069 0.5 49 63.546 0.00633878 -3.28253 63.546000 Cu 0.519503 0.605325 1.38211e-16 50 63.546 0.00470678 -3.2814 63.546000 Cu 0.596499 0.634144 2.79769e-17 51 63.546 0.00140548 -3.28275 63.546000 Cu 0.616223 0.610178 0.5 52 63.546 0.0105074 -3.28168 63.546000 Cu 0.499706 0.629158 0.5 53 63.546 0.0015139 -3.2834 63.546000 Cu 0.384262 0.648371 0.5 68 63.546 0.000920007 -3.28317 63.546000 Cu 0.480423 0.653208 5.6193e-17 70 63.546 0.00137717 -3.28378 63.546000 Cu 0.576855 0.65815 0.5 72 63.546 0.000241898 -3.28336 63.546000 Cu 0.922627 0.600069 0.5 41 63.546 0.00633878 -3.28253 63.546000 Cu 0.712095 0.614708 5.6193e-17 54 63.546 0.00413892 -3.28166 63.546000 Cu 0.788502 0.64366 5.6193e-17 55 63.546 0.00069985 -3.28228 63.546000 Cu 0.807378 0.619269 0.5 56 63.546 0.00267709 -3.28231 63.546000 Cu 0.692778 0.638975 0.5 57 63.546 0.00305219 -3.2822 63.546000 Cu 0.903129 0.624123 1 58 63.546 0.00583663 -3.2835 63.546000 Cu 0.980423 0.653208 1 59 63.546 0.00137717 -3.28378 63.546000 Cu 0.999706 0.629158 0.5 60 63.546 0.0015139 -3.2834 63.546000 Cu 0.884262 0.648371 0.5 61 63.546 0.000920007 -3.28317 63.546000 Cu 0.673175 0.663069 2.51075e-17 74 63.546 0.000529006 -3.2827 63.546000 Cu 0.269302 0.667884 0.5 69 63.546 0.000768359 -3.28254 63.546000 Cu 0.0574524 0.682246 1.79339e-17 82 63.546 0.000324036 -3.28326 63.546000 Cu 0.134465 0.711238 5.6193e-17 83 63.546 0.000106432 -3.28316 63.546000 Cu 0.153729 0.687136 0.5 84 63.546 5.67625e-05 -3.28305 63.546000 Cu 0.0382733 0.706393 0.5 85 63.546 0.000134748 -3.28307 63.546000 Cu 0.250022 0.691998 5.6193e-17 86 63.546 0.000200454 -3.28284 63.546000 Cu 0.326937 0.720949 2.72596e-17 87 63.546 6.70472e-05 -3.28294 63.546000 Cu 0.230714 0.716101 0.5 89 63.546 2.20966e-05 -3.28308 63.546000 Cu 0.019176 0.730568 1.48254e-17 102 63.546 1.66139e-05 -3.28299 63.546000 Cu 0.365288 0.672618 5.6193e-17 67 63.546 9.40322e-05 -3.28281 63.546000 Cu 0.557452 0.682246 9.32564e-18 71 63.546 0.000324036 -3.28326 63.546000 Cu 0.461312 0.677389 0.5 73 63.546 0.000313184 -3.28321 63.546000 Cu 0.653729 0.687136 0.5 77 63.546 5.67625e-05 -3.28305 63.546000 Cu 0.346178 0.696799 0.5 88 63.546 0.000149932 -3.28279 63.546000 Cu 0.442214 0.701584 1 90 63.546 1.71189e-05 -3.28289 63.546000 Cu 0.519176 0.730568 5.6193e-17 91 63.546 1.66139e-05 -3.28299 63.546000 Cu 0.538273 0.706393 0.5 92 63.546 0.000134748 -3.28307 63.546000 Cu 0.423074 0.725763 0.5 93 63.546 3.39768e-05 -3.28289 63.546000 Cu 0.634465 0.711238 5.6193e-17 94 63.546 0.000106432 -3.28316 63.546000 Cu 0.750022 0.691998 5.6193e-17 75 63.546 0.000200454 -3.28284 63.546000 Cu 0.769302 0.667884 0.5 76 63.546 0.000768359 -3.28254 63.546000 Cu 0.865288 0.672618 5.6193e-17 78 63.546 9.40322e-05 -3.28281 63.546000 Cu 0.942214 0.701584 5.26062e-18 79 63.546 1.71189e-05 -3.28289 63.546000 Cu 0.961312 0.677389 0.5 80 63.546 0.000313184 -3.28321 63.546000 Cu 0.846178 0.696799 0.5 81 63.546 0.000149932 -3.28279 63.546000 Cu 0.730714 0.716101 0.5 96 63.546 2.20966e-05 -3.28308 63.546000 Cu 0.826937 0.720949 3.2042e-17 98 63.546 6.70472e-05 -3.28294 63.546000 Cu 0.923074 0.725763 0.5 100 63.546 3.39768e-05 -3.28289 63.546000 Cu 0.0960856 0.759559 1.53036e-17 103 63.546 1.94995e-05 -3.283 63.546000 Cu 0.115292 0.73539 0.5 104 63.546 4.04531e-05 -3.28313 63.546000 Cu 0.211471 0.740236 5.6193e-17 106 63.546 1.9599e-05 -3.2832 63.546000 Cu 0.288482 0.769251 1 107 63.546 2.26148e-05 -3.28321 63.546000 Cu 0.307684 0.74509 0.5 108 63.546 1.70082e-05 -3.28312 63.546000 Cu 0.192272 0.764396 0.5 109 63.546 1.34242e-05 -3.28313 63.546000 Cu 0.0768792 0.783722 0.5 124 63.546 4.28643e-05 -3.28291 63.546000 Cu 0.173013 0.788538 5.6193e-17 126 63.546 7.93733e-05 -3.28293 63.546000 Cu 0.269234 0.793388 0.5 128 63.546 2.43943e-05 -3.28307 63.546000 Cu 0.615292 0.73539 0.5 97 63.546 4.04531e-05 -3.28313 63.546000 Cu 0.384667 0.774099 0.5 110 63.546 4.81003e-05 -3.28316 63.546000 Cu 0.403854 0.749923 5.6193e-17 111 63.546 1.53148e-05 -3.28301 63.546000 Cu 0.480783 0.778919 6.2171e-18 112 63.546 1.32214e-05 -3.28301 63.546000 Cu 0.499973 0.754741 0.5 113 63.546 6.25122e-07 -3.28294 63.546000 Cu 0.596086 0.759559 3.8259e-18 114 63.546 1.94995e-05 -3.283 63.546000 Cu 0.576879 0.783722 0.5 117 63.546 4.28643e-05 -3.28291 63.546000 Cu 0.365505 0.798255 1.26733e-17 130 63.546 0.000135676 -3.28313 63.546000 Cu 0.711471 0.740236 3.8259e-18 95 63.546 1.9599e-05 -3.2832 63.546000 Cu 0.903854 0.749923 5.6193e-17 99 63.546 1.53148e-05 -3.28301 63.546000 Cu 0.807684 0.74509 0.5 101 63.546 1.70082e-05 -3.28312 63.546000 Cu 0.999973 0.754741 0.5 105 63.546 6.25122e-07 -3.28294 63.546000 Cu 0.673013 0.788538 9.08652e-18 115 63.546 7.93733e-05 -3.28293 63.546000 Cu 0.692272 0.764396 0.5 116 63.546 1.34242e-05 -3.28313 63.546000 Cu 0.788482 0.769251 5.6193e-17 118 63.546 2.26148e-05 -3.28321 63.546000 Cu 0.865505 0.798255 1.67383e-17 119 63.546 0.000135676 -3.28313 63.546000 Cu 0.884667 0.774099 0.5 120 63.546 4.81003e-05 -3.28316 63.546000 Cu 0.769234 0.793388 0.5 121 63.546 2.43943e-05 -3.28307 63.546000 Cu 0.980783 0.778919 5.6193e-17 122 63.546 1.32214e-05 -3.28301 63.546000 Cu 0.0577581 0.807909 3.58679e-18 123 63.546 2.136e-05 -3.28291 63.546000 Cu 0.24996 0.81749 1.93686e-17 127 63.546 0.000214462 -3.28283 63.546000 Cu 0.153785 0.812689 0.5 129 63.546 0.000172288 -3.28279 63.546000 Cu 0.0195701 0.856283 5.6193e-17 143 63.546 0.00125169 -3.28379 63.546000 Cu 0.0386708 0.832105 0.5 144 63.546 0.000328868 -3.28315 63.546000 Cu 0.134698 0.836876 5.6193e-17 146 63.546 8.69591e-05 -3.28281 63.546000 Cu 0.211485 0.865839 5.6193e-17 147 63.546 0.000688353 -3.28224 63.546000 Cu 0.230693 0.841612 0.5 148 63.546 0.000726805 -3.28255 63.546000 Cu 0.115748 0.861126 0.5 149 63.546 0.00094168 -3.28318 63.546000 Cu 0.326803 0.846424 2.1999e-17 150 63.546 0.00057128 -3.28277 63.546000 Cu 0.346236 0.822353 0.5 131 63.546 4.62424e-05 -3.28299 63.546000 Cu 0.442513 0.827248 5.6193e-17 132 63.546 0.000311656 -3.28322 63.546000 Cu 0.461683 0.8031 0.5 133 63.546 0.000147153 -3.28308 63.546000 Cu 0.557758 0.807909 5.6193e-17 134 63.546 2.136e-05 -3.28291 63.546000 Cu 0.634698 0.836876 5.6193e-17 135 63.546 8.69591e-05 -3.28281 63.546000 Cu 0.653785 0.812689 0.5 136 63.546 0.000172288 -3.28279 63.546000 Cu 0.538671 0.832105 0.5 137 63.546 0.000328868 -3.28315 63.546000 Cu 0.42317 0.851342 0.5 153 63.546 0.000229993 -3.28339 63.546000 Cu 0.51957 0.856283 7.41269e-18 154 63.546 0.00125169 -3.28379 63.546000 Cu 0.615748 0.861126 0.5 156 63.546 0.00094168 -3.28318 63.546000 Cu 0.961683 0.8031 0.5 125 63.546 0.000147153 -3.28308 63.546000 Cu 0.74996 0.81749 5.6193e-17 138 63.546 0.000214462 -3.28283 63.546000 Cu 0.826803 0.846424 5.6193e-17 139 63.546 0.00057128 -3.28277 63.546000 Cu 0.846236 0.822353 0.5 140 63.546 4.62424e-05 -3.28299 63.546000 Cu 0.730693 0.841612 0.5 141 63.546 0.000726805 -3.28255 63.546000 Cu 0.942513 0.827248 5.0215e-18 142 63.546 0.000311656 -3.28322 63.546000 Cu 0.92317 0.851342 0.5 145 63.546 0.000229993 -3.28339 63.546000 Cu 0.711485 0.865839 1.69775e-17 158 63.546 0.000688353 -3.28224 63.546000 Cu 0.307231 0.870529 0.5 151 63.546 0.00287033 -3.28221 63.546000 Cu 0.0968728 0.885383 1.17168e-17 166 63.546 0.006092 -3.2835 63.546000 Cu 0.173873 0.914675 5.6193e-17 167 63.546 0.021139 -3.28407 63.546000 Cu 0.192623 0.890228 0.5 168 63.546 0.00256938 -3.28228 63.546000 Cu 0.07738 0.909434 0.5 169 63.546 0.00642184 -3.28252 63.546000 Cu 0.287907 0.894788 5.6193e-17 170 63.546 0.0043118 -3.2816 63.546000 Cu 0.269529 0.919361 0.5 173 63.546 0.00855835 -3.2818 63.546000 Cu 0.0562039 0.933256 8.13005e-18 186 63.546 0.00936499 -3.27958 63.546000 Cu 0.000273154 0.880348 0.5 164 63.546 0.00161524 -3.28341 63.546000 Cu 0.403511 0.875361 4.39979e-17 152 63.546 0.00133409 -3.28273 63.546000 Cu 0.596873 0.885383 5.6193e-17 155 63.546 0.006092 -3.2835 63.546000 Cu 0.500273 0.880348 0.5 157 63.546 0.00161524 -3.28341 63.546000 Cu 0.364817 0.923503 1 171 63.546 0.0255794 -3.28173 63.546000 Cu 0.383744 0.89932 0.5 172 63.546 0.0109147 -3.28159 63.546000 Cu 0.480486 0.904172 1 174 63.546 0.0048564 -3.28135 63.546000 Cu 0.556204 0.933256 1 175 63.546 0.00936499 -3.27958 63.546000 Cu 0.57738 0.909434 0.5 176 63.546 0.00642184 -3.28252 63.546000 Cu 0.460146 0.928027 0.5 177 63.546 0.0411385 -3.28159 63.546000 Cu 0.787907 0.894788 2.65422e-17 159 63.546 0.0043118 -3.2816 63.546000 Cu 0.807231 0.870529 0.5 160 63.546 0.00287033 -3.28221 63.546000 Cu 0.692623 0.890228 0.5 161 63.546 0.00256938 -3.28228 63.546000 Cu 0.903511 0.875361 5.6193e-17 162 63.546 0.00133409 -3.28273 63.546000 Cu 0.980486 0.904172 5.6193e-17 163 63.546 0.0048564 -3.28135 63.546000 Cu 0.883744 0.89932 0.5 165 63.546 0.0109147 -3.28159 63.546000 Cu 0.673873 0.914675 2.63031e-18 178 63.546 0.021139 -3.28407 63.546000 Cu 0.769529 0.919361 0.5 180 63.546 0.00855835 -3.2818 63.546000 Cu 0.864817 0.923503 6.69533e-18 182 63.546 0.0255794 -3.28173 63.546000 Cu 0.960146 0.928027 0.5 184 63.546 0.0411385 -3.28159 63.546000 Cu 0.133294 0.962039 5.6193e-17 187 63.546 0.0597268 -3.28274 63.546000 Cu 0.154141 0.938749 0.5 188 63.546 0.0377454 -3.28496 63.546000 Cu 0.0334677 0.957011 0.5 189 63.546 0.143564 -3.27726 63.546000 Cu 0.252667 0.944059 1 190 63.546 0.0995307 -3.28216 63.546000 Cu 0.331312 0.974593 1 191 63.546 0.693936 -3.16967 63.546000 Cu 0.236515 0.967461 0.5 193 63.546 0.634354 -3.2084 63.546000 Cu 0.0121111 0.980563 1 206 63.546 0.645565 -3.26241 63.546000 Cu 0.11637 0.984434 0.5 207 63.546 3.51838 -3.17019 63.546000 Cu 0.216769 0.989237 5.64321e-17 208 63.546 9.28918 -2.98812 63.546000 Cu 0.654141 0.938749 0.5 181 63.546 0.0377454 -3.28496 63.546000 Cu 0.347703 0.948393 0.5 192 63.546 0.0764068 -3.27689 63.546000 Cu 0.438851 0.952605 7.17357e-19 194 63.546 0.11572 -3.26554 63.546000 Cu 0.512111 0.980563 5.6193e-17 195 63.546 0.645565 -3.26241 63.546000 Cu 0.533468 0.957011 0.5 196 63.546 0.143564 -3.27726 63.546000 Cu 0.41707 0.978772 0.5 197 63.546 0.535241 -3.2166 63.546000 Cu 0.633294 0.962039 9.56476e-19 198 63.546 0.0597268 -3.28274 63.546000 Cu 0.61637 0.984434 0.5 201 63.546 3.51838 -3.17019 63.546000 Cu 0.752667 0.944059 5.6193e-17 179 63.546 0.0995307 -3.28216 63.546000 Cu 0.938851 0.952605 5.6193e-17 183 63.546 0.11572 -3.26554 63.546000 Cu 0.847703 0.948393 0.5 185 63.546 0.0764068 -3.27689 63.546000 Cu 0.716769 0.989237 5.6193e-17 199 63.546 9.28918 -2.98812 63.546000 Cu 0.736515 0.967461 0.5 200 63.546 0.634354 -3.2084 63.546000 Cu 0.831312 0.974593 8.36917e-18 202 63.546 0.693936 -3.16967 63.546000 Cu 0.91707 0.978772 0.5 204 63.546 0.535241 -3.2166