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 1.91295e-17 216 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 4.66282e-17 226 63.546 0.644766 -3.26267 63.546000 Cu 0.133301 0.0476885 3.94546e-17 227 63.546 0.0589013 -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 2.74987e-17 230 63.546 9.29057 -2.98824 63.546000 Cu 0.331217 0.0352635 0 231 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 3.46723e-17 251 63.546 0.093421 -3.28204 63.546000 Cu 0.599256 0.00491122 1 211 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 6.86272e-17 218 63.546 0.0589013 -3.28285 63.546000 Cu 0.406645 0.00492556 4.30414e-17 234 63.546 1.317 -3.24825 63.546000 Cu 0.512106 0.0292639 0 235 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 0.0737656 -3.27731 63.546000 Cu 0.438615 0.0571882 1 255 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 3.94546e-17 212 63.546 9.29057 -2.98824 63.546000 Cu 0.906645 0.00492556 1.01386e-16 214 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 1.03299e-16 222 63.546 0.688815 -3.16789 63.546000 Cu 0.938615 0.0571882 5.52365e-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 0.0737656 -3.27731 63.546000 Cu 0.752346 0.0657501 3.94546e-17 219 63.546 0.093421 -3.28204 63.546000 Cu 0.0559954 0.076466 8.58437e-17 247 63.546 0.00832318 -3.27964 63.546000 Cu 0.173438 0.0951058 2.70205e-17 248 63.546 0.018449 -3.28403 63.546000 Cu 0.153941 0.0710129 0.5 249 63.546 0.0386064 -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 1.43471e-17 269 63.546 0.00494835 -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 1 273 63.546 0.00459717 -3.28173 63.546000 Cu 0.653941 0.0710129 0.5 221 63.546 0.0386064 -3.28534 63.546000 Cu 0.5965 0.124374 0 238 63.546 0.00494835 -3.2836 63.546000 Cu 0.364512 0.0862916 3.94546e-17 252 63.546 0.0275634 -3.28168 63.546000 Cu 0.555995 0.076466 0 256 63.546 0.00832318 -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 0.00935739 -3.28165 63.546000 Cu 0.48021 0.105545 3.94546e-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 3.94546e-17 239 63.546 0.018449 -3.28403 63.546000 Cu 0.787526 0.114968 1 240 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 4.16067e-17 243 63.546 0.0275634 -3.28168 63.546000 Cu 0.98021 0.105545 7.19748e-17 244 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 0.00935739 -3.28165 63.546000 Cu 0.0193609 0.153415 3.94546e-17 266 63.546 0.00136085 -3.28374 63.546000 Cu 0.211247 0.143899 1 270 63.546 0.000799626 -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 0.000283907 -3.28327 63.546000 Cu 0.134594 0.172817 8.60829e-18 290 63.546 9.93235e-05 -3.28286 63.546000 Cu 0.249978 0.192167 3.94546e-17 291 63.546 0.00019681 -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 0.000167334 -3.28283 63.546000 Cu 0.326724 0.163262 3.94546e-17 294 63.546 0.000449632 -3.28273 63.546000 Cu 0.634594 0.172817 3.94546e-17 259 63.546 9.93235e-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 3.94546e-17 274 63.546 0.0012114 -3.2828 63.546000 Cu 0.653839 0.196969 0.5 281 63.546 0.000167334 -3.28283 63.546000 Cu 0.442535 0.182417 1.24342e-17 295 63.546 0.000383837 -3.28338 63.546000 Cu 0.423008 0.158339 0.5 296 63.546 0.000294187 -3.28336 63.546000 Cu 0.34627 0.187301 0.5 297 63.546 8.24976e-05 -3.28319 63.546000 Cu 0.519361 0.153415 1.88904e-17 298 63.546 0.00136085 -3.28374 63.546000 Cu 0.538631 0.177576 0.5 299 63.546 0.000283907 -3.28327 63.546000 Cu 0.711247 0.143899 3.94546e-17 261 63.546 0.000799626 -3.28234 63.546000 Cu 0.826724 0.163262 3.94546e-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 3.94546e-17 265 63.546 0.0012114 -3.2828 63.546000 Cu 0.923008 0.158339 0.5 268 63.546 0.000294187 -3.28336 63.546000 Cu 0.749978 0.192167 2.63031e-18 282 63.546 0.00019681 -3.28295 63.546000 Cu 0.84627 0.187301 0.5 284 63.546 8.24976e-05 -3.28319 63.546000 Cu 0.942535 0.182417 3.94546e-17 286 63.546 0.000383837 -3.28338 63.546000 Cu 0.0578234 0.201742 2.0086e-17 287 63.546 2.74618e-05 -3.28294 63.546000 Cu 0.0961578 0.249978 3.94546e-17 309 63.546 2.04419e-05 -3.28296 63.546000 Cu 0.0769925 0.225875 0.5 310 63.546 3.68193e-05 -3.2829 63.546000 Cu 3.47499e-05 0.254779 0.5 311 63.546 1.05737e-07 -3.2829 63.546000 Cu 0.173124 0.221076 3.94546e-17 312 63.546 9.46942e-05 -3.28296 63.546000 Cu 0.288563 0.240314 3.94546e-17 313 63.546 1.06572e-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 1.92087e-05 -3.2831 63.546000 Cu 0.596158 0.249978 3.94546e-17 300 63.546 2.04419e-05 -3.28296 63.546000 Cu 0.365593 0.211374 6.45621e-18 316 63.546 0.000111393 -3.28326 63.546000 Cu 0.480893 0.230666 2.39119e-17 317 63.546 1.15622e-05 -3.28299 63.546000 Cu 0.461775 0.206537 0.5 318 63.546 0.000138658 -3.28314 63.546000 Cu 0.384766 0.235475 0.5 319 63.546 4.59274e-05 -3.28313 63.546000 Cu 0.557823 0.201742 1.02343e-16 320 63.546 2.74618e-05 -3.28294 63.546000 Cu 0.576992 0.225875 0.5 321 63.546 3.68193e-05 -3.2829 63.546000 Cu 0.403916 0.259579 0 338 63.546 2.62774e-05 -3.28296 63.546000 Cu 0.500035 0.254779 0.5 340 63.546 1.05737e-07 -3.2829 63.546000 Cu 0.673124 0.221076 8.29743e-17 280 63.546 9.46942e-05 -3.28296 63.546000 Cu 0.865593 0.211374 3.94546e-17 283 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 0.000138658 -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 3.94546e-17 304 63.546 1.06572e-05 -3.28318 63.546000 Cu 0.903916 0.259579 3.94546e-17 305 63.546 2.62774e-05 -3.28296 63.546000 Cu 0.884766 0.235475 0.5 306 63.546 4.59274e-05 -3.28313 63.546000 Cu 0.807724 0.2644 0.5 307 63.546 1.92087e-05 -3.2831 63.546000 Cu 0.980893 0.230666 2.72596e-17 308 63.546 1.15622e-05 -3.28299 63.546000 Cu 0.0191705 0.278892 3.94546e-17 330 63.546 1.27804e-05 -3.28302 63.546000 Cu 0.134467 0.298188 2.17598e-17 331 63.546 0.000128859 -3.28323 63.546000 Cu 0.115296 0.274084 0.5 332 63.546 4.89846e-05 -3.28316 63.546000 Cu 0.038299 0.303025 0.5 333 63.546 0.000137013 -3.28316 63.546000 Cu 0.211501 0.269245 3.94546e-17 334 63.546 1.29518e-05 -3.2832 63.546000 Cu 0.326942 0.288483 4.06502e-18 335 63.546 9.51706e-05 -3.28296 63.546000 Cu 0.230729 0.293325 0.5 337 63.546 2.10184e-05 -3.28315 63.546000 Cu 0.0575209 0.327139 3.94546e-17 351 63.546 0.000353676 -3.28335 63.546000 Cu 0.153784 0.322253 0.5 353 63.546 7.23727e-05 -3.28315 63.546000 Cu 0.250062 0.317389 3.94546e-17 355 63.546 0.000207381 -3.28295 63.546000 Cu 0.615296 0.274084 0.5 303 63.546 4.89846e-05 -3.28316 63.546000 Cu 0.634467 0.298188 5.0215e-18 322 63.546 0.000128859 -3.28323 63.546000 Cu 0.653784 0.322253 0.5 325 63.546 7.23727e-05 -3.28315 63.546000 Cu 0.51917 0.278892 0 339 63.546 1.27804e-05 -3.28302 63.546000 Cu 0.423073 0.283682 0.5 341 63.546 4.49967e-05 -3.28292 63.546000 Cu 0.346217 0.312587 0.5 357 63.546 0.000187118 -3.28285 63.546000 Cu 0.442231 0.307819 3.68243e-17 359 63.546 2.62631e-05 -3.28296 63.546000 Cu 0.557521 0.327139 3.77808e-17 360 63.546 0.000353676 -3.28335 63.546000 Cu 0.538299 0.303025 0.5 361 63.546 0.000137013 -3.28316 63.546000 Cu 0.461405 0.331981 0.5 362 63.546 0.000303702 -3.28323 63.546000 Cu 0.711501 0.269245 3.94546e-17 301 63.546 1.29518e-05 -3.2832 63.546000 Cu 0.750062 0.317389 3.94546e-17 323 63.546 0.000207381 -3.28295 63.546000 Cu 0.730729 0.293325 0.5 324 63.546 2.10184e-05 -3.28315 63.546000 Cu 0.826942 0.288483 3.94546e-17 326 63.546 9.51706e-05 -3.28296 63.546000 Cu 0.942231 0.307819 3.94546e-17 327 63.546 2.62631e-05 -3.28296 63.546000 Cu 0.923073 0.283682 0.5 328 63.546 4.49967e-05 -3.28292 63.546000 Cu 0.846217 0.312587 0.5 329 63.546 0.000187118 -3.28285 63.546000 Cu 0.961405 0.331981 0.5 349 63.546 0.000303702 -3.28323 63.546000 Cu 0.173324 0.346293 3.94546e-17 352 63.546 0.000444578 -3.28282 63.546000 Cu 0.0769959 0.351212 0.5 354 63.546 0.000286837 -3.28341 63.546000 Cu 0.269459 0.341474 0.5 358 63.546 0.00073015 -3.28262 63.546000 Cu 4.69684e-05 0.380166 0.5 371 63.546 0.00134681 -3.28353 63.546000 Cu 0.0967812 0.375192 1.88904e-17 373 63.546 0.00111364 -3.28281 63.546000 Cu 0.212471 0.394568 6.4323e-17 374 63.546 0.00480786 -3.28168 63.546000 Cu 0.193042 0.370352 0.5 375 63.546 0.00281438 -3.28221 63.546000 Cu 0.116546 0.399128 0.5 376 63.546 0.00959613 -3.28157 63.546000 Cu 0.288795 0.365652 1 377 63.546 0.00080036 -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 1 342 63.546 0.00111364 -3.28281 63.546000 Cu 0.365442 0.336739 9.08652e-18 356 63.546 8.87397e-05 -3.28285 63.546000 Cu 0.616546 0.399128 0.5 364 63.546 0.00959613 -3.28157 63.546000 Cu 0.403509 0.385176 3.94546e-17 378 63.546 0.00501358 -3.28359 63.546000 Cu 0.384539 0.360956 0.5 379 63.546 0.000791255 -3.28316 63.546000 Cu 0.480664 0.356133 3.94546e-17 381 63.546 0.00123707 -3.28378 63.546000 Cu 0.576996 0.351212 0.5 382 63.546 0.000286837 -3.28341 63.546000 Cu 0.500047 0.380166 0.5 383 63.546 0.00134681 -3.28353 63.546000 Cu 0.673324 0.346293 1 343 63.546 0.000444578 -3.28282 63.546000 Cu 0.788795 0.365652 1 344 63.546 0.00080036 -3.28227 63.546000 Cu 0.769459 0.341474 0.5 345 63.546 0.00073015 -3.28262 63.546000 Cu 0.693042 0.370352 0.5 346 63.546 0.00281438 -3.28221 63.546000 Cu 0.865442 0.336739 3.94546e-17 347 63.546 8.87397e-05 -3.28285 63.546000 Cu 0.980664 0.356133 3.94546e-17 348 63.546 0.00123707 -3.28378 63.546000 Cu 0.884539 0.360956 0.5 350 63.546 0.000791255 -3.28316 63.546000 Cu 0.712471 0.394568 1 365 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 1 369 63.546 0.00501358 -3.28359 63.546000 Cu 0.0197715 0.403998 1 370 63.546 0.00381635 -3.28142 63.546000 Cu 0.061345 0.452341 0 391 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 8.17787e-17 394 63.546 0.0280676 -3.28172 63.546000 Cu 0.247608 0.443785 1.43471e-17 395 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 3.94546e-17 398 63.546 0.0189086 -3.2841 63.546000 Cu 0.561345 0.452341 3.94546e-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 3.94546e-17 205 63.546 0.058616 -3.28274 63.546000 Cu 0.635479 0.42324 3.94546e-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 3.39549e-17 399 63.546 0.00825634 -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 0.0393517 -3.2853 63.546000 Cu 0.519772 0.403998 2.34337e-17 402 63.546 0.00381635 -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 1 366 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 0.0393517 -3.2853 63.546000 Cu 0.94397 0.433072 1 390 63.546 0.00825634 -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 2.15207e-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 0 409 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 5.26062e-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 1.0043e-17 7 63.546 6.73031 -3.00162 63.546000 Cu 0.487887 0.528952 1 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 2.15207e-18 203 63.546 0.644516 -3.26267 63.546000 Cu 0.593345 0.504592 3.94546e-17 404 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 2.39119e-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 8.13005e-18 406 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 6.64751e-17 19 63.546 0.114513 -3.26554 63.546000 Cu 0.168696 0.534936 3.94546e-17 22 63.546 0.693189 -3.1693 63.546000 Cu 0.247361 0.565459 1 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 0.0759427 -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 3.87373e-17 42 63.546 0.025175 -3.28168 63.546000 Cu 0.230463 0.590145 0.5 44 63.546 0.0083972 -3.28185 63.546000 Cu 0.326142 0.594835 8.60829e-18 46 63.546 0.020623 -3.28405 63.546000 Cu 0.366691 0.547463 1 26 63.546 0.0599332 -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 0 28 63.546 0.00937989 -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 1.24342e-16 31 63.546 0.025175 -3.28168 63.546000 Cu 0.652309 0.561116 0.5 32 63.546 0.0759427 -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 9.56476e-18 11 63.546 0.693189 -3.1693 63.546000 Cu 0.866691 0.547463 1 15 63.546 0.0599332 -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 7.41269e-18 35 63.546 0.020623 -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 0.0083972 -3.28185 63.546000 Cu 0.943815 0.57625 1 38 63.546 0.00937989 -3.2796 63.546000 Cu 0.0195029 0.605325 3.94546e-17 39 63.546 0.00470679 -3.2814 63.546000 Cu 0.212095 0.614708 3.94546e-17 43 63.546 0.00413894 -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 0.00267708 -3.28231 63.546000 Cu 0.0964995 0.634144 1.05212e-17 62 63.546 0.00140548 -3.28275 63.546000 Cu 0.173175 0.663069 3.94546e-17 63 63.546 0.000529009 -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 0.000241901 -3.28336 63.546000 Cu 0.288502 0.64366 4.06502e-18 66 63.546 0.000699848 -3.28228 63.546000 Cu 0.403129 0.624123 1.09995e-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 3.94546e-17 50 63.546 0.00470679 -3.2814 63.546000 Cu 0.596499 0.634144 3.94546e-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 0.00092001 -3.28317 63.546000 Cu 0.480423 0.653208 2.89334e-17 70 63.546 0.00137717 -3.28378 63.546000 Cu 0.576855 0.65815 0.5 72 63.546 0.000241901 -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 5.0215e-18 54 63.546 0.00413894 -3.28166 63.546000 Cu 0.788502 0.64366 1.67383e-18 55 63.546 0.000699848 -3.28228 63.546000 Cu 0.807378 0.619269 0.5 56 63.546 0.00267708 -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 0 58 63.546 0.00583663 -3.2835 63.546000 Cu 0.980423 0.653208 1.98469e-17 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 0.00092001 -3.28317 63.546000 Cu 0.673175 0.663069 3.94546e-17 74 63.546 0.000529009 -3.2827 63.546000 Cu 0.269302 0.667884 0.5 69 63.546 0.000768357 -3.28254 63.546000 Cu 0.0574524 0.682246 3.94546e-17 82 63.546 0.000324032 -3.28326 63.546000 Cu 0.134465 0.711238 5.0215e-18 83 63.546 0.000106433 -3.28316 63.546000 Cu 0.153729 0.687136 0.5 84 63.546 5.67623e-05 -3.28305 63.546000 Cu 0.0382733 0.706393 0.5 85 63.546 0.000134752 -3.28307 63.546000 Cu 0.250022 0.691998 3.82591e-18 86 63.546 0.000200453 -3.28284 63.546000 Cu 0.326937 0.720949 1.57819e-17 87 63.546 6.70493e-05 -3.28294 63.546000 Cu 0.230714 0.716101 0.5 89 63.546 2.20963e-05 -3.28308 63.546000 Cu 0.019176 0.730568 3.94546e-17 102 63.546 1.66134e-05 -3.28299 63.546000 Cu 0.365288 0.672618 5.26062e-18 67 63.546 9.40322e-05 -3.28281 63.546000 Cu 0.557452 0.682246 2.84552e-17 71 63.546 0.000324032 -3.28326 63.546000 Cu 0.461312 0.677389 0.5 73 63.546 0.000313182 -3.28321 63.546000 Cu 0.653729 0.687136 0.5 77 63.546 5.67623e-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 2.10425e-17 90 63.546 1.7119e-05 -3.28289 63.546000 Cu 0.519176 0.730568 1.43471e-18 91 63.546 1.66134e-05 -3.28299 63.546000 Cu 0.538273 0.706393 0.5 92 63.546 0.000134752 -3.28307 63.546000 Cu 0.423074 0.725763 0.5 93 63.546 3.39764e-05 -3.28289 63.546000 Cu 0.634465 0.711238 3.94546e-17 94 63.546 0.000106433 -3.28316 63.546000 Cu 0.750022 0.691998 3.94546e-17 75 63.546 0.000200453 -3.28284 63.546000 Cu 0.769302 0.667884 0.5 76 63.546 0.000768357 -3.28254 63.546000 Cu 0.865288 0.672618 2.39119e-19 78 63.546 9.40322e-05 -3.28281 63.546000 Cu 0.942214 0.701584 3.94546e-17 79 63.546 1.7119e-05 -3.28289 63.546000 Cu 0.961312 0.677389 0.5 80 63.546 0.000313182 -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 2.20963e-05 -3.28308 63.546000 Cu 0.826937 0.720949 1.24342e-17 98 63.546 6.70493e-05 -3.28294 63.546000 Cu 0.923074 0.725763 0.5 100 63.546 3.39764e-05 -3.28289 63.546000 Cu 0.0960856 0.759559 3.94546e-17 103 63.546 1.94993e-05 -3.283 63.546000 Cu 0.115292 0.73539 0.5 104 63.546 4.04527e-05 -3.28313 63.546000 Cu 0.211471 0.740236 3.94546e-17 106 63.546 1.95992e-05 -3.2832 63.546000 Cu 0.288482 0.769251 2.48684e-17 107 63.546 2.26153e-05 -3.28321 63.546000 Cu 0.307684 0.74509 0.5 108 63.546 1.70085e-05 -3.28312 63.546000 Cu 0.192272 0.764396 0.5 109 63.546 1.34241e-05 -3.28313 63.546000 Cu 0.0768792 0.783722 0.5 124 63.546 4.28633e-05 -3.28291 63.546000 Cu 0.173013 0.788538 3.94546e-17 126 63.546 7.93753e-05 -3.28293 63.546000 Cu 0.269234 0.793388 0.5 128 63.546 2.43942e-05 -3.28307 63.546000 Cu 0.615292 0.73539 0.5 97 63.546 4.04527e-05 -3.28313 63.546000 Cu 0.384667 0.774099 0.5 110 63.546 4.81e-05 -3.28316 63.546000 Cu 0.403854 0.749923 1.1956e-17 111 63.546 1.53147e-05 -3.28301 63.546000 Cu 0.480783 0.778919 3.34767e-18 112 63.546 1.32216e-05 -3.28301 63.546000 Cu 0.499973 0.754741 0.5 113 63.546 6.25147e-07 -3.28294 63.546000 Cu 0.596086 0.759559 2.15207e-18 114 63.546 1.94993e-05 -3.283 63.546000 Cu 0.576879 0.783722 0.5 117 63.546 4.28633e-05 -3.28291 63.546000 Cu 0.365505 0.798255 1.98469e-17 130 63.546 0.000135677 -3.28313 63.546000 Cu 0.711471 0.740236 1.72166e-17 95 63.546 1.95992e-05 -3.2832 63.546000 Cu 0.903854 0.749923 3.94546e-17 99 63.546 1.53147e-05 -3.28301 63.546000 Cu 0.807684 0.74509 0.5 101 63.546 1.70085e-05 -3.28312 63.546000 Cu 0.999973 0.754741 0.5 105 63.546 6.25147e-07 -3.28294 63.546000 Cu 0.673013 0.788538 3.94546e-17 115 63.546 7.93753e-05 -3.28293 63.546000 Cu 0.692272 0.764396 0.5 116 63.546 1.34241e-05 -3.28313 63.546000 Cu 0.788482 0.769251 3.10855e-18 118 63.546 2.26153e-05 -3.28321 63.546000 Cu 0.865505 0.798255 3.94546e-17 119 63.546 0.000135677 -3.28313 63.546000 Cu 0.884667 0.774099 0.5 120 63.546 4.81e-05 -3.28316 63.546000 Cu 0.769234 0.793388 0.5 121 63.546 2.43942e-05 -3.28307 63.546000 Cu 0.980783 0.778919 3.94546e-17 122 63.546 1.32216e-05 -3.28301 63.546000 Cu 0.0577581 0.807909 7.17357e-19 123 63.546 2.13602e-05 -3.28291 63.546000 Cu 0.24996 0.81749 3.94546e-17 127 63.546 0.000214463 -3.28283 63.546000 Cu 0.153785 0.812689 0.5 129 63.546 0.000172293 -3.28279 63.546000 Cu 0.0195701 0.856283 1.02821e-17 143 63.546 0.00125168 -3.28379 63.546000 Cu 0.0386708 0.832105 0.5 144 63.546 0.000328877 -3.28315 63.546000 Cu 0.134698 0.836876 3.08464e-17 146 63.546 8.6956e-05 -3.28281 63.546000 Cu 0.211485 0.865839 3.94546e-17 147 63.546 0.00068835 -3.28224 63.546000 Cu 0.230693 0.841612 0.5 148 63.546 0.000726797 -3.28255 63.546000 Cu 0.115748 0.861126 0.5 149 63.546 0.000941676 -3.28318 63.546000 Cu 0.326803 0.846424 1.55427e-17 150 63.546 0.000571282 -3.28277 63.546000 Cu 0.346236 0.822353 0.5 131 63.546 4.62421e-05 -3.28299 63.546000 Cu 0.442513 0.827248 1.07604e-17 132 63.546 0.000311652 -3.28322 63.546000 Cu 0.461683 0.8031 0.5 133 63.546 0.000147158 -3.28308 63.546000 Cu 0.557758 0.807909 3.94546e-17 134 63.546 2.13602e-05 -3.28291 63.546000 Cu 0.634698 0.836876 3.94546e-17 135 63.546 8.6956e-05 -3.28281 63.546000 Cu 0.653785 0.812689 0.5 136 63.546 0.000172293 -3.28279 63.546000 Cu 0.538671 0.832105 0.5 137 63.546 0.000328877 -3.28315 63.546000 Cu 0.42317 0.851342 0.5 153 63.546 0.000229991 -3.28339 63.546000 Cu 0.51957 0.856283 3.70635e-17 154 63.546 0.00125168 -3.28379 63.546000 Cu 0.615748 0.861126 0.5 156 63.546 0.000941676 -3.28318 63.546000 Cu 0.961683 0.8031 0.5 125 63.546 0.000147158 -3.28308 63.546000 Cu 0.74996 0.81749 2.53466e-17 138 63.546 0.000214463 -3.28283 63.546000 Cu 0.826803 0.846424 3.94546e-17 139 63.546 0.000571282 -3.28277 63.546000 Cu 0.846236 0.822353 0.5 140 63.546 4.62421e-05 -3.28299 63.546000 Cu 0.730693 0.841612 0.5 141 63.546 0.000726797 -3.28255 63.546000 Cu 0.942513 0.827248 1.8173e-17 142 63.546 0.000311652 -3.28322 63.546000 Cu 0.92317 0.851342 0.5 145 63.546 0.000229991 -3.28339 63.546000 Cu 0.711485 0.865839 7.89093e-18 158 63.546 0.00068835 -3.28224 63.546000 Cu 0.307231 0.870529 0.5 151 63.546 0.00287034 -3.28221 63.546000 Cu 0.0968728 0.885383 2.0086e-17 166 63.546 0.00609199 -3.2835 63.546000 Cu 0.173873 0.914675 3.94546e-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 0.00642183 -3.28252 63.546000 Cu 0.287907 0.894788 3.94546e-17 170 63.546 0.00431179 -3.2816 63.546000 Cu 0.269529 0.919361 0.5 173 63.546 0.00855834 -3.2818 63.546000 Cu 0.0562039 0.933256 3.94546e-17 186 63.546 0.009365 -3.27958 63.546000 Cu 0.000273152 0.880348 0.5 164 63.546 0.00161524 -3.28341 63.546000 Cu 0.403511 0.875361 4.83021e-17 152 63.546 0.00133408 -3.28273 63.546000 Cu 0.596873 0.885383 3.94546e-17 155 63.546 0.00609199 -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 3.94546e-17 171 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 2.63031e-17 174 63.546 0.0048564 -3.28135 63.546000 Cu 0.556204 0.933256 9.70823e-17 175 63.546 0.009365 -3.27958 63.546000 Cu 0.57738 0.909434 0.5 176 63.546 0.00642183 -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 2.0086e-17 159 63.546 0.00431179 -3.2816 63.546000 Cu 0.807231 0.870529 0.5 160 63.546 0.00287034 -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 3.94546e-17 162 63.546 0.00133408 -3.28273 63.546000 Cu 0.980486 0.904172 9.08652e-18 163 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 6.00189e-17 178 63.546 0.021139 -3.28407 63.546000 Cu 0.769529 0.919361 0.5 180 63.546 0.00855834 -3.2818 63.546000 Cu 0.864817 0.923503 3.94546e-17 182 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 3.94546e-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 4.63891e-17 190 63.546 0.0995306 -3.28216 63.546000 Cu 0.331312 0.974593 1.57819e-17 191 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 6.88663e-17 206 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 3.37158e-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 0.0764069 -3.27689 63.546000 Cu 0.438851 0.952605 4.54326e-17 194 63.546 0.11572 -3.26554 63.546000 Cu 0.512111 0.980563 2.36728e-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 1.84122e-16 198 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 3.94546e-17 179 63.546 0.0995306 -3.28216 63.546000 Cu 0.938851 0.952605 3.94546e-17 183 63.546 0.11572 -3.26554 63.546000 Cu 0.847703 0.948393 0.5 185 63.546 0.0764069 -3.27689 63.546000 Cu 0.716769 0.989237 7.79528e-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 3.94546e-17 202 63.546 0.693936 -3.16967 63.546000 Cu 0.91707 0.978772 0.5 204 63.546 0.535241 -3.2166