Number of particles = 460 A = 1 Angstrom (basic length-scale) H0(1,1) = 19.5711 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 78.3956 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.63413 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 0.031364 0.0118315 1 235 63.546 1.91995 -3.16982 63.546000 Cu 0.122345 0.00627432 0.5 237 63.546 9.10794 -3.02699 63.546000 Cu 0.0991875 0.0563501 1 240 63.546 0.0256584 -3.28377 63.546000 Cu 0.064284 0.0344637 0.5 241 63.546 0.0923353 -3.27527 63.546000 Cu 0.152249 0.0264141 1 243 63.546 0.200741 -3.24558 63.546000 Cu 0.237481 0.0184468 0.5 245 63.546 0.681586 -3.19755 63.546000 Cu 0.185515 0.0477603 0.5 246 63.546 0.0379461 -3.28282 63.546000 Cu 0.275045 0.0388942 0 244 63.546 0.0780825 -3.26953 63.546000 Cu 0.327593 0.00820844 2.72085e-17 247 63.546 1.85453 -3.16181 63.546000 Cu 0.44692 0.0192782 0 248 63.546 0.508753 -3.20651 63.546000 Cu 0.362022 0.0279817 0.5 250 63.546 0.463437 -3.2403 63.546000 Cu 0.309291 0.0593446 0.5 262 63.546 0.0522388 -3.28018 63.546000 Cu 0.395809 0.0502751 1.21722e-17 264 63.546 0.0754373 -3.27617 63.546000 Cu 0.480017 0.042275 0.5 266 63.546 0.00822186 -3.28974 63.546000 Cu 0.62235 0.00626781 0 251 63.546 9.10715 -3.02701 63.546000 Cu 0.531364 0.0118287 0.5 252 63.546 1.92058 -3.16982 63.546000 Cu 0.564289 0.0344565 0 268 63.546 0.092276 -3.27529 63.546000 Cu 0.685534 0.0477499 0 269 63.546 0.0377155 -3.28278 63.546000 Cu 0.652261 0.026405 0.5 270 63.546 0.200496 -3.24559 63.546000 Cu 0.599202 0.0563398 0.5 271 63.546 0.0255983 -3.28375 63.546000 Cu 0.73749 0.0184389 6.57539e-17 272 63.546 0.681038 -3.19752 63.546000 Cu 0.946923 0.0192789 0.5 236 63.546 0.508304 -3.20652 63.546000 Cu 0.980016 0.0422781 1 239 63.546 0.00818193 -3.28971 63.546000 Cu 0.862034 0.0279768 1 273 63.546 0.46385 -3.24037 63.546000 Cu 0.827603 0.00820157 0.5 274 63.546 1.85358 -3.16196 63.546000 Cu 0.775062 0.0388863 0.5 275 63.546 0.0780894 -3.26955 63.546000 Cu 0.809309 0.0593372 0 296 63.546 0.0524942 -3.28022 63.546000 Cu 0.895819 0.0502737 0.5 297 63.546 0.0755249 -3.27616 63.546000 Cu 0.0137461 0.0645454 0.5 242 63.546 0.0131433 -3.28072 63.546000 Cu 0.0478774 0.0863293 1 256 63.546 0.00968823 -3.28136 63.546000 Cu 0.169129 0.0989788 1.31269e-18 257 63.546 0.00101044 -3.2821 63.546000 Cu 0.134188 0.0777487 0.5 258 63.546 0.00940685 -3.28096 63.546000 Cu 0.0823999 0.107793 0.5 259 63.546 0.00332345 -3.28212 63.546000 Cu 0.221246 0.0688169 0 260 63.546 0.00713202 -3.28039 63.546000 Cu 0.20368 0.12032 0.5 282 63.546 0.00206106 -3.28354 63.546000 Cu 0.342639 0.0809811 1 261 63.546 0.0236785 -3.28433 63.546000 Cu 0.256129 0.0899518 0.5 263 63.546 0.00886471 -3.28329 63.546000 Cu 0.428518 0.0726887 0.5 267 63.546 0.00422439 -3.28106 63.546000 Cu 0.290151 0.111499 0 284 63.546 0.00621971 -3.28379 63.546000 Cu 0.376143 0.102963 0.5 286 63.546 0.00195463 -3.28241 63.546000 Cu 0.461928 0.0946619 1.03941e-16 288 63.546 0.00404926 -3.28193 63.546000 Cu 0.496052 0.116348 0.5 291 63.546 0.00344429 -3.28219 63.546000 Cu 0.410026 0.124807 3.3772e-17 285 63.546 0.00109057 -3.28236 63.546000 Cu 0.513754 0.0645378 7.16014e-18 265 63.546 0.0132099 -3.28073 63.546000 Cu 0.582436 0.10777 7.70908e-17 289 63.546 0.00316872 -3.2821 63.546000 Cu 0.547896 0.0863124 0.5 290 63.546 0.00948853 -3.28134 63.546000 Cu 0.634214 0.0777318 6.57539e-17 292 63.546 0.00918011 -3.28092 63.546000 Cu 0.721273 0.0688034 0.5 294 63.546 0.00705882 -3.28036 63.546000 Cu 0.669167 0.0989586 0.5 295 63.546 0.0009768 -3.28211 63.546000 Cu 0.703728 0.1203 0 317 63.546 0.00219706 -3.28353 63.546000 Cu 0.928523 0.0726908 2.38671e-19 238 63.546 0.00415649 -3.28105 63.546000 Cu 0.996028 0.116368 1 253 63.546 0.00352382 -3.28219 63.546000 Cu 0.961924 0.094674 0.5 254 63.546 0.00408794 -3.28192 63.546000 Cu 0.756161 0.0899386 1 293 63.546 0.00909335 -3.28333 63.546000 Cu 0.842655 0.0809761 0.5 298 63.546 0.0238879 -3.28434 63.546000 Cu 0.790185 0.111491 0.5 319 63.546 0.006325 -3.28378 63.546000 Cu 0.876158 0.102967 0 321 63.546 0.00193423 -3.28239 63.546000 Cu 0.910024 0.124818 0.5 255 63.546 0.00104674 -3.28234 63.546000 Cu 0.0650376 0.159369 1 277 63.546 0.000137857 -3.28309 63.546000 Cu 0.0304966 0.137895 0.5 278 63.546 0.00126561 -3.28265 63.546000 Cu 0.117022 0.129165 1 280 63.546 0.000315719 -3.28289 63.546000 Cu 0.237914 0.141869 0 281 63.546 0.00162892 -3.28361 63.546000 Cu 0.151525 0.15061 0.5 283 63.546 0.000518085 -3.28343 63.546000 Cu 0.0995276 0.18087 0.5 303 63.546 9.1975e-05 -3.28328 63.546000 Cu 0.185876 0.172162 2.86406e-18 305 63.546 0.000497395 -3.28335 63.546000 Cu 0.324073 0.13326 0.5 287 63.546 0.000821388 -3.28305 63.546000 Cu 0.306327 0.18518 0 306 63.546 4.80657e-05 -3.28293 63.546000 Cu 0.272072 0.163526 0.5 307 63.546 0.000330076 -3.28314 63.546000 Cu 0.358169 0.154982 0 309 63.546 0.000214349 -3.28272 63.546000 Cu 0.478723 0.168013 0 310 63.546 0.000421839 -3.28284 63.546000 Cu 0.444261 0.146462 0.5 311 63.546 0.00113819 -3.2825 63.546000 Cu 0.392482 0.176618 0.5 312 63.546 0.000337686 -3.2828 63.546000 Cu 0.530544 0.137863 5.96678e-19 313 63.546 0.00111716 -3.28262 63.546000 Cu 0.651586 0.15058 5.96678e-19 314 63.546 0.000646826 -3.28342 63.546000 Cu 0.617074 0.129136 0.5 315 63.546 0.000289412 -3.28286 63.546000 Cu 0.565109 0.159329 0.5 316 63.546 0.000102099 -3.28309 63.546000 Cu 0.737961 0.141853 0.5 320 63.546 0.00178948 -3.28361 63.546000 Cu 0.59961 0.180833 1.30076e-17 338 63.546 0.000166269 -3.28327 63.546000 Cu 0.685932 0.172143 0.5 340 63.546 0.000590332 -3.28335 63.546000 Cu 0.944235 0.146489 1 276 63.546 0.00121896 -3.28253 63.546000 Cu 0.978664 0.168054 0.5 279 63.546 0.000539412 -3.28285 63.546000 Cu 0.824093 0.133259 1 318 63.546 0.00083294 -3.28302 63.546000 Cu 0.772104 0.163525 0 342 63.546 0.000343214 -3.28314 63.546000 Cu 0.892438 0.176654 9.42752e-18 343 63.546 0.000419214 -3.2828 63.546000 Cu 0.858166 0.154998 0.5 344 63.546 0.000206773 -3.28273 63.546000 Cu 0.806317 0.185202 0.5 345 63.546 3.79061e-05 -3.28292 63.546000 Cu 0.0131449 0.18958 0 301 63.546 9.02987e-05 -3.28309 63.546000 Cu 0.133941 0.202414 0 302 63.546 0.00017895 -3.28323 63.546000 Cu 0.0476064 0.211109 0.5 304 63.546 6.99e-06 -3.28318 63.546000 Cu 0.22017 0.193766 0.5 308 63.546 0.000180007 -3.2831 63.546000 Cu 0.0820788 0.232647 0 326 63.546 7.5441e-05 -3.28317 63.546000 Cu 0.202808 0.245584 2.24351e-17 327 63.546 5.14108e-05 -3.28293 63.546000 Cu 0.168354 0.22399 0.5 328 63.546 0.000131188 -3.28312 63.546000 Cu 0.254546 0.215382 2.99532e-17 330 63.546 1.86833e-05 -3.28297 63.546000 Cu 0.37515 0.228385 1.25302e-17 331 63.546 9.5146e-05 -3.28297 63.546000 Cu 0.340713 0.206798 0.5 332 63.546 8.5343e-05 -3.28292 63.546000 Cu 0.288972 0.236988 0.5 333 63.546 8.07277e-06 -3.28288 63.546000 Cu 0.426935 0.198191 1.96904e-17 334 63.546 0.000170423 -3.28295 63.546000 Cu 0.46141 0.219739 0.5 337 63.546 3.0633e-05 -3.28307 63.546000 Cu 0.495879 0.24129 0 359 63.546 8.82799e-06 -3.2832 63.546000 Cu 0.409609 0.249956 0.5 357 63.546 6.09994e-05 -3.28318 63.546000 Cu 0.5477 0.211064 1.55136e-18 335 63.546 4.17662e-05 -3.28318 63.546000 Cu 0.513236 0.189532 0.5 336 63.546 4.71301e-05 -3.28308 63.546000 Cu 0.720195 0.193768 0 339 63.546 0.000189611 -3.28309 63.546000 Cu 0.634004 0.202391 0.5 341 63.546 0.000265325 -3.28323 63.546000 Cu 0.582144 0.232626 0.5 361 63.546 0.000117401 -3.28319 63.546000 Cu 0.668362 0.223998 0 363 63.546 0.000131683 -3.28312 63.546000 Cu 0.70274 0.245626 0.5 366 63.546 2.26909e-05 -3.28292 63.546000 Cu 0.961296 0.219799 0 299 63.546 9.88582e-05 -3.28309 63.546000 Cu 0.926845 0.198243 0.5 300 63.546 0.000275074 -3.28298 63.546000 Cu 0.99577 0.241337 0.5 324 63.546 1.52669e-05 -3.28319 63.546000 Cu 0.788866 0.237051 0 364 63.546 5.2177e-05 -3.2829 63.546000 Cu 0.75451 0.215415 0.5 365 63.546 7.40432e-06 -3.28298 63.546000 Cu 0.84064 0.206846 0 367 63.546 0.000151595 -3.28295 63.546000 Cu 0.875024 0.228452 0.5 368 63.546 0.000226531 -3.283 63.546000 Cu 0.0303339 0.262875 2.04064e-17 323 63.546 5.35382e-05 -3.28308 63.546000 Cu 0.116602 0.254206 0.5 329 63.546 0.000134176 -3.28298 63.546000 Cu 0.0996408 0.305999 1 348 63.546 0.000412106 -3.28285 63.546000 Cu 0.0649662 0.284409 0.5 349 63.546 0.000353214 -3.28293 63.546000 Cu 0.15112 0.275786 0 351 63.546 0.000209834 -3.28291 63.546000 Cu 0.237252 0.26719 0.5 353 63.546 3.9426e-05 -3.283 63.546000 Cu 0.185665 0.297427 0.5 354 63.546 4.1236e-05 -3.28299 63.546000 Cu 0.271726 0.288837 0 352 63.546 0.000131266 -3.28319 63.546000 Cu 0.323394 0.25859 1.34849e-17 355 63.546 7.22597e-05 -3.28307 63.546000 Cu 0.444121 0.271527 1.79003e-17 356 63.546 3.07284e-05 -3.28319 63.546000 Cu 0.357877 0.280201 0.5 358 63.546 0.000189405 -3.28324 63.546000 Cu 0.306264 0.310472 0.5 378 63.546 0.000439178 -3.28342 63.546000 Cu 0.392472 0.301776 2.35091e-17 380 63.546 0.000126725 -3.2833 63.546000 Cu 0.478713 0.293076 0.5 382 63.546 0.000119582 -3.28309 63.546000 Cu 0.616599 0.254218 0 360 63.546 0.000136894 -3.28298 63.546000 Cu 0.530384 0.262854 0.5 362 63.546 6.54629e-05 -3.28309 63.546000 Cu 0.564929 0.284421 0 384 63.546 0.000321177 -3.28293 63.546000 Cu 0.685552 0.297493 0 385 63.546 5.06771e-05 -3.28295 63.546000 Cu 0.651052 0.27583 0.5 386 63.546 0.000145798 -3.28287 63.546000 Cu 0.599562 0.306038 0.5 387 63.546 0.000375062 -3.28285 63.546000 Cu 0.73714 0.267263 4.17675e-18 388 63.546 3.40784e-05 -3.28299 63.546000 Cu 0.909463 0.250026 0 322 63.546 0.000182725 -3.2832 63.546000 Cu 0.944024 0.271581 0.5 325 63.546 9.54693e-05 -3.28321 63.546000 Cu 0.978708 0.293094 1 347 63.546 9.5276e-05 -3.28306 63.546000 Cu 0.857757 0.280279 0 389 63.546 0.000407741 -3.28328 63.546000 Cu 0.823254 0.258671 0.5 390 63.546 0.000199977 -3.28311 63.546000 Cu 0.771598 0.288922 0.5 391 63.546 0.000357337 -3.2832 63.546000 Cu 0.806139 0.310546 1 412 63.546 0.000871901 -3.28339 63.546000 Cu 0.892404 0.301824 0.5 413 63.546 0.000183919 -3.28325 63.546000 Cu 0.0135015 0.314615 0.5 350 63.546 0.000580668 -3.28287 63.546000 Cu 0.0482807 0.336184 0 372 63.546 0.00121576 -3.28257 63.546000 Cu 0.16872 0.349406 0 373 63.546 0.000847512 -3.28304 63.546000 Cu 0.134235 0.327658 0.5 374 63.546 0.000195251 -3.28281 63.546000 Cu 0.0829695 0.357877 0.5 375 63.546 0.000873923 -3.28237 63.546000 Cu 0.220204 0.319107 1.06209e-17 376 63.546 0.000264573 -3.28322 63.546000 Cu 0.203115 0.371175 0.5 398 63.546 0.00562494 -3.28384 63.546000 Cu 0.340965 0.332059 7.63748e-18 377 63.546 0.000501715 -3.28346 63.546000 Cu 0.254731 0.340787 0.5 379 63.546 0.00146336 -3.28365 63.546000 Cu 0.42727 0.323317 0.5 383 63.546 0.000120749 -3.28315 63.546000 Cu 0.28935 0.362349 7.16014e-18 400 63.546 0.00182448 -3.28366 63.546000 Cu 0.375853 0.35353 0.5 402 63.546 0.000329931 -3.28292 63.546000 Cu 0.4622 0.344823 3.89034e-17 404 63.546 0.00114365 -3.28265 63.546000 Cu 0.497096 0.366386 0.5 407 63.546 0.00293325 -3.28214 63.546000 Cu 0.410928 0.374939 8.7473e-17 401 63.546 0.00329304 -3.28209 63.546000 Cu 0.51348 0.314636 0 381 63.546 0.000486349 -3.28295 63.546000 Cu 0.582956 0.357939 4.21255e-17 405 63.546 0.000640906 -3.28237 63.546000 Cu 0.54831 0.336235 0.5 406 63.546 0.00108923 -3.2826 63.546000 Cu 0.634207 0.327725 1.16949e-17 408 63.546 0.000109619 -3.28278 63.546000 Cu 0.720104 0.319189 0.5 410 63.546 0.000587038 -3.28318 63.546000 Cu 0.668754 0.349483 0.5 411 63.546 0.00114693 -3.28302 63.546000 Cu 0.70319 0.371229 7.29141e-17 433 63.546 0.00602639 -3.28391 63.546000 Cu 0.927245 0.323314 0 346 63.546 0.000172516 -3.28304 63.546000 Cu 0.997193 0.366353 3.89034e-17 369 63.546 0.00313445 -3.2821 63.546000 Cu 0.962223 0.344794 0.5 370 63.546 0.00133326 -3.28262 63.546000 Cu 0.754739 0.340859 0 409 63.546 0.0020481 -3.28361 63.546000 Cu 0.840927 0.332092 0.5 414 63.546 0.000538512 -3.28341 63.546000 Cu 0.789491 0.362387 0.5 435 63.546 0.00166123 -3.28365 63.546000 Cu 0.875969 0.353533 4.59442e-17 437 63.546 0.000374049 -3.28294 63.546000 Cu 0.911078 0.374927 0.5 371 63.546 0.0035585 -3.28202 63.546000 Cu 0.0658354 0.410074 1.30076e-17 393 63.546 0.00394144 -3.28158 63.546000 Cu 0.0318101 0.388077 0.5 394 63.546 0.00323679 -3.28194 63.546000 Cu 0.117375 0.379746 1.38429e-17 396 63.546 0.00191903 -3.28246 63.546000 Cu 0.237775 0.392755 2.38671e-19 397 63.546 0.00818705 -3.28364 63.546000 Cu 0.151542 0.401743 0.5 399 63.546 0.0225923 -3.2844 63.546000 Cu 0.0994472 0.43245 0.5 419 63.546 0.0665672 -3.27716 63.546000 Cu 0.185671 0.423385 4.74956e-17 421 63.546 0.0482047 -3.28212 63.546000 Cu 0.324436 0.383726 0.5 403 63.546 0.00127132 -3.28225 63.546000 Cu 0.309839 0.435026 1.9034e-16 422 63.546 0.0427401 -3.28152 63.546000 Cu 0.273303 0.413914 0.5 423 63.546 0.00766391 -3.28069 63.546000 Cu 0.359994 0.404999 1.48454e-16 425 63.546 0.010395 -3.28087 63.546000 Cu 0.480787 0.418294 4.57056e-17 426 63.546 0.0102393 -3.28034 63.546000 Cu 0.445982 0.396447 0.5 427 63.546 0.00882444 -3.28123 63.546000 Cu 0.395723 0.426485 0.5 428 63.546 0.0235671 -3.28335 63.546000 Cu 0.531714 0.388116 1.46425e-16 429 63.546 0.00270659 -3.28189 63.546000 Cu 0.651567 0.401762 5.72811e-18 430 63.546 0.0226218 -3.28455 63.546000 Cu 0.617331 0.379795 0.5 431 63.546 0.00211413 -3.28253 63.546000 Cu 0.565786 0.410093 0.5 432 63.546 0.00427615 -3.28153 63.546000 Cu 0.737851 0.392775 0.5 436 63.546 0.00809038 -3.28359 63.546000 Cu 0.59932 0.432456 0 451 63.546 0.0699701 -3.27711 63.546000 Cu 0.685628 0.423386 0.5 453 63.546 0.0500369 -3.28208 63.546000 Cu 0.94608 0.396418 1.2578e-16 392 63.546 0.00974818 -3.28123 63.546000 Cu 0.980882 0.418284 0.5 395 63.546 0.00990651 -3.28041 63.546000 Cu 0.824572 0.383739 1.37236e-16 434 63.546 0.00114502 -3.28216 63.546000 Cu 0.773365 0.413903 2.25544e-16 455 63.546 0.00804046 -3.2804 63.546000 Cu 0.895827 0.426461 1.04896e-16 456 63.546 0.0247976 -3.28346 63.546000 Cu 0.860098 0.404987 0.5 457 63.546 0.0108817 -3.28079 63.546000 Cu 0.809902 0.434982 0.5 458 63.546 0.0456574 -3.28106 63.546000 Cu 0.0154066 0.44059 0 417 63.546 0.00469013 -3.29043 63.546000 Cu 0.134189 0.454782 1.37952e-16 418 63.546 0.444569 -3.24191 63.546000 Cu 0.0498969 0.463427 0.5 420 63.546 0.47853 -3.20603 63.546000 Cu 0.220595 0.443883 0.5 424 63.546 0.082437 -3.27399 63.546000 Cu 0.0839779 0.491237 1.83777e-17 440 63.546 10.3539 -3.22506 63.546000 Cu 0.21101 0.491372 5.05983e-17 441 63.546 10.7654 -2.85917 63.546000 Cu 0.169391 0.47474 0.5 442 63.546 1.95945 -3.17191 63.546000 Cu 0.258906 0.464237 2.38671e-19 443 63.546 0.840272 -3.17722 63.546000 Cu 0.373961 0.476617 5.95485e-17 444 63.546 9.17808 -3.02976 63.546000 Cu 0.343904 0.456486 0.5 445 63.546 0.240188 -3.23995 63.546000 Cu 0.296355 0.491652 0.5 446 63.546 8.50519 -3.2385 63.546000 Cu 0.431509 0.448472 3.413e-17 447 63.546 0.0917972 -3.27344 63.546000 Cu 0.464979 0.471194 0.5 450 63.546 2.07928 -3.16516 63.546000 Cu 0.492388 0.491291 0 459 63.546 9.55302 -3.04317 63.546000 Cu 0.71127 0.491317 0.5 222 63.546 10.6645 -2.85983 63.546000 Cu 0.669647 0.474708 1.83419e-16 233 63.546 1.96336 -3.1697 63.546000 Cu 0.549944 0.463458 2.57765e-17 448 63.546 0.488742 -3.20567 63.546000 Cu 0.515391 0.4406 0.5 449 63.546 0.00505179 -3.29012 63.546000 Cu 0.720582 0.443847 1.66354e-16 452 63.546 0.0860167 -3.27394 63.546000 Cu 0.63414 0.454777 0.5 454 63.546 0.453706 -3.24149 63.546000 Cu 0.584045 0.491284 0.5 460 63.546 10.3696 -3.22567 63.546000 Cu 0.874089 0.476632 0.5 1 63.546 9.18661 -3.03061 63.546000 Cu 0.843991 0.456468 8.65183e-17 18 63.546 0.245934 -3.23942 63.546000 Cu 0.759033 0.464164 0.5 229 63.546 0.882826 -3.17531 63.546000 Cu 0.796678 0.491714 2.38671e-19 232 63.546 8.45112 -3.23855 63.546000 Cu 0.965012 0.471203 0 415 63.546 2.05628 -3.16648 63.546000 Cu 0.931492 0.448461 0.5 416 63.546 0.0871641 -3.27324 63.546000 Cu 0.992673 0.491285 0.5 439 63.546 9.65469 -3.04221 63.546000 Cu 0.0521969 0.519156 0.5 3 63.546 0.5092 -3.20535 63.546000 Cu 0.0189167 0.542135 1.17904e-16 15 63.546 0.00702731 -3.28966 63.546000 Cu 0.137064 0.527875 7.26754e-17 19 63.546 0.458853 -3.24007 63.546000 Cu 0.171442 0.508048 0.5 20 63.546 1.87284 -3.16297 63.546000 Cu 0.223938 0.538746 0.5 24 63.546 0.0759236 -3.26953 63.546000 Cu 0.103138 0.550153 0.5 41 63.546 0.0747485 -3.27643 63.546000 Cu 0.189674 0.559215 1.18142e-17 42 63.546 0.0518689 -3.28062 63.546000 Cu 0.37685 0.506151 0 4 63.546 9.10968 -3.02725 63.546000 Cu 0.467918 0.511692 0.5 6 63.546 1.92822 -3.16951 63.546000 Cu 0.261607 0.51833 1 21 63.546 0.683188 -3.19732 63.546000 Cu 0.313524 0.547638 7.99549e-18 22 63.546 0.0381824 -3.28251 63.546000 Cu 0.346929 0.526286 0.5 23 63.546 0.201886 -3.24615 63.546000 Cu 0.434948 0.534313 1.21961e-16 25 63.546 0.0940171 -3.27509 63.546000 Cu 0.399976 0.5562 0.5 28 63.546 0.0261986 -3.28374 63.546000 Cu 0.55245 0.519108 3.28173e-17 5 63.546 0.506091 -3.20689 63.546000 Cu 0.671814 0.508011 8.17449e-17 7 63.546 1.82905 -3.16361 63.546000 Cu 0.724056 0.538718 2.23158e-17 8 63.546 0.0775951 -3.26942 63.546000 Cu 0.637221 0.527789 0.5 10 63.546 0.467299 -3.24099 63.546000 Cu 0.51923 0.54212 0.5 27 63.546 0.0081693 -3.2896 63.546000 Cu 0.603347 0.550113 3.28173e-17 29 63.546 0.0755918 -3.27589 63.546000 Cu 0.689744 0.559172 0.5 31 63.546 0.0559142 -3.28041 63.546000 Cu 0.877113 0.506156 0.5 2 63.546 9.11912 -3.02732 63.546000 Cu 0.761847 0.518293 0.5 9 63.546 0.666272 -3.1993 63.546000 Cu 0.84701 0.526279 1.21842e-16 11 63.546 0.19846 -3.24736 63.546000 Cu 0.899743 0.556224 2.38671e-19 12 63.546 0.0261686 -3.28366 63.546000 Cu 0.934931 0.534308 0.5 13 63.546 0.0970363 -3.27418 63.546000 Cu 0.813585 0.547631 0.5 14 63.546 0.0407633 -3.2826 63.546000 Cu 0.967789 0.511616 1.21842e-16 438 63.546 1.90642 -3.16944 63.546000 Cu 0.07032 0.572572 3.43687e-17 16 63.546 0.0042784 -3.28111 63.546000 Cu 0.00281526 0.616239 0 38 63.546 0.00307778 -3.28214 63.546000 Cu 0.0370062 0.594558 0.5 39 63.546 0.00464514 -3.28189 63.546000 Cu 0.242805 0.589793 2.58958e-17 43 63.546 0.00979595 -3.28342 63.546000 Cu 0.156214 0.580853 0.5 45 63.546 0.023701 -3.28444 63.546000 Cu 0.122815 0.602849 0 64 63.546 0.00178943 -3.28245 63.546000 Cu 0.208799 0.611354 0.5 66 63.546 0.00652486 -3.28376 63.546000 Cu 0.0889085 0.624694 0.5 67 63.546 0.00103239 -3.28242 63.546000 Cu 0.485398 0.564408 1 26 63.546 0.013986 -3.28078 63.546000 Cu 0.277785 0.568656 0.5 44 63.546 0.00674966 -3.28032 63.546000 Cu 0.364828 0.5776 1.03703e-16 46 63.546 0.00939374 -3.28099 63.546000 Cu 0.416605 0.607666 6.57539e-17 47 63.546 0.00381411 -3.282 63.546000 Cu 0.45113 0.586197 0.5 48 63.546 0.00988677 -3.28142 63.546000 Cu 0.329825 0.598823 0.5 49 63.546 0.000877977 -3.28208 63.546000 Cu 0.295284 0.620154 5.64458e-17 68 63.546 0.00280693 -3.28355 63.546000 Cu 0.656268 0.580857 7.80455e-17 30 63.546 0.0236248 -3.28417 63.546000 Cu 0.570538 0.572567 0.5 32 63.546 0.00429626 -3.281 63.546000 Cu 0.74264 0.589829 0.5 36 63.546 0.0102122 -3.28331 63.546000 Cu 0.537055 0.594554 7.49428e-17 50 63.546 0.00408097 -3.28192 63.546000 Cu 0.589006 0.624753 0 51 63.546 0.00175471 -3.28251 63.546000 Cu 0.622775 0.602884 0.5 52 63.546 0.00149676 -3.28233 63.546000 Cu 0.502965 0.616252 0.5 53 63.546 0.00352795 -3.28212 63.546000 Cu 0.708745 0.611411 7.1124e-17 54 63.546 0.00607835 -3.28359 63.546000 Cu 0.985136 0.564433 0.5 17 63.546 0.0140689 -3.2808 63.546000 Cu 0.777646 0.568671 2.27931e-16 33 63.546 0.00703854 -3.28041 63.546000 Cu 0.829612 0.59885 1.78168e-16 34 63.546 0.00110427 -3.28202 63.546000 Cu 0.864614 0.57763 0.5 35 63.546 0.00949343 -3.28092 63.546000 Cu 0.950993 0.586225 6.01452e-17 37 63.546 0.010747 -3.28144 63.546000 Cu 0.916393 0.60768 0.5 40 63.546 0.00349735 -3.28206 63.546000 Cu 0.795175 0.620204 0.5 56 63.546 0.00279197 -3.28346 63.546000 Cu 0.0548642 0.64635 1 62 63.546 0.000933848 -3.28259 63.546000 Cu 0.0207214 0.667938 0.5 63 63.546 0.000743069 -3.28281 63.546000 Cu 0.174981 0.633131 0 65 63.546 0.000716674 -3.28299 63.546000 Cu 0.107005 0.676537 1 88 63.546 0.000624334 -3.28269 63.546000 Cu 0.141001 0.654863 0.5 89 63.546 8.85315e-05 -3.28264 63.546000 Cu 0.227126 0.663381 1 90 63.546 0.000600868 -3.28292 63.546000 Cu 0.193198 0.685071 0.5 93 63.546 7.34185e-05 -3.2828 63.546000 Cu 0.347512 0.650473 1 69 63.546 0.000589229 -3.28325 63.546000 Cu 0.381967 0.629023 0.5 70 63.546 0.000431192 -3.28282 63.546000 Cu 0.261151 0.64172 0.5 71 63.546 0.0019008 -3.2835 63.546000 Cu 0.468465 0.637757 3.03113e-17 72 63.546 0.0007942 -3.28254 63.546000 Cu 0.43404 0.659229 0.5 75 63.546 0.000155641 -3.28291 63.546000 Cu 0.31339 0.672012 0.5 92 63.546 0.000773153 -3.2831 63.546000 Cu 0.399862 0.680724 1 94 63.546 0.000171615 -3.28308 63.546000 Cu 0.674977 0.633216 0.5 57 63.546 0.000453965 -3.283 63.546000 Cu 0.52059 0.667925 0 73 63.546 0.000263178 -3.28276 63.546000 Cu 0.554829 0.646392 0.5 74 63.546 0.00113461 -3.28259 63.546000 Cu 0.64105 0.654957 8.55637e-17 76 63.546 0.00050183 -3.28272 63.546000 Cu 0.693315 0.68517 0 77 63.546 0.000228719 -3.28281 63.546000 Cu 0.727261 0.663494 0.5 78 63.546 0.000105144 -3.28298 63.546000 Cu 0.607017 0.676576 0.5 79 63.546 0.000480977 -3.28274 63.546000 Cu 0.761121 0.641797 0 55 63.546 0.00164318 -3.28353 63.546000 Cu 0.881874 0.629037 1 58 63.546 0.000342072 -3.28284 63.546000 Cu 0.934197 0.659255 2.43445e-17 59 63.546 0.00011497 -3.28303 63.546000 Cu 0.968465 0.63777 0.5 60 63.546 0.00119467 -3.28267 63.546000 Cu 0.847576 0.650502 0.5 61 63.546 0.000816125 -3.28336 63.546000 Cu 0.813518 0.672084 4.96436e-17 80 63.546 0.000681854 -3.28316 63.546000 Cu 0.899915 0.680757 0.5 82 63.546 0.000364312 -3.28318 63.546000 Cu 0.0384593 0.719688 1 85 63.546 3.38735e-05 -3.28313 63.546000 Cu 0.0727981 0.69812 0.5 86 63.546 0.000256231 -3.28284 63.546000 Cu 0.00414531 0.741285 0.5 108 63.546 1.55545e-05 -3.28323 63.546000 Cu 0.159108 0.706724 1 111 63.546 0.000244933 -3.28286 63.546000 Cu 0.211006 0.736952 5.50137e-17 112 63.546 2.24559e-05 -3.28296 63.546000 Cu 0.245304 0.715302 0.5 113 63.546 7.54534e-05 -3.28299 63.546000 Cu 0.124784 0.728341 0.5 114 63.546 0.000105117 -3.28305 63.546000 Cu 0.0904371 0.749955 0 134 63.546 5.91229e-05 -3.2832 63.546000 Cu 0.2794 0.693637 7.87615e-18 91 63.546 0.000337106 -3.28308 63.546000 Cu 0.452118 0.710979 1 95 63.546 0.000105442 -3.28317 63.546000 Cu 0.4864 0.689437 0.5 96 63.546 6.99805e-05 -3.28299 63.546000 Cu 0.365711 0.702289 0.5 97 63.546 0.000284043 -3.28326 63.546000 Cu 0.331512 0.723911 1 115 63.546 0.000138438 -3.28316 63.546000 Cu 0.417781 0.732556 0.5 117 63.546 0.000145713 -3.28312 63.546000 Cu 0.297186 0.745549 0.5 118 63.546 3.3762e-05 -3.28299 63.546000 Cu 0.57283 0.698136 8.4609e-17 98 63.546 0.000193484 -3.28295 63.546000 Cu 0.624816 0.728382 1 99 63.546 0.000159154 -3.28302 63.546000 Cu 0.659145 0.706794 0.5 100 63.546 0.000288405 -3.28293 63.546000 Cu 0.538488 0.719685 0.5 101 63.546 2.00128e-05 -3.28306 63.546000 Cu 0.745367 0.715402 3.592e-17 102 63.546 7.82985e-05 -3.28294 63.546000 Cu 0.711084 0.737033 0.5 105 63.546 0.000153309 -3.28292 63.546000 Cu 0.504085 0.741235 1 119 63.546 5.92228e-05 -3.2831 63.546000 Cu 0.590409 0.749945 0.5 121 63.546 4.03046e-05 -3.28318 63.546000 Cu 0.865744 0.702351 0 81 63.546 0.000263441 -3.28325 63.546000 Cu 0.779514 0.693739 0.5 83 63.546 8.81493e-05 -3.28298 63.546000 Cu 0.98639 0.689459 0 84 63.546 5.57107e-05 -3.28296 63.546000 Cu 0.952107 0.711014 0.5 87 63.546 0.000111411 -3.28323 63.546000 Cu 0.797293 0.745639 8.96211e-17 103 63.546 1.43344e-05 -3.28293 63.546000 Cu 0.831586 0.723997 0.5 104 63.546 5.55255e-05 -3.28312 63.546000 Cu 0.917863 0.732625 0 106 63.546 7.83469e-05 -3.28321 63.546000 Cu 0.0560537 0.771561 0.5 110 63.546 6.9318e-05 -3.28322 63.546000 Cu 0.0215337 0.793134 2.93566e-17 131 63.546 6.97838e-05 -3.28304 63.546000 Cu 0.142295 0.780234 4.72569e-17 135 63.546 0.000197036 -3.28322 63.546000 Cu 0.176658 0.758596 0.5 136 63.546 7.25459e-05 -3.28306 63.546000 Cu 0.228459 0.788868 0.5 140 63.546 0.00016484 -3.28314 63.546000 Cu 0.107813 0.801835 0.5 157 63.546 0.000197208 -3.28324 63.546000 Cu 0.194066 0.810536 4.36768e-17 158 63.546 0.00069287 -3.28338 63.546000 Cu 0.383381 0.754157 5.84745e-18 116 63.546 0.00012923 -3.28297 63.546000 Cu 0.469614 0.762803 0.5 122 63.546 0.000147549 -3.28308 63.546000 Cu 0.262805 0.767197 4.23642e-17 137 63.546 1.65626e-05 -3.28296 63.546000 Cu 0.314517 0.797442 3.74714e-17 138 63.546 6.7702e-05 -3.28287 63.546000 Cu 0.348939 0.775778 0.5 139 63.546 0.000129433 -3.28281 63.546000 Cu 0.435085 0.78438 3.92614e-17 141 63.546 0.000356778 -3.28286 63.546000 Cu 0.400557 0.805996 0.5 144 63.546 0.000531083 -3.28278 63.546000 Cu 0.555926 0.771509 2.85212e-17 120 63.546 1.84989e-05 -3.28326 63.546000 Cu 0.676712 0.758637 5.68038e-17 123 63.546 0.000179483 -3.2831 63.546000 Cu 0.728494 0.788917 0 124 63.546 0.000284808 -3.2832 63.546000 Cu 0.642243 0.780236 0.5 126 63.546 0.000195618 -3.28331 63.546000 Cu 0.521365 0.793058 0.5 143 63.546 0.000150385 -3.28303 63.546000 Cu 0.607687 0.8018 5.90711e-17 145 63.546 9.38165e-05 -3.28325 63.546000 Cu 0.694019 0.810548 0.5 147 63.546 0.000696838 -3.28336 63.546000 Cu 0.969754 0.762886 0 107 63.546 5.3011e-05 -3.28309 63.546000 Cu 0.88352 0.754248 0.5 109 63.546 5.73594e-05 -3.28298 63.546000 Cu 0.762916 0.767272 0.5 125 63.546 5.21271e-05 -3.28297 63.546000 Cu 0.849097 0.775868 0 127 63.546 5.78948e-05 -3.28283 63.546000 Cu 0.900706 0.806084 2.27931e-17 128 63.546 0.000316553 -3.2828 63.546000 Cu 0.93526 0.784473 0.5 129 63.546 0.000183102 -3.28288 63.546000 Cu 0.814622 0.797519 0.5 130 63.546 5.05863e-05 -3.28292 63.546000 Cu 0.073144 0.823374 2.98339e-17 132 63.546 0.0001727 -3.28308 63.546000 Cu 0.00326986 0.866441 3.3414e-18 154 63.546 0.00329433 -3.28206 63.546000 Cu 0.0382437 0.844886 0.5 155 63.546 0.00110634 -3.28258 63.546000 Cu 0.245705 0.840876 1.19336e-17 159 63.546 0.00196731 -3.28362 63.546000 Cu 0.159476 0.832133 0.5 161 63.546 0.000690033 -3.28345 63.546000 Cu 0.124556 0.853615 0 180 63.546 0.000399225 -3.28292 63.546000 Cu 0.211023 0.862466 0.5 182 63.546 0.00241463 -3.28367 63.546000 Cu 0.486706 0.814606 0 142 63.546 0.000768843 -3.28286 63.546000 Cu 0.28013 0.819163 0.5 160 63.546 0.000381567 -3.28314 63.546000 Cu 0.366076 0.8277 0 162 63.546 0.000183819 -3.28273 63.546000 Cu 0.417394 0.857937 1.02629e-17 163 63.546 0.000955035 -3.28235 63.546000 Cu 0.452003 0.836217 0.5 164 63.546 0.00131554 -3.28256 63.546000 Cu 0.331658 0.849486 0.5 165 63.546 0.000925644 -3.28293 63.546000 Cu 0.297213 0.871291 1 184 63.546 0.00646611 -3.28376 63.546000 Cu 0.659389 0.832111 0 146 63.546 0.000518628 -3.28343 63.546000 Cu 0.573 0.823316 0.5 148 63.546 0.000241818 -3.28309 63.546000 Cu 0.745671 0.840885 0.5 152 63.546 0.00185582 -3.28361 63.546000 Cu 0.538122 0.844826 1 166 63.546 0.00145212 -3.28265 63.546000 Cu 0.58929 0.874981 1 167 63.546 0.00404729 -3.28217 63.546000 Cu 0.624462 0.853578 0.5 168 63.546 0.000413386 -3.28297 63.546000 Cu 0.50319 0.866396 0.5 169 63.546 0.00363915 -3.28214 63.546000 Cu 0.710963 0.862454 0 170 63.546 0.00216436 -3.28368 63.546000 Cu 0.986867 0.814687 0.5 133 63.546 0.00047977 -3.28286 63.546000 Cu 0.78015 0.819209 0 149 63.546 0.000476128 -3.28313 63.546000 Cu 0.831682 0.849517 1.7423e-17 150 63.546 0.00101033 -3.28294 63.546000 Cu 0.866156 0.827765 0.5 151 63.546 0.000143021 -3.28271 63.546000 Cu 0.952113 0.836286 0 153 63.546 0.0010138 -3.28251 63.546000 Cu 0.91745 0.85798 0.5 156 63.546 0.000910975 -3.28232 63.546000 Cu 0.797199 0.871299 0.5 172 63.546 0.00637159 -3.2838 63.546000 Cu 0.0893665 0.875016 0.5 183 63.546 0.00371577 -3.28207 63.546000 Cu 0.0541129 0.896532 8.34156e-17 178 63.546 0.00960686 -3.28124 63.546000 Cu 0.0191171 0.918392 0.5 179 63.546 0.0110105 -3.28023 63.546000 Cu 0.175838 0.883838 0 181 63.546 0.00121202 -3.28226 63.546000 Cu 0.104092 0.926582 0 204 63.546 0.0257201 -3.28317 63.546000 Cu 0.140081 0.905106 0.5 205 63.546 0.010492 -3.28089 63.546000 Cu 0.226716 0.914048 0 206 63.546 0.0074907 -3.28073 63.546000 Cu 0.189918 0.935137 0.5 209 63.546 0.0449763 -3.28114 63.546000 Cu 0.348604 0.901861 3.77101e-17 185 63.546 0.0230013 -3.28434 63.546000 Cu 0.382927 0.879842 0.5 186 63.546 0.00192245 -3.28237 63.546000 Cu 0.262465 0.892875 0.5 187 63.546 0.00887936 -3.2837 63.546000 Cu 0.468425 0.888163 5.48944e-18 188 63.546 0.00313115 -3.28185 63.546000 Cu 0.43418 0.910184 0.5 191 63.546 0.00396269 -3.28144 63.546000 Cu 0.314251 0.923538 0.5 208 63.546 0.0515706 -3.2824 63.546000 Cu 0.400431 0.932589 4.08128e-17 210 63.546 0.0688791 -3.277 63.546000 Cu 0.675777 0.883819 0.5 173 63.546 0.00121851 -3.28228 63.546000 Cu 0.519092 0.918374 5.75198e-17 189 63.546 0.0111706 -3.28024 63.546000 Cu 0.554063 0.896505 0.5 190 63.546 0.00993808 -3.28131 63.546000 Cu 0.640032 0.905085 1.08595e-17 192 63.546 0.0108757 -3.28095 63.546000 Cu 0.689893 0.935125 0 193 63.546 0.0453407 -3.28122 63.546000 Cu 0.726683 0.914036 0.5 194 63.546 0.00749625 -3.28073 63.546000 Cu 0.604061 0.926565 0.5 195 63.546 0.0261588 -3.28325 63.546000 Cu 0.762432 0.892871 1.7065e-17 171 63.546 0.00865251 -3.28369 63.546000 Cu 0.882942 0.879863 6.32479e-18 174 63.546 0.00199452 -3.28242 63.546000 Cu 0.934193 0.910198 2.89986e-17 175 63.546 0.00402958 -3.28147 63.546000 Cu 0.968468 0.888191 0.5 176 63.546 0.00306211 -3.28185 63.546000 Cu 0.848595 0.901869 0.5 177 63.546 0.0229817 -3.28438 63.546000 Cu 0.814236 0.923535 2.01677e-17 196 63.546 0.0511427 -3.28235 63.546000 Cu 0.900432 0.932592 0.5 198 63.546 0.0688306 -3.27704 63.546000 Cu 0.0346043 0.97133 2.06451e-17 201 63.546 2.08627 -3.16537 63.546000 Cu 0.0681401 0.948582 0.5 202 63.546 0.0936816 -3.27304 63.546000 Cu 0.00697174 0.991435 0.5 223 63.546 9.58159 -3.04298 63.546000 Cu 0.155714 0.956598 1 224 63.546 0.239176 -3.24053 63.546000 Cu 0.202997 0.991744 6.46799e-17 225 63.546 8.52832 -3.23881 63.546000 Cu 0.240699 0.964354 0.5 226 63.546 0.842362 -3.17746 63.546000 Cu 0.125538 0.976741 0.5 227 63.546 9.17675 -3.03051 63.546000 Cu 0.4155 0.991422 0.5 249 63.546 10.362 -3.22488 63.546000 Cu 0.279165 0.944019 1.55136e-17 207 63.546 0.0824018 -3.27391 63.546000 Cu 0.449661 0.963585 0 211 63.546 0.485767 -3.20533 63.546000 Cu 0.484282 0.940726 0.5 212 63.546 0.0046622 -3.28992 63.546000 Cu 0.365495 0.954937 0.5 213 63.546 0.451666 -3.24171 63.546000 Cu 0.330119 0.974899 9.37978e-17 228 63.546 1.9636 -3.17165 63.546000 Cu 0.288348 0.991504 0.5 230 63.546 10.7301 -2.85918 63.546000 Cu 0.568123 0.948572 6.99307e-17 214 63.546 0.0939225 -3.27304 63.546000 Cu 0.625531 0.976733 2.86406e-17 215 63.546 9.17776 -3.03052 63.546000 Cu 0.655694 0.956588 0.5 216 63.546 0.239254 -3.24053 63.546000 Cu 0.534599 0.971324 0.5 217 63.546 2.08649 -3.16536 63.546000 Cu 0.740686 0.964347 2.74472e-17 218 63.546 0.843007 -3.17753 63.546000 Cu 0.702998 0.991738 0.5 221 63.546 8.52748 -3.23881 63.546000 Cu 0.50697 0.991432 9.83326e-17 231 63.546 9.58154 -3.04301 63.546000 Cu 0.915499 0.991423 2.44638e-17 234 63.546 10.3617 -3.22501 63.546000 Cu 0.865491 0.954935 1 197 63.546 0.451548 -3.24169 63.546000 Cu 0.779148 0.944012 0.5 199 63.546 0.0823656 -3.27388 63.546000 Cu 0.984293 0.940732 1.08595e-17 200 63.546 0.00476917 -3.28995 63.546000 Cu 0.949663 0.963588 0.5 203 63.546 0.485982 -3.20535 63.546000 Cu 0.788349 0.991496 1 219 63.546 10.7278 -2.85915 63.546000 Cu 0.830111 0.974894 0.5 220 63.546 1.96381 -3.1715