Number of particles = 524 A = 1 Angstrom (basic length-scale) H0(1,1) = 11.8488 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 101.898 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.11048 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 0.537729 0.0366427 0.25 265 63.546 4.98267 -3.56816 63.546000 Cu 0.643342 0.0136044 0.25 268 63.546 2.81189 -3.675 63.546000 Cu 0.537729 0.0366427 0.75 269 63.546 4.98267 -3.56816 63.546000 Cu 0.643342 0.0136044 0.75 270 63.546 2.81189 -3.675 63.546000 Cu 0.724098 0.0342833 1 275 63.546 0.0554537 -3.52543 63.546000 Cu 0.620978 0.0569968 1 276 63.546 4.56987 -3.60915 63.546000 Cu 0.620978 0.0569968 0.5 277 63.546 4.56987 -3.60915 63.546000 Cu 0.80722 0.0547589 0.25 279 63.546 0.0364728 -3.54475 63.546000 Cu 0.837854 0.0125211 5.95725e-17 283 63.546 5.27566 -3.55365 63.546000 Cu 0.837854 0.0125211 0.5 284 63.546 5.27566 -3.55365 63.546000 Cu 0.912196 0.0330622 0.25 285 63.546 0.0596013 -3.51596 63.546000 Cu 0.0292129 0.0122355 0.25 286 63.546 5.30833 -3.48852 63.546000 Cu 0.724098 0.0342833 0.5 287 63.546 0.0554537 -3.52543 63.546000 Cu 0.80722 0.0547589 0.75 288 63.546 0.0364728 -3.54475 63.546000 Cu 0.912196 0.0330622 0.75 289 63.546 0.0596013 -3.51596 63.546000 Cu 0.0292129 0.0122355 0.75 290 63.546 5.30833 -3.48852 63.546000 Cu 0.995558 0.0530789 1 307 63.546 0.03067 -3.52961 63.546000 Cu 0.218698 0.0123598 1 315 63.546 8.84743 -3.18108 63.546000 Cu 0.100706 0.0322078 1 316 63.546 0.125029 -3.47202 63.546000 Cu 0.100706 0.0322078 0.5 317 63.546 0.125029 -3.47202 63.546000 Cu 0.18686 0.0512082 0.25 318 63.546 0.0461083 -3.50538 63.546000 Cu 0.292542 0.0307362 0.25 319 63.546 5.80129 -3.22103 63.546000 Cu 0.995558 0.0530789 0.5 320 63.546 0.03067 -3.52961 63.546000 Cu 0.18686 0.0512082 0.75 322 63.546 0.0461083 -3.50538 63.546000 Cu 0.218698 0.0123598 0.5 324 63.546 8.84743 -3.18108 63.546000 Cu 0.292542 0.0307362 0.75 325 63.546 5.80129 -3.22103 63.546000 Cu 0.437328 0.0180491 1 363 63.546 5.40876 -3.56051 63.546000 Cu 0.382406 0.0481495 2.12034e-15 364 63.546 4.98179 -3.3857 63.546000 Cu 0.382406 0.0481495 0.5 365 63.546 4.98179 -3.3857 63.546000 Cu 0.437328 0.0180491 0.5 370 63.546 5.40876 -3.56051 63.546000 Cu 0.541871 0.0846375 1 271 63.546 0.649901 -3.36768 63.546000 Cu 0.628322 0.10289 0.25 273 63.546 0.173358 -3.44013 63.546000 Cu 0.710221 0.0772088 0.25 278 63.546 0.737553 -3.60634 63.546000 Cu 0.541871 0.0846375 0.5 280 63.546 0.649901 -3.36768 63.546000 Cu 0.628322 0.10289 0.75 281 63.546 0.173358 -3.44013 63.546000 Cu 0.710221 0.0772088 0.75 282 63.546 0.737553 -3.60634 63.546000 Cu 0.801998 0.0971027 1 299 63.546 0.265448 -3.58249 63.546000 Cu 0.716659 0.121426 5.54992e-17 300 63.546 0.034427 -3.49015 63.546000 Cu 0.716659 0.121426 0.5 301 63.546 0.034427 -3.49015 63.546000 Cu 0.893824 0.116655 0.25 303 63.546 0.0874212 -3.56315 63.546000 Cu 0.895899 0.0747304 1 308 63.546 0.0173827 -3.54118 63.546000 Cu 0.895899 0.0747304 0.5 309 63.546 0.0173827 -3.54118 63.546000 Cu 0.9866 0.0942567 0.25 310 63.546 0.00789812 -3.53783 63.546000 Cu 0.0839372 0.0724078 0.25 311 63.546 0.013711 -3.53244 63.546000 Cu 0.801998 0.0971027 0.5 312 63.546 0.265448 -3.58249 63.546000 Cu 0.893824 0.116655 0.75 313 63.546 0.0874212 -3.56315 63.546000 Cu 0.9866 0.0942567 0.75 314 63.546 0.00789812 -3.53783 63.546000 Cu 0.0839372 0.0724078 0.75 321 63.546 0.013711 -3.53244 63.546000 Cu 0.0774539 0.113549 1.18806e-18 347 63.546 0.00345112 -3.53741 63.546000 Cu 0.273306 0.0697103 1 355 63.546 0.0212793 -3.51085 63.546000 Cu 0.172705 0.0914684 1 356 63.546 0.0060182 -3.53291 63.546000 Cu 0.172705 0.0914684 0.5 357 63.546 0.0060182 -3.53291 63.546000 Cu 0.262002 0.110494 0.25 358 63.546 0.00424556 -3.5313 63.546000 Cu 0.358192 0.0884955 0.25 359 63.546 0.0243504 -3.50269 63.546000 Cu 0.0774539 0.113549 0.5 360 63.546 0.00345112 -3.53741 63.546000 Cu 0.262002 0.110494 0.75 362 63.546 0.00424556 -3.5313 63.546000 Cu 0.459527 0.0664933 0.25 366 63.546 4.76317 -3.32091 63.546000 Cu 0.273306 0.0697103 0.5 367 63.546 0.0212793 -3.51085 63.546000 Cu 0.358192 0.0884955 0.75 368 63.546 0.0243504 -3.50269 63.546000 Cu 0.459527 0.0664933 0.75 369 63.546 4.76317 -3.32091 63.546000 Cu 0.446306 0.107121 1 411 63.546 0.0181521 -3.5122 63.546000 Cu 0.446306 0.107121 0.5 412 63.546 0.0181521 -3.5122 63.546000 Cu 0.535698 0.125715 0.25 272 63.546 0.0114449 -3.51821 63.546000 Cu 0.535698 0.125715 0.75 274 63.546 0.0114449 -3.51821 63.546000 Cu 0.625518 0.144382 1.70401e-16 292 63.546 0.00585972 -3.52281 63.546000 Cu 0.533793 0.166989 1 293 63.546 0.00084954 -3.53095 63.546000 Cu 0.533793 0.166989 0.5 294 63.546 0.00084954 -3.53095 63.546000 Cu 0.624512 0.185826 0.25 295 63.546 0.000416212 -3.53173 63.546000 Cu 0.715775 0.163142 0.25 296 63.546 0.00240681 -3.52634 63.546000 Cu 0.624512 0.185826 0.75 298 63.546 0.000416212 -3.53173 63.546000 Cu 0.806136 0.140188 0.25 302 63.546 0.0055471 -3.51666 63.546000 Cu 0.625518 0.144382 0.5 304 63.546 0.00585972 -3.52281 63.546000 Cu 0.715775 0.163142 0.75 305 63.546 0.00240681 -3.52634 63.546000 Cu 0.806136 0.140188 0.75 306 63.546 0.0055471 -3.51666 63.546000 Cu 0.896487 0.159079 1 339 63.546 0.00125405 -3.52818 63.546000 Cu 0.806244 0.18197 1 340 63.546 0.000757165 -3.52924 63.546000 Cu 0.806244 0.18197 0.5 341 63.546 0.000757165 -3.52924 63.546000 Cu 0.987299 0.178021 0.25 343 63.546 0.000624895 -3.53322 63.546000 Cu 0.985415 0.135978 1 348 63.546 0.0283174 -3.55158 63.546000 Cu 0.985415 0.135978 0.5 349 63.546 0.0283174 -3.55158 63.546000 Cu 0.0769842 0.155158 0.25 350 63.546 0.00859113 -3.54477 63.546000 Cu 0.168463 0.132694 0.25 351 63.546 0.00185726 -3.53673 63.546000 Cu 0.896487 0.159079 0.5 352 63.546 0.00125405 -3.52818 63.546000 Cu 0.987299 0.178021 0.75 353 63.546 0.000624895 -3.53322 63.546000 Cu 0.0769842 0.155158 0.75 354 63.546 0.00859113 -3.54477 63.546000 Cu 0.168463 0.132694 0.75 361 63.546 0.00185726 -3.53673 63.546000 Cu 0.168602 0.174227 1.70062e-16 395 63.546 0.00226694 -3.54166 63.546000 Cu 0.352298 0.129373 1.3739e-15 403 63.546 0.00294016 -3.53226 63.546000 Cu 0.259762 0.151716 1 404 63.546 0.000954442 -3.53648 63.546000 Cu 0.259762 0.151716 0.5 405 63.546 0.000954442 -3.53648 63.546000 Cu 0.351236 0.170651 0.25 406 63.546 0.000348643 -3.53535 63.546000 Cu 0.442944 0.148182 0.25 407 63.546 0.00171993 -3.53163 63.546000 Cu 0.168602 0.174227 0.5 408 63.546 0.00226694 -3.54166 63.546000 Cu 0.351236 0.170651 0.75 410 63.546 0.000348643 -3.53535 63.546000 Cu 0.352298 0.129373 0.5 413 63.546 0.00294016 -3.53226 63.546000 Cu 0.442944 0.148182 0.75 414 63.546 0.00171993 -3.53163 63.546000 Cu 0.533163 0.208462 0.25 291 63.546 9.44321e-05 -3.53367 63.546000 Cu 0.533163 0.208462 0.75 297 63.546 9.44321e-05 -3.53367 63.546000 Cu 0.715163 0.204686 1 331 63.546 0.000169478 -3.53242 63.546000 Cu 0.624024 0.227358 8.41823e-17 332 63.546 3.25277e-05 -3.53353 63.546000 Cu 0.624024 0.227358 0.5 333 63.546 3.25277e-05 -3.53353 63.546000 Cu 0.714851 0.246261 0.25 334 63.546 3.11303e-05 -3.53359 63.546000 Cu 0.805888 0.223567 0.25 335 63.546 6.139e-05 -3.53295 63.546000 Cu 0.714851 0.246261 0.75 338 63.546 3.11303e-05 -3.53359 63.546000 Cu 0.896855 0.200838 0.25 342 63.546 0.000171114 -3.53207 63.546000 Cu 0.715163 0.204686 0.5 344 63.546 0.000169478 -3.53242 63.546000 Cu 0.805888 0.223567 0.75 345 63.546 6.139e-05 -3.53295 63.546000 Cu 0.896855 0.200838 0.75 346 63.546 0.000171114 -3.53207 63.546000 Cu 0.987567 0.219738 0 387 63.546 3.78373e-05 -3.53354 63.546000 Cu 0.896679 0.242465 1 388 63.546 2.28648e-05 -3.53419 63.546000 Cu 0.896679 0.242465 0.5 389 63.546 2.28648e-05 -3.53419 63.546000 Cu 0.0784151 0.238655 0.25 391 63.546 1.42745e-05 -3.53429 63.546000 Cu 0.0782638 0.196971 1.01833e-16 396 63.546 0.000336184 -3.53525 63.546000 Cu 0.0782638 0.196971 0.5 397 63.546 0.000336184 -3.53525 63.546000 Cu 0.169168 0.215921 0.25 398 63.546 0.000145124 -3.53545 63.546000 Cu 0.259983 0.193221 0.25 399 63.546 0.000519074 -3.53827 63.546000 Cu 0.987567 0.219738 0.5 400 63.546 3.78373e-05 -3.53354 63.546000 Cu 0.0784151 0.238655 0.75 401 63.546 1.42745e-05 -3.53429 63.546000 Cu 0.169168 0.215921 0.75 402 63.546 0.000145124 -3.53545 63.546000 Cu 0.259983 0.193221 0.75 409 63.546 0.000519074 -3.53827 63.546000 Cu 0.2601 0.23486 1 443 63.546 0.00010333 -3.5353 63.546000 Cu 0.442294 0.18956 1.70741e-16 451 63.546 0.000154393 -3.53412 63.546000 Cu 0.351066 0.212175 0 452 63.546 9.81846e-05 -3.53656 63.546000 Cu 0.351066 0.212175 0.5 453 63.546 9.81846e-05 -3.53656 63.546000 Cu 0.44205 0.231117 0.25 454 63.546 2.50272e-05 -3.53611 63.546000 Cu 0.2601 0.23486 0.5 455 63.546 0.00010333 -3.5353 63.546000 Cu 0.44205 0.231117 0.75 457 63.546 2.50272e-05 -3.53611 63.546000 Cu 0.442294 0.18956 0.5 458 63.546 0.000154393 -3.53412 63.546000 Cu 0.533061 0.250043 1 327 63.546 3.32911e-05 -3.53447 63.546000 Cu 0.533478 0.291677 0.25 328 63.546 6.49945e-05 -3.5358 63.546000 Cu 0.624153 0.268968 0.25 329 63.546 3.97378e-05 -3.53374 63.546000 Cu 0.533478 0.291677 0.75 330 63.546 6.49945e-05 -3.5358 63.546000 Cu 0.533061 0.250043 0.5 336 63.546 3.32911e-05 -3.53447 63.546000 Cu 0.624153 0.268968 0.75 337 63.546 3.97378e-05 -3.53374 63.546000 Cu 0.624456 0.31063 1 372 63.546 0.000183179 -3.53563 63.546000 Cu 0.805855 0.265165 2.74611e-16 379 63.546 1.25665e-05 -3.5331 63.546000 Cu 0.715206 0.287884 1 380 63.546 3.73633e-05 -3.53324 63.546000 Cu 0.715206 0.287884 0.5 381 63.546 3.73633e-05 -3.53324 63.546000 Cu 0.806031 0.306792 0.25 382 63.546 6.90512e-05 -3.53299 63.546000 Cu 0.896867 0.284067 0.25 383 63.546 3.31322e-05 -3.53234 63.546000 Cu 0.624456 0.31063 0.5 384 63.546 0.000183179 -3.53563 63.546000 Cu 0.806031 0.306792 0.75 386 63.546 6.90512e-05 -3.53299 63.546000 Cu 0.987601 0.261376 0.25 390 63.546 2.78521e-05 -3.53362 63.546000 Cu 0.805855 0.265165 0.5 392 63.546 1.25665e-05 -3.5331 63.546000 Cu 0.896867 0.284067 0.75 393 63.546 3.31322e-05 -3.53234 63.546000 Cu 0.987601 0.261376 0.75 394 63.546 2.78521e-05 -3.53362 63.546000 Cu 0.0786598 0.280269 1 435 63.546 1.62207e-05 -3.53272 63.546000 Cu 0.987748 0.302957 1 436 63.546 9.55234e-05 -3.53319 63.546000 Cu 0.987748 0.302957 0.5 437 63.546 9.55234e-05 -3.53319 63.546000 Cu 0.16967 0.299168 0.25 439 63.546 7.11082e-05 -3.5337 63.546000 Cu 0.169421 0.257573 1.70231e-16 444 63.546 2.13005e-05 -3.53451 63.546000 Cu 0.169421 0.257573 0.5 445 63.546 2.13005e-05 -3.53451 63.546000 Cu 0.260513 0.276493 0.25 446 63.546 1.36753e-05 -3.53452 63.546000 Cu 0.351189 0.253796 0.25 447 63.546 2.59671e-05 -3.53517 63.546000 Cu 0.0786598 0.280269 0.5 448 63.546 1.62207e-05 -3.53272 63.546000 Cu 0.16967 0.299168 0.75 449 63.546 7.11082e-05 -3.5337 63.546000 Cu 0.260513 0.276493 0.75 450 63.546 1.36753e-05 -3.53452 63.546000 Cu 0.351189 0.253796 0.75 456 63.546 2.59671e-05 -3.53517 63.546000 Cu 0.351617 0.29542 1 487 63.546 4.4451e-05 -3.53542 63.546000 Cu 0.442386 0.272729 3.39784e-16 495 63.546 1.2424e-05 -3.53542 63.546000 Cu 0.442386 0.272729 0.5 496 63.546 1.2424e-05 -3.53542 63.546000 Cu 0.351617 0.29542 0.5 497 63.546 4.4451e-05 -3.53542 63.546000 Cu 0.533844 0.333367 1 373 63.546 0.00108056 -3.53958 63.546000 Cu 0.533844 0.333367 0.5 374 63.546 0.00108056 -3.53958 63.546000 Cu 0.625166 0.352396 0.25 375 63.546 0.0040271 -3.5428 63.546000 Cu 0.715446 0.329585 0.25 376 63.546 0.000289741 -3.53429 63.546000 Cu 0.625166 0.352396 0.75 378 63.546 0.0040271 -3.5428 63.546000 Cu 0.715446 0.329585 0.75 385 63.546 0.000289741 -3.53429 63.546000 Cu 0.71665 0.371502 1 419 63.546 0.0128363 -3.54729 63.546000 Cu 0.896716 0.325697 1 427 63.546 0.000278859 -3.53154 63.546000 Cu 0.806309 0.348547 6.33064e-17 428 63.546 0.000530407 -3.53208 63.546000 Cu 0.806309 0.348547 0.5 429 63.546 0.000530407 -3.53208 63.546000 Cu 0.89686 0.3675 0.25 430 63.546 0.00198795 -3.52579 63.546000 Cu 0.987296 0.344578 0.25 431 63.546 0.000920304 -3.52861 63.546000 Cu 0.71665 0.371502 0.5 432 63.546 0.0128363 -3.54729 63.546000 Cu 0.89686 0.3675 0.75 434 63.546 0.00198795 -3.52579 63.546000 Cu 0.0784362 0.321845 0.25 438 63.546 0.000246072 -3.53277 63.546000 Cu 0.896716 0.325697 0.5 440 63.546 0.000278859 -3.53154 63.546000 Cu 0.987296 0.344578 0.75 441 63.546 0.000920304 -3.52861 63.546000 Cu 0.0784362 0.321845 0.75 442 63.546 0.000246072 -3.53277 63.546000 Cu 0.169062 0.340715 1 479 63.546 0.000610099 -3.53155 63.546000 Cu 0.0775832 0.363411 1 480 63.546 0.00281003 -3.5255 63.546000 Cu 0.0775832 0.363411 0.5 481 63.546 0.00281003 -3.5255 63.546000 Cu 0.259678 0.359563 0.25 483 63.546 0.00110664 -3.53133 63.546000 Cu 0.260528 0.318083 3.40972e-16 488 63.546 9.84783e-05 -3.53431 63.546000 Cu 0.260528 0.318083 0.5 489 63.546 9.84783e-05 -3.53431 63.546000 Cu 0.351437 0.337 0.25 490 63.546 0.000218904 -3.53411 63.546000 Cu 0.442661 0.314378 0.25 491 63.546 0.000183438 -3.53739 63.546000 Cu 0.169062 0.340715 0.5 492 63.546 0.000610099 -3.53155 63.546000 Cu 0.259678 0.359563 0.75 493 63.546 0.00110664 -3.53133 63.546000 Cu 0.351437 0.337 0.75 494 63.546 0.000218904 -3.53411 63.546000 Cu 0.442661 0.314378 0.75 498 63.546 0.000183438 -3.53739 63.546000 Cu 0.442413 0.35593 1 515 63.546 0.000424465 -3.53525 63.546000 Cu 0.442413 0.35593 0.5 522 63.546 0.000424465 -3.53525 63.546000 Cu 0.533662 0.37491 0.25 371 63.546 0.000792257 -3.53704 63.546000 Cu 0.533662 0.37491 0.75 377 63.546 0.000792257 -3.53704 63.546000 Cu 0.531802 0.416164 1 415 63.546 0.00462358 -3.53166 63.546000 Cu 0.621492 0.435262 0.25 417 63.546 0.00893396 -3.52674 63.546000 Cu 0.625106 0.393974 0 420 63.546 0.0019379 -3.53668 63.546000 Cu 0.625106 0.393974 0.5 421 63.546 0.0019379 -3.53668 63.546000 Cu 0.716408 0.413186 0.25 422 63.546 0.00389709 -3.53522 63.546000 Cu 0.80832 0.390748 0.25 423 63.546 0.0416494 -3.55463 63.546000 Cu 0.531802 0.416164 0.5 424 63.546 0.00462358 -3.53166 63.546000 Cu 0.621492 0.435262 0.75 425 63.546 0.00893396 -3.52674 63.546000 Cu 0.716408 0.413186 0.75 426 63.546 0.00389709 -3.53522 63.546000 Cu 0.80832 0.390748 0.75 433 63.546 0.0416494 -3.55463 63.546000 Cu 0.806953 0.432601 1 463 63.546 0.00876716 -3.53156 63.546000 Cu 0.986883 0.386393 0 471 63.546 0.0113862 -3.50945 63.546000 Cu 0.900098 0.410185 3.43857e-16 472 63.546 0.131523 -3.56738 63.546000 Cu 0.900098 0.410185 0.5 473 63.546 0.131523 -3.56738 63.546000 Cu 0.991857 0.429872 0.25 474 63.546 0.388495 -3.58781 63.546000 Cu 0.0761289 0.405121 0.25 475 63.546 0.0640002 -3.47642 63.546000 Cu 0.806953 0.432601 0.5 476 63.546 0.00876716 -3.53156 63.546000 Cu 0.991857 0.429872 0.75 478 63.546 0.388495 -3.58781 63.546000 Cu 0.16762 0.382173 0.25 482 63.546 0.00664856 -3.5222 63.546000 Cu 0.986883 0.386393 0.5 484 63.546 0.0113862 -3.50945 63.546000 Cu 0.0761289 0.405121 0.75 485 63.546 0.0640002 -3.47642 63.546000 Cu 0.16762 0.382173 0.75 486 63.546 0.00664856 -3.5222 63.546000 Cu 0.257492 0.400848 1 507 63.546 0.0119051 -3.51894 63.546000 Cu 0.16414 0.423584 5.24442e-17 508 63.546 0.27989 -3.42026 63.546000 Cu 0.16414 0.423584 0.5 509 63.546 0.27989 -3.42026 63.546000 Cu 0.347003 0.419465 0.25 511 63.546 0.0156005 -3.5161 63.546000 Cu 0.350337 0.3784 1 516 63.546 0.00186508 -3.53239 63.546000 Cu 0.350337 0.3784 0.5 517 63.546 0.00186508 -3.53239 63.546000 Cu 0.441119 0.397251 0.25 518 63.546 0.00276537 -3.53317 63.546000 Cu 0.257492 0.400848 0.5 519 63.546 0.0119051 -3.51894 63.546000 Cu 0.347003 0.419465 0.75 520 63.546 0.0156005 -3.5161 63.546000 Cu 0.441119 0.397251 0.75 521 63.546 0.00276537 -3.53317 63.546000 Cu 0.41047 0.47809 0.75 20 63.546 5.85266 -3.29566 63.546000 Cu 0.334714 0.459696 0.5 27 63.546 4.8935 -3.26802 63.546000 Cu 0.436173 0.438092 0.5 52 63.546 0.024943 -3.50819 63.546000 Cu 0.436173 0.438092 1.68874e-16 53 63.546 0.024943 -3.50819 63.546000 Cu 0.41047 0.47809 0.25 221 63.546 5.85266 -3.29566 63.546000 Cu 0.266784 0.491449 0.5 224 63.546 6.25459 -3.59354 63.546000 Cu 0.521775 0.457036 0.25 416 63.546 0.0405422 -3.50345 63.546000 Cu 0.521775 0.457036 0.75 418 63.546 0.0405422 -3.50345 63.546000 Cu 0.600992 0.476391 3.055e-18 459 63.546 0.0784115 -3.50499 63.546000 Cu 0.670484 0.496349 0.25 462 63.546 2.7603 -3.60116 63.546000 Cu 0.708027 0.454615 1.12865e-16 464 63.546 0.0201695 -3.51687 63.546000 Cu 0.708027 0.454615 0.5 465 63.546 0.0201695 -3.51687 63.546000 Cu 0.789025 0.474221 0.25 466 63.546 0.124989 -3.53389 63.546000 Cu 0.895435 0.452238 0.25 467 63.546 0.0197308 -3.5395 63.546000 Cu 0.600992 0.476391 0.5 468 63.546 0.0784115 -3.50499 63.546000 Cu 0.670484 0.496349 0.75 469 63.546 2.7603 -3.60116 63.546000 Cu 0.789025 0.474221 0.75 470 63.546 0.124989 -3.53389 63.546000 Cu 0.895435 0.452238 0.75 477 63.546 0.0197308 -3.5395 63.546000 Cu 0.88176 0.49247 0 499 63.546 0.336916 -3.4439 63.546000 Cu 0.0846218 0.449737 2.03667e-18 500 63.546 1.0287 -3.61279 63.546000 Cu 0.986047 0.471585 1.73796e-16 501 63.546 0.0600559 -3.52463 63.546000 Cu 0.986047 0.471585 0.5 502 63.546 0.0600559 -3.52463 63.546000 Cu 0.07633 0.491627 0.25 503 63.546 0.0456514 -3.51424 63.546000 Cu 0.178246 0.470137 0.25 504 63.546 4.83721 -3.64063 63.546000 Cu 0.88176 0.49247 0.5 505 63.546 0.336916 -3.4439 63.546000 Cu 0.07633 0.491627 0.75 506 63.546 0.0456514 -3.51424 63.546000 Cu 0.250816 0.441726 0.25 510 63.546 0.97495 -3.34175 63.546000 Cu 0.0846218 0.449737 0.5 512 63.546 1.0287 -3.61279 63.546000 Cu 0.178246 0.470137 0.75 513 63.546 4.83721 -3.64063 63.546000 Cu 0.250816 0.441726 0.75 514 63.546 0.97495 -3.34175 63.546000 Cu 0.334714 0.459696 1.74644e-16 523 63.546 4.8935 -3.26802 63.546000 Cu 0.266784 0.491449 1.74305e-16 524 63.546 6.25459 -3.59354 63.546000 Cu 0.480097 0.497138 8.09575e-17 460 63.546 8.71973 -3.28184 63.546000 Cu 0.480097 0.497138 0.5 461 63.546 8.71973 -3.28184 63.546000 Cu 0.35675 0.513661 0.25 1 63.546 2.81994 -3.67582 63.546000 Cu 0.35675 0.513661 0.75 2 63.546 2.81994 -3.67582 63.546000 Cu 0.276157 0.534347 1.72777e-16 3 63.546 0.0554599 -3.52564 63.546000 Cu 0.162179 0.512588 1 4 63.546 5.28207 -3.55313 63.546000 Cu 0.162179 0.512588 0.5 5 63.546 5.28207 -3.55313 63.546000 Cu 0.97076 0.51231 0.25 6 63.546 5.31481 -3.48793 63.546000 Cu 0.0880078 0.533122 0.25 7 63.546 0.0609032 -3.51673 63.546000 Cu 0.97076 0.51231 0.75 8 63.546 5.31481 -3.48793 63.546000 Cu 0.379343 0.55705 2.37611e-18 9 63.546 4.56978 -3.60914 63.546000 Cu 0.379343 0.55705 0.5 10 63.546 4.56978 -3.60914 63.546000 Cu 0.193094 0.55482 0.25 11 63.546 0.0355868 -3.5451 63.546000 Cu 0.276157 0.534347 0.5 13 63.546 0.0554599 -3.52564 63.546000 Cu 0.0880078 0.533122 0.75 14 63.546 0.0609032 -3.51673 63.546000 Cu 0.193094 0.55482 0.75 15 63.546 0.0355868 -3.5451 63.546000 Cu 0.781303 0.512446 3.02275e-16 19 63.546 8.84338 -3.18178 63.546000 Cu 0.00468415 0.553151 1.11677e-16 21 63.546 0.0303664 -3.53004 63.546000 Cu 0.899405 0.532285 1.70231e-16 22 63.546 0.125765 -3.47178 63.546000 Cu 0.899405 0.532285 0.5 23 63.546 0.125765 -3.47178 63.546000 Cu 0.707401 0.530828 0.25 24 63.546 5.81708 -3.22308 63.546000 Cu 0.813393 0.551273 0.25 25 63.546 0.0442945 -3.50471 63.546000 Cu 0.781303 0.512446 0.5 26 63.546 8.84338 -3.18178 63.546000 Cu 0.707401 0.530828 0.75 28 63.546 5.81708 -3.22308 63.546000 Cu 0.00468415 0.553151 0.5 34 63.546 0.0303664 -3.53004 63.546000 Cu 0.813393 0.551273 0.75 35 63.546 0.0442945 -3.50471 63.546000 Cu 0.562771 0.518101 5.66872e-17 51 63.546 5.4194 -3.55926 63.546000 Cu 0.617754 0.548251 1 55 63.546 4.99543 -3.38466 63.546000 Cu 0.617754 0.548251 0.5 56 63.546 4.99543 -3.38466 63.546000 Cu 0.462574 0.536699 0.25 57 63.546 4.9899 -3.56876 63.546000 Cu 0.562771 0.518101 0.5 59 63.546 5.4194 -3.55926 63.546000 Cu 0.462574 0.536699 0.75 60 63.546 4.9899 -3.56876 63.546000 Cu 0.29035 0.577265 0.25 12 63.546 0.751464 -3.60613 63.546000 Cu 0.372329 0.602971 0.25 16 63.546 0.180153 -3.43803 63.546000 Cu 0.29035 0.577265 0.75 17 63.546 0.751464 -3.60613 63.546000 Cu 0.372329 0.602971 0.75 18 63.546 0.180153 -3.43803 63.546000 Cu 0.198772 0.597152 1 29 63.546 0.274114 -3.5828 63.546000 Cu 0.104627 0.574796 1 30 63.546 0.0175193 -3.54165 63.546000 Cu 0.104627 0.574796 0.5 31 63.546 0.0175193 -3.54165 63.546000 Cu 0.9165 0.572479 0.25 32 63.546 0.0133875 -3.53276 63.546000 Cu 0.0140929 0.59432 0.25 33 63.546 0.00790933 -3.53822 63.546000 Cu 0.9165 0.572479 0.75 36 63.546 0.0133875 -3.53276 63.546000 Cu 0.28419 0.621498 1 38 63.546 0.0366265 -3.4895 63.546000 Cu 0.28419 0.621498 0.5 39 63.546 0.0366265 -3.4895 63.546000 Cu 0.107069 0.616705 0.25 40 63.546 0.0908819 -3.56426 63.546000 Cu 0.198772 0.597152 0.5 42 63.546 0.274114 -3.5828 63.546000 Cu 0.0140929 0.59432 0.75 43 63.546 0.00790933 -3.53822 63.546000 Cu 0.107069 0.616705 0.75 44 63.546 0.0908819 -3.56426 63.546000 Cu 0.727072 0.569789 1 54 63.546 0.0207706 -3.51178 63.546000 Cu 0.540672 0.566586 0.25 58 63.546 4.75794 -3.32051 63.546000 Cu 0.923353 0.61361 0 61 63.546 0.0033786 -3.53838 63.546000 Cu 0.827899 0.591535 1 62 63.546 0.00607645 -3.53232 63.546000 Cu 0.827899 0.591535 0.5 63 63.546 0.00607645 -3.53232 63.546000 Cu 0.642345 0.588569 0.25 64 63.546 0.0239653 -3.50291 63.546000 Cu 0.738784 0.610554 0.25 65 63.546 0.00427474 -3.53133 63.546000 Cu 0.727072 0.569789 0.5 66 63.546 0.0207706 -3.51178 63.546000 Cu 0.540672 0.566586 0.75 67 63.546 4.75794 -3.32051 63.546000 Cu 0.642345 0.588569 0.75 68 63.546 0.0239653 -3.50291 63.546000 Cu 0.923353 0.61361 0.5 74 63.546 0.0033786 -3.53838 63.546000 Cu 0.738784 0.610554 0.75 75 63.546 0.00427474 -3.53133 63.546000 Cu 0.45852 0.584727 1.31127e-15 95 63.546 0.666757 -3.36562 63.546000 Cu 0.554422 0.607194 8.48611e-18 97 63.546 0.0183573 -3.51173 63.546000 Cu 0.554422 0.607194 0.5 98 63.546 0.0183573 -3.51173 63.546000 Cu 0.45852 0.584727 0.5 100 63.546 0.666757 -3.36562 63.546000 Cu 0.465241 0.625778 0.25 99 63.546 0.0109758 -3.51752 63.546000 Cu 0.465241 0.625778 0.75 107 63.546 0.0109758 -3.51752 63.546000 Cu 0.375497 0.644439 1 37 63.546 0.00534936 -3.52287 63.546000 Cu 0.194847 0.640253 0.25 41 63.546 0.00594481 -3.51611 63.546000 Cu 0.285223 0.663194 0.25 45 63.546 0.00217546 -3.52655 63.546000 Cu 0.376291 0.685872 0.25 46 63.546 0.000484247 -3.53124 63.546000 Cu 0.375497 0.644439 0.5 47 63.546 0.00534936 -3.52287 63.546000 Cu 0.194847 0.640253 0.75 48 63.546 0.00594481 -3.51611 63.546000 Cu 0.285223 0.663194 0.75 49 63.546 0.00217546 -3.52655 63.546000 Cu 0.376291 0.685872 0.75 50 63.546 0.000484247 -3.53124 63.546000 Cu 0.104463 0.65913 0 69 63.546 0.00128222 -3.52779 63.546000 Cu 0.0155756 0.636033 0 70 63.546 0.0298003 -3.5527 63.546000 Cu 0.0155756 0.636033 0.5 71 63.546 0.0298003 -3.5527 63.546000 Cu 0.832385 0.632761 0.25 72 63.546 0.00166709 -3.53729 63.546000 Cu 0.924039 0.655203 0.25 73 63.546 0.00952833 -3.54447 63.546000 Cu 0.832385 0.632761 0.75 76 63.546 0.00166709 -3.53729 63.546000 Cu 0.194594 0.68201 1.71759e-16 78 63.546 0.000689758 -3.52922 63.546000 Cu 0.194594 0.68201 0.5 79 63.546 0.000689758 -3.52922 63.546000 Cu 0.013554 0.678068 0.25 80 63.546 0.000562363 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63.546 1.12944e-05 -3.53327 63.546000 Cu 0.103222 0.784056 0.75 132 63.546 4.49376e-05 -3.53264 63.546000 Cu 0.375475 0.81061 0.5 135 63.546 0.000182261 -3.53532 63.546000 Cu 0.193907 0.806773 0.75 136 63.546 5.23495e-05 -3.53336 63.546000 Cu 0.921433 0.780264 5.22745e-17 149 63.546 2.12647e-05 -3.53305 63.546000 Cu 0.830797 0.757592 1.5275e-18 150 63.546 2.27847e-05 -3.5347 63.546000 Cu 0.830797 0.757592 0.5 151 63.546 2.27847e-05 -3.5347 63.546000 Cu 0.649009 0.753815 0.25 152 63.546 6.71192e-06 -3.53568 63.546000 Cu 0.739522 0.776495 0.25 153 63.546 3.13546e-05 -3.53456 63.546000 Cu 0.649009 0.753815 0.75 156 63.546 6.71192e-06 -3.53568 63.546000 Cu 0.0122481 0.80294 1 158 63.546 9.92891e-05 -3.53321 63.546000 Cu 0.0122481 0.80294 0.5 159 63.546 9.92891e-05 -3.53321 63.546000 Cu 0.830331 0.799152 0.25 160 63.546 7.58493e-05 -3.53441 63.546000 Cu 0.921433 0.780264 0.5 162 63.546 2.12647e-05 -3.53305 63.546000 Cu 0.739522 0.776495 0.75 163 63.546 3.13546e-05 -3.53456 63.546000 Cu 0.830331 0.799152 0.75 164 63.546 7.58493e-05 -3.53441 63.546000 Cu 0.648319 0.795413 0 184 63.546 6.38785e-05 -3.53515 63.546000 Cu 0.557684 0.772742 3.47422e-16 185 63.546 2.6421e-05 -3.53534 63.546000 Cu 0.557684 0.772742 0.5 186 63.546 2.6421e-05 -3.53534 63.546000 Cu 0.466517 0.791675 0.25 187 63.546 0.000104808 -3.53476 63.546000 Cu 0.648319 0.795413 0.5 194 63.546 6.38785e-05 -3.53515 63.546000 Cu 0.466517 0.791675 0.75 195 63.546 0.000104808 -3.53476 63.546000 Cu 0.28444 0.829552 0.25 133 63.546 0.000289865 -3.53493 63.546000 Cu 0.374802 0.852346 0.25 134 63.546 0.00373721 -3.54333 63.546000 Cu 0.28444 0.829552 0.75 137 63.546 0.000289865 -3.53493 63.546000 Cu 0.374802 0.852346 0.75 138 63.546 0.00373721 -3.54333 63.546000 Cu 0.103114 0.825671 1 157 63.546 0.000214377 -3.53181 63.546000 Cu 0.921433 0.821818 0.25 161 63.546 0.000267097 -3.53235 63.546000 Cu 0.283337 0.871452 1 165 63.546 0.0126792 -3.54745 63.546000 Cu 0.193596 0.848507 3.39614e-16 166 63.546 0.000558261 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-3.52552 63.546000 Cu 0.922358 0.863377 0.5 199 63.546 0.00238814 -3.52552 63.546000 Cu 0.740376 0.85952 0.25 200 63.546 0.00128426 -3.53174 63.546000 Cu 0.830843 0.840675 0.5 202 63.546 0.00073235 -3.53059 63.546000 Cu 0.648499 0.836967 0.75 203 63.546 0.000192125 -3.5337 63.546000 Cu 0.740376 0.85952 0.75 204 63.546 0.00128426 -3.53174 63.546000 Cu 0.557555 0.855884 3.41142e-16 225 63.546 0.000443249 -3.53584 63.546000 Cu 0.466126 0.833328 4.39581e-17 226 63.546 0.000928628 -3.53932 63.546000 Cu 0.466126 0.833328 0.5 227 63.546 0.000928628 -3.53932 63.546000 Cu 0.46632 0.874858 0.25 231 63.546 0.000858082 -3.53679 63.546000 Cu 0.557555 0.855884 0.5 233 63.546 0.000443249 -3.53584 63.546000 Cu 0.46632 0.874858 0.75 234 63.546 0.000858082 -3.53679 63.546000 Cu 0.374999 0.893913 4.54856e-17 173 63.546 0.00189717 -3.53629 63.546000 Cu 0.374999 0.893913 0.5 174 63.546 0.00189717 -3.53629 63.546000 Cu 0.191796 0.8907 0.25 175 63.546 0.0420228 -3.55506 63.546000 Cu 0.283713 0.913125 0.25 176 63.546 0.0037838 -3.53467 63.546000 Cu 0.191796 0.8907 0.75 179 63.546 0.0420228 -3.55506 63.546000 Cu 0.378654 0.935199 0.25 180 63.546 0.00877958 -3.52675 63.546000 Cu 0.283713 0.913125 0.75 181 63.546 0.0037838 -3.53467 63.546000 Cu 0.378654 0.935199 0.75 182 63.546 0.00877958 -3.52675 63.546000 Cu 0.0131599 0.886345 1 197 63.546 0.0116409 -3.50948 63.546000 Cu 0.83238 0.882142 0.25 201 63.546 0.00571641 -3.52215 63.546000 Cu 0.19321 0.932535 1 205 63.546 0.00838812 -3.53178 63.546000 Cu 0.100037 0.910132 1 206 63.546 0.13227 -3.56748 63.546000 Cu 0.100037 0.910132 0.5 207 63.546 0.13227 -3.56748 63.546000 Cu 0.923989 0.905066 0.25 208 63.546 0.0657152 -3.47596 63.546000 Cu 0.008209 0.929817 0.25 209 63.546 0.393277 -3.58849 63.546000 Cu 0.0131599 0.886345 0.5 210 63.546 0.0116409 -3.50948 63.546000 Cu 0.83238 0.882142 0.75 211 63.546 0.00571641 -3.52215 63.546000 Cu 0.923989 0.905066 0.75 212 63.546 0.0657152 -3.47596 63.546000 Cu 0.19321 0.932535 0.5 218 63.546 0.00838812 -3.53178 63.546000 Cu 0.008209 0.929817 0.75 219 63.546 0.393277 -3.58849 63.546000 Cu 0.74256 0.900805 1 228 63.546 0.0107813 -3.51851 63.546000 Cu 0.649689 0.87835 3.71352e-16 229 63.546 0.00206806 -3.53297 63.546000 Cu 0.649689 0.87835 0.5 230 63.546 0.00206806 -3.53297 63.546000 Cu 0.558973 0.897189 0.25 232 63.546 0.00292725 -3.53301 63.546000 Cu 0.835923 0.923519 2.67788e-15 236 63.546 0.284007 -3.42089 63.546000 Cu 0.835923 0.923519 0.5 237 63.546 0.284007 -3.42089 63.546000 Cu 0.652942 0.919409 0.25 238 63.546 0.0150155 -3.5158 63.546000 Cu 0.74256 0.900805 0.5 240 63.546 0.0107813 -3.51851 63.546000 Cu 0.558973 0.897189 0.75 241 63.546 0.00292725 -3.53301 63.546000 Cu 0.652942 0.919409 0.75 242 63.546 0.0150155 -3.5158 63.546000 Cu 0.468289 0.916103 1 253 63.546 0.00465271 -3.53178 63.546000 Cu 0.468289 0.916103 0.5 258 63.546 0.00465271 -3.53178 63.546000 Cu 0.520087 0.997084 3.07707e-16 266 63.546 8.72254 -3.28186 63.546000 Cu 0.520087 0.997084 0.5 267 63.546 8.72254 -3.28186 63.546000 Cu 0.32968 0.996278 0.25 323 63.546 2.76771 -3.60064 63.546000 Cu 0.32968 0.996278 0.75 326 63.546 2.76771 -3.60064 63.546000 Cu 0.399073 0.976335 9.70472e-16 213 63.546 0.0796578 -3.50419 63.546000 Cu 0.292114 0.954553 1 214 63.546 0.019836 -3.51717 63.546000 Cu 0.292114 0.954553 0.5 215 63.546 0.019836 -3.51717 63.546000 Cu 0.104675 0.952168 0.25 216 63.546 0.0195704 -3.54028 63.546000 Cu 0.211052 0.974153 0.25 217 63.546 0.126118 -3.53359 63.546000 Cu 0.104675 0.952168 0.75 220 63.546 0.0195704 -3.54028 63.546000 Cu 0.399073 0.976335 0.5 222 63.546 0.0796578 -3.50419 63.546000 Cu 0.211052 0.974153 0.75 223 63.546 0.126118 -3.53359 63.546000 Cu 0.91532 0.94967 1 235 63.546 1.03561 -3.61414 63.546000 Cu 0.74913 0.941653 0.25 239 63.546 0.982931 -3.34083 63.546000 Cu 0.11825 0.992387 1 243 63.546 0.34273 -3.44329 63.546000 Cu 0.0140026 0.971504 5.26139e-16 244 63.546 0.0625446 -3.52369 63.546000 Cu 0.0140026 0.971504 0.5 245 63.546 0.0625446 -3.52369 63.546000 Cu 0.821889 0.970086 0.25 246 63.546 4.84229 -3.63898 63.546000 Cu 0.92376 0.991548 0.25 247 63.546 0.045247 -3.51356 63.546000 Cu 0.91532 0.94967 0.5 248 63.546 1.03561 -3.61414 63.546000 Cu 0.74913 0.941653 0.75 249 63.546 0.982931 -3.34083 63.546000 Cu 0.821889 0.970086 0.75 250 63.546 4.84229 -3.63898 63.546000 Cu 0.11825 0.992387 0.5 251 63.546 0.34273 -3.44329 63.546000 Cu 0.92376 0.991548 0.75 252 63.546 0.045247 -3.51356 63.546000 Cu 0.665442 0.95964 1 254 63.546 4.88917 -3.27008 63.546000 Cu 0.563903 0.938043 1 255 63.546 0.0235272 -3.50673 63.546000 Cu 0.563903 0.938043 0.5 256 63.546 0.0235272 -3.50673 63.546000 Cu 0.478301 0.956976 0.25 257 63.546 0.0409682 -3.50355 63.546000 Cu 0.733275 0.991388 0 259 63.546 6.25479 -3.59376 63.546000 Cu 0.733275 0.991388 0.5 260 63.546 6.25479 -3.59376 63.546000 Cu 0.58955 0.978031 0.25 261 63.546 5.8542 -3.2961 63.546000 Cu 0.665442 0.95964 0.5 262 63.546 4.88917 -3.27008 63.546000 Cu 0.478301 0.956976 0.75 263 63.546 0.0409682 -3.50355 63.546000 Cu 0.58955 0.978031 0.75 264 63.546 5.8542 -3.2961