Number of particles = 588 A = 1 Angstrom (basic length-scale) H0(1,1) = 21.9603 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 87.6723 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62305 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 0.0424247 0.0123845 1.41247e-17 317 63.546 7.96533 -3.47428 63.546000 Cu 0.13792 0.0339124 4.78802e-19 318 63.546 0.430108 -3.47878 63.546000 Cu 0.126489 0.0118943 0.5 319 63.546 1.83294 -3.51828 63.546000 Cu 0.0657678 0.0381389 0.5 320 63.546 0.821028 -3.42646 63.546000 Cu 0.211792 0.0119215 0 321 63.546 0.346535 -3.53077 63.546000 Cu 0.216389 0.0328063 0.5 324 63.546 0.333409 -3.5291 63.546000 Cu 0.298795 0.0319242 1 322 63.546 0.426716 -3.502 63.546000 Cu 0.293655 0.011927 0.5 323 63.546 0.639785 -3.51635 63.546000 Cu 0.373683 0.0119692 1 325 63.546 6.40488 -3.22602 63.546000 Cu 0.388104 0.0292539 0.5 328 63.546 4.05377 -3.44319 63.546000 Cu 0.542425 0.0123845 0.5 299 63.546 7.96533 -3.47428 63.546000 Cu 0.565768 0.0381389 0 305 63.546 0.821028 -3.42646 63.546000 Cu 0.47062 0.0253396 0 326 63.546 9.12003 -3.27744 63.546000 Cu 0.485481 0.0437556 0.5 351 63.546 0.785686 -3.45483 63.546000 Cu 0.626489 0.0118943 4.78802e-19 298 63.546 1.83294 -3.51828 63.546000 Cu 0.793655 0.011927 1 300 63.546 0.639785 -3.51635 63.546000 Cu 0.711792 0.0119215 0.5 301 63.546 0.346535 -3.53077 63.546000 Cu 0.63792 0.0339124 0.5 307 63.546 0.430108 -3.47878 63.546000 Cu 0.716389 0.0328063 0 309 63.546 0.333409 -3.5291 63.546000 Cu 0.798795 0.0319242 0.5 311 63.546 0.426716 -3.502 63.546000 Cu 0.873683 0.0119692 0.5 303 63.546 6.40488 -3.22602 63.546000 Cu 0.888104 0.0292539 1 313 63.546 4.05377 -3.44319 63.546000 Cu 0.985481 0.0437556 0 314 63.546 0.785686 -3.45483 63.546000 Cu 0.97062 0.0253396 0.5 315 63.546 9.12003 -3.27744 63.546000 Cu 0.0768749 0.0597887 4.78802e-19 341 63.546 0.130437 -3.51416 63.546000 Cu 0.166996 0.0776951 3.7586e-17 342 63.546 0.0441516 -3.52531 63.546000 Cu 0.153229 0.056584 0.5 343 63.546 0.0682731 -3.50341 63.546000 Cu 0.0874113 0.0806535 0.5 344 63.546 0.0121478 -3.53456 63.546000 Cu 0.00685995 0.0836572 0 338 63.546 0.0143532 -3.54466 63.546000 Cu 0.230106 0.0538183 4.78802e-19 345 63.546 0.175787 -3.52339 63.546000 Cu 0.327986 0.0707539 0 346 63.546 0.0257074 -3.54102 63.546000 Cu 0.312998 0.0510439 0.5 347 63.546 0.105119 -3.53746 63.546000 Cu 0.246618 0.0742795 0.5 348 63.546 0.0257413 -3.53459 63.546000 Cu 0.39805 0.0479635 1 349 63.546 0.0510648 -3.5226 63.546000 Cu 0.343349 0.0906944 0.5 373 63.546 0.00656475 -3.54213 63.546000 Cu 0.411998 0.0670672 0.5 352 63.546 0.0343146 -3.54288 63.546000 Cu 0.425198 0.0870108 0 375 63.546 0.0219167 -3.54606 63.546000 Cu 0.576875 0.0597887 0.5 308 63.546 0.130437 -3.51416 63.546000 Cu 0.587411 0.0806535 0 329 63.546 0.0121478 -3.53456 63.546000 Cu 0.495775 0.0632936 4.78802e-19 350 63.546 0.0847023 -3.54249 63.546000 Cu 0.50686 0.0836572 0.5 377 63.546 0.0143532 -3.54466 63.546000 Cu 0.653229 0.056584 7.18203e-19 306 63.546 0.0682731 -3.50341 63.546000 Cu 0.730106 0.0538183 0.5 312 63.546 0.175787 -3.52339 63.546000 Cu 0.666996 0.0776951 0.5 331 63.546 0.0441516 -3.52531 63.546000 Cu 0.746618 0.0742795 0 333 63.546 0.0257413 -3.53459 63.546000 Cu 0.812998 0.0510439 1 310 63.546 0.105119 -3.53746 63.546000 Cu 0.89805 0.0479635 0.5 316 63.546 0.0510648 -3.5226 63.546000 Cu 0.827986 0.0707539 0.5 335 63.546 0.0257074 -3.54102 63.546000 Cu 0.911998 0.0670672 1 337 63.546 0.0343146 -3.54288 63.546000 Cu 0.995775 0.0632936 0.5 339 63.546 0.0847023 -3.54249 63.546000 Cu 0.925198 0.0870108 0.5 340 63.546 0.0219167 -3.54606 63.546000 Cu 0.843349 0.0906944 4.78802e-19 334 63.546 0.00656475 -3.54213 63.546000 Cu 0.0320187 0.124705 0 364 63.546 0.0019742 -3.53882 63.546000 Cu 0.0996121 0.101167 2.87281e-17 367 63.546 0.00678649 -3.53737 63.546000 Cu 0.194387 0.118111 6.03291e-17 368 63.546 0.0015915 -3.53935 63.546000 Cu 0.180623 0.0979897 0.5 369 63.546 0.0111273 -3.53561 63.546000 Cu 0.112941 0.121473 0.5 370 63.546 0.00363505 -3.53894 63.546000 Cu 0.0189358 0.104208 0.5 365 63.546 0.0023381 -3.54033 63.546000 Cu 0.261823 0.0944653 0 371 63.546 0.00395587 -3.53692 63.546000 Cu 0.357443 0.110914 1.19701e-18 372 63.546 0.00535715 -3.54115 63.546000 Cu 0.276082 0.114555 0.5 374 63.546 0.0016682 -3.53983 63.546000 Cu 0.289675 0.13474 3.90224e-17 397 63.546 0.00178704 -3.54097 63.546000 Cu 0.370796 0.131288 0.5 399 63.546 0.00180478 -3.54033 63.546000 Cu 0.599612 0.101167 0.5 332 63.546 0.00678649 -3.53737 63.546000 Cu 0.532019 0.124705 0.5 354 63.546 0.0019742 -3.53882 63.546000 Cu 0.518936 0.104208 0 376 63.546 0.0023381 -3.54033 63.546000 Cu 0.438338 0.107431 0.5 378 63.546 0.00482257 -3.54185 63.546000 Cu 0.451456 0.127941 4.78802e-19 401 63.546 0.000387904 -3.53938 63.546000 Cu 0.612941 0.121473 0 355 63.546 0.00363505 -3.53894 63.546000 Cu 0.680623 0.0979897 0 330 63.546 0.0111273 -3.53561 63.546000 Cu 0.761823 0.0944653 0.5 336 63.546 0.00395587 -3.53692 63.546000 Cu 0.694387 0.118111 0.5 357 63.546 0.0015915 -3.53935 63.546000 Cu 0.776082 0.114555 6.10473e-17 359 63.546 0.0016682 -3.53983 63.546000 Cu 0.789675 0.13474 0.5 362 63.546 0.00178704 -3.54097 63.546000 Cu 0.870796 0.131288 0 360 63.546 0.00180478 -3.54033 63.546000 Cu 0.857443 0.110914 0.5 361 63.546 0.00535715 -3.54115 63.546000 Cu 0.938338 0.107431 3.2798e-17 363 63.546 0.00482257 -3.54185 63.546000 Cu 0.951456 0.127941 0.5 366 63.546 0.000387904 -3.53938 63.546000 Cu 0.059358 0.165357 0 390 63.546 0.000227464 -3.5395 63.546000 Cu 0.045597 0.145073 0.5 391 63.546 0.0012827 -3.53892 63.546000 Cu 0.126737 0.141697 8.97754e-17 393 63.546 0.000707099 -3.53974 63.546000 Cu 0.140606 0.161928 0.5 396 63.546 0.000108425 -3.54025 63.546000 Cu 0.221874 0.158477 0 394 63.546 0.000532462 -3.54096 63.546000 Cu 0.208207 0.138244 0.5 395 63.546 0.000347677 -3.54065 63.546000 Cu 0.383999 0.151694 4.78802e-19 398 63.546 0.000186397 -3.53982 63.546000 Cu 0.303062 0.155056 0.5 400 63.546 0.000659575 -3.5408 63.546000 Cu 0.235404 0.178797 0.5 419 63.546 0.000186665 -3.54047 63.546000 Cu 0.316414 0.175413 7.18203e-19 421 63.546 9.65089e-05 -3.54007 63.546000 Cu 0.397333 0.17208 0.5 423 63.546 0.000151618 -3.53949 63.546000 Cu 0.545597 0.145073 2.39401e-19 353 63.546 0.0012827 -3.53892 63.546000 Cu 0.559358 0.165357 0.5 380 63.546 0.000227464 -3.5395 63.546000 Cu 0.464776 0.14839 0.5 402 63.546 0.00051109 -3.53896 63.546000 Cu 0.478279 0.168743 2.39401e-19 425 63.546 0.000471127 -3.53919 63.546000 Cu 0.708207 0.138244 0 356 63.546 0.000347677 -3.54065 63.546000 Cu 0.626737 0.141697 0.5 358 63.546 0.000707099 -3.53974 63.546000 Cu 0.640606 0.161928 0 381 63.546 0.000108425 -3.54025 63.546000 Cu 0.735404 0.178797 2.39401e-19 382 63.546 0.000186665 -3.54047 63.546000 Cu 0.721874 0.158477 0.5 383 63.546 0.000532462 -3.54096 63.546000 Cu 0.803062 0.155056 1.45556e-16 385 63.546 0.000659575 -3.5408 63.546000 Cu 0.816414 0.175413 0.5 388 63.546 9.65089e-05 -3.54007 63.546000 Cu 0.897333 0.17208 0 386 63.546 0.000151618 -3.53949 63.546000 Cu 0.883999 0.151694 0.5 387 63.546 0.000186397 -3.53982 63.546000 Cu 0.964776 0.14839 5.14712e-17 389 63.546 0.00051109 -3.53896 63.546000 Cu 0.978279 0.168743 0.5 392 63.546 0.000471127 -3.53919 63.546000 Cu 0.0867201 0.205933 1.58005e-17 414 63.546 2.14632e-05 -3.54026 63.546000 Cu 0.0731042 0.185628 0.5 415 63.546 4.61151e-05 -3.54008 63.546000 Cu 0.154272 0.182205 0 417 63.546 0.000158579 -3.54036 63.546000 Cu 0.167808 0.20253 0.5 420 63.546 3.96357e-05 -3.54026 63.546000 Cu 0.100316 0.226252 0.5 441 63.546 1.86298e-05 -3.54018 63.546000 Cu 0.181413 0.222862 0 443 63.546 2.35642e-05 -3.54008 63.546000 Cu 0.00558888 0.209339 0.5 416 63.546 8.97689e-06 -3.54008 63.546000 Cu 0.248855 0.199134 0 418 63.546 6.09697e-05 -3.54 63.546000 Cu 0.329843 0.195772 0.5 424 63.546 3.94103e-05 -3.53972 63.546000 Cu 0.262418 0.219484 0.5 445 63.546 2.67817e-05 -3.5398 63.546000 Cu 0.343391 0.216113 2.37007e-17 447 63.546 8.05837e-05 -3.53967 63.546000 Cu 0.41086 0.192418 1.81945e-17 422 63.546 0.000118473 -3.53962 63.546000 Cu 0.424446 0.212737 0.5 449 63.546 6.20193e-05 -3.5398 63.546000 Cu 0.573104 0.185628 0 379 63.546 4.61151e-05 -3.54008 63.546000 Cu 0.58672 0.205933 0.5 404 63.546 2.14632e-05 -3.54026 63.546000 Cu 0.491927 0.189041 0.5 426 63.546 9.11571e-05 -3.53977 63.546000 Cu 0.505589 0.209339 0 451 63.546 8.97689e-06 -3.54008 63.546000 Cu 0.600316 0.226252 1.48429e-17 403 63.546 1.86298e-05 -3.54018 63.546000 Cu 0.654272 0.182205 0.5 384 63.546 0.000158579 -3.54036 63.546000 Cu 0.667808 0.20253 0 405 63.546 3.96357e-05 -3.54026 63.546000 Cu 0.762418 0.219484 0 406 63.546 2.67817e-05 -3.5398 63.546000 Cu 0.748855 0.199134 0.5 407 63.546 6.09697e-05 -3.54 63.546000 Cu 0.681413 0.222862 0.5 408 63.546 2.35642e-05 -3.54008 63.546000 Cu 0.829843 0.195772 5.98503e-18 409 63.546 3.94103e-05 -3.53972 63.546000 Cu 0.924446 0.212737 7.30173e-17 410 63.546 6.20193e-05 -3.5398 63.546000 Cu 0.91086 0.192418 0.5 411 63.546 0.000118473 -3.53962 63.546000 Cu 0.843391 0.216113 0.5 412 63.546 8.05837e-05 -3.53967 63.546000 Cu 0.991927 0.189041 2.20249e-17 413 63.546 9.11571e-05 -3.53977 63.546000 Cu 0.113979 0.246575 2.39401e-19 440 63.546 4.72552e-05 -3.54008 63.546000 Cu 0.0329358 0.249978 0.5 442 63.546 9.88205e-06 -3.54015 63.546000 Cu 0.195076 0.243191 0.5 446 63.546 1.44276e-05 -3.53993 63.546000 Cu 0.0467318 0.270309 4.2374e-17 465 63.546 2.50322e-05 -3.53999 63.546000 Cu 0.127764 0.266903 0.5 467 63.546 3.38479e-05 -3.53995 63.546000 Cu 0.0191848 0.22965 8.37904e-18 439 63.546 6.8667e-05 -3.54015 63.546000 Cu 0.208777 0.263523 2.39401e-19 469 63.546 1.89719e-05 -3.53989 63.546000 Cu 0.276112 0.239823 0 444 63.546 9.24017e-06 -3.53973 63.546000 Cu 0.357099 0.236448 0.5 450 63.546 2.80555e-05 -3.53981 63.546000 Cu 0.289823 0.260155 0.5 471 63.546 3.37755e-06 -3.53988 63.546000 Cu 0.370883 0.256781 0 473 63.546 2.65107e-05 -3.53995 63.546000 Cu 0.532936 0.249978 8.30722e-17 427 63.546 9.88205e-06 -3.54015 63.546000 Cu 0.546732 0.270309 0.5 430 63.546 2.50322e-05 -3.53999 63.546000 Cu 0.43811 0.23305 3.80648e-17 448 63.546 6.91044e-05 -3.54003 63.546000 Cu 0.519185 0.22965 0.5 452 63.546 6.8667e-05 -3.54015 63.546000 Cu 0.451903 0.253388 0.5 475 63.546 1.21849e-05 -3.54014 63.546000 Cu 0.613979 0.246575 0.5 429 63.546 4.72552e-05 -3.54008 63.546000 Cu 0.627764 0.266903 8.30722e-17 428 63.546 3.38479e-05 -3.53995 63.546000 Cu 0.695076 0.243191 4.81196e-17 431 63.546 1.44276e-05 -3.53993 63.546000 Cu 0.789823 0.260155 0 432 63.546 3.37755e-06 -3.53988 63.546000 Cu 0.776112 0.239823 0.5 433 63.546 9.24017e-06 -3.53973 63.546000 Cu 0.708777 0.263523 0.5 434 63.546 1.89719e-05 -3.53989 63.546000 Cu 0.857099 0.236448 0 435 63.546 2.80555e-05 -3.53981 63.546000 Cu 0.951903 0.253388 1.84339e-17 436 63.546 1.21849e-05 -3.54014 63.546000 Cu 0.93811 0.23305 0.5 437 63.546 6.91044e-05 -3.54003 63.546000 Cu 0.870883 0.256781 0.5 438 63.546 2.65107e-05 -3.53995 63.546000 Cu 0.141497 0.287244 1.22813e-16 466 63.546 4.39961e-05 -3.53984 63.546000 Cu 0.0604336 0.290638 0.5 468 63.546 2.60403e-05 -3.54005 63.546000 Cu 0.0741054 0.31097 4.78802e-19 489 63.546 5.92045e-05 -3.53995 63.546000 Cu 0.155144 0.307589 0.5 491 63.546 4.73601e-05 -3.53973 63.546000 Cu 0.222517 0.283867 0.5 472 63.546 2.83501e-05 -3.53986 63.546000 Cu 0.30354 0.280497 4.78802e-19 470 63.546 2.15613e-05 -3.53995 63.546000 Cu 0.384572 0.277117 0.5 476 63.546 2.06753e-05 -3.54001 63.546000 Cu 0.236148 0.304227 4.78802e-19 493 63.546 7.93212e-06 -3.53988 63.546000 Cu 0.317158 0.300853 0.5 495 63.546 2.46759e-05 -3.54004 63.546000 Cu 0.398224 0.297456 8.42692e-17 497 63.546 2.03178e-05 -3.54021 63.546000 Cu 0.411847 0.3178 0.5 500 63.546 3.68821e-05 -3.54034 63.546000 Cu 0.560434 0.290638 0 453 63.546 2.60403e-05 -3.54005 63.546000 Cu 0.574105 0.31097 0.5 456 63.546 5.92045e-05 -3.53995 63.546000 Cu 0.465664 0.273718 3.66284e-17 474 63.546 2.69518e-05 -3.54004 63.546000 Cu 0.492969 0.314378 4.78802e-19 498 63.546 7.74647e-06 -3.54024 63.546000 Cu 0.479329 0.294048 0.5 499 63.546 6.11361e-06 -3.54021 63.546000 Cu 0.655144 0.307589 4.78802e-19 454 63.546 4.73601e-05 -3.53973 63.546000 Cu 0.641497 0.287244 0.5 455 63.546 4.39961e-05 -3.53984 63.546000 Cu 0.722517 0.283867 0 457 63.546 2.83501e-05 -3.53986 63.546000 Cu 0.736148 0.304227 0.5 460 63.546 7.93212e-06 -3.53988 63.546000 Cu 0.817158 0.300853 4.78802e-19 458 63.546 2.46759e-05 -3.54004 63.546000 Cu 0.80354 0.280497 0.5 459 63.546 2.15613e-05 -3.53995 63.546000 Cu 0.884572 0.277117 1.46035e-17 461 63.546 2.06753e-05 -3.54001 63.546000 Cu 0.979329 0.294048 1.00548e-17 462 63.546 6.11361e-06 -3.54021 63.546000 Cu 0.965664 0.273718 0.5 463 63.546 2.69518e-05 -3.54004 63.546000 Cu 0.898224 0.297456 0.5 464 63.546 2.03178e-05 -3.54021 63.546000 Cu 0.911847 0.3178 3.92618e-17 485 63.546 3.68821e-05 -3.54034 63.546000 Cu 0.992969 0.314378 0.5 487 63.546 7.74647e-06 -3.54024 63.546000 Cu 0.168738 0.32795 2.39401e-19 490 63.546 4.78345e-05 -3.53967 63.546000 Cu 0.0877505 0.331301 0.5 492 63.546 0.00020127 -3.53963 63.546000 Cu 0.10129 0.351659 0 515 63.546 0.000242503 -3.53949 63.546000 Cu 0.182216 0.348331 0.5 517 63.546 6.04651e-05 -3.53993 63.546000 Cu 0.00664429 0.334696 0 486 63.546 6.54158e-05 -3.53983 63.546000 Cu 0.0202989 0.355011 0.5 513 63.546 0.000421063 -3.53924 63.546000 Cu 0.330753 0.321214 4.78802e-19 494 63.546 7.99495e-05 -3.54034 63.546000 Cu 0.249739 0.324599 0.5 496 63.546 5.78925e-05 -3.54008 63.546000 Cu 0.263205 0.344972 0 519 63.546 0.000245648 -3.54043 63.546000 Cu 0.357911 0.361858 0 520 63.546 0.00019682 -3.54027 63.546000 Cu 0.34433 0.341562 0.5 521 63.546 0.000198797 -3.54041 63.546000 Cu 0.425494 0.338123 5.50623e-17 523 63.546 3.47684e-05 -3.54005 63.546000 Cu 0.587751 0.331301 2.39401e-19 477 63.546 0.00020127 -3.53963 63.546000 Cu 0.520299 0.355011 5.50623e-18 524 63.546 0.000421063 -3.53924 63.546000 Cu 0.506644 0.334696 0.5 525 63.546 6.54158e-05 -3.53983 63.546000 Cu 0.439192 0.358412 0.5 526 63.546 0.000189733 -3.53948 63.546000 Cu 0.60129 0.351659 0.5 480 63.546 0.000242503 -3.53949 63.546000 Cu 0.682216 0.348331 0 478 63.546 6.04651e-05 -3.53993 63.546000 Cu 0.668738 0.32795 0.5 479 63.546 4.78345e-05 -3.53967 63.546000 Cu 0.749739 0.324599 0 481 63.546 5.78925e-05 -3.54008 63.546000 Cu 0.763205 0.344972 0.5 484 63.546 0.000245648 -3.54043 63.546000 Cu 0.84433 0.341562 0 482 63.546 0.000198797 -3.54041 63.546000 Cu 0.830753 0.321214 0.5 483 63.546 7.99495e-05 -3.54034 63.546000 Cu 0.925494 0.338123 0.5 488 63.546 3.47684e-05 -3.54005 63.546000 Cu 0.857911 0.361858 0.5 509 63.546 0.00019682 -3.54027 63.546000 Cu 0.939192 0.358412 0 511 63.546 0.000189733 -3.53948 63.546000 Cu 0.033854 0.375376 0 512 63.546 0.000734879 -3.53894 63.546000 Cu 0.195533 0.368725 0 516 63.546 0.0006655 -3.54062 63.546000 Cu 0.114651 0.372066 0.5 518 63.546 0.00014591 -3.53969 63.546000 Cu 0.0472639 0.395851 0.5 539 63.546 0.000442482 -3.53936 63.546000 Cu 0.127827 0.392516 0 541 63.546 0.00178832 -3.54023 63.546000 Cu 0.208852 0.389074 0.5 543 63.546 0.00223163 -3.54085 63.546000 Cu 0.276668 0.365318 0.5 522 63.546 0.000749704 -3.54088 63.546000 Cu 0.290294 0.385572 0 545 63.546 0.000494077 -3.54075 63.546000 Cu 0.385655 0.40233 1.05815e-16 546 63.546 0.00354018 -3.53915 63.546000 Cu 0.371788 0.382105 0.5 547 63.546 0.000560184 -3.54001 63.546000 Cu 0.304105 0.405717 0.5 548 63.546 0.00123555 -3.5394 63.546000 Cu 0.547264 0.395851 0 501 63.546 0.000442482 -3.53936 63.546000 Cu 0.533854 0.375376 0.5 502 63.546 0.000734879 -3.53894 63.546000 Cu 0.452958 0.378706 0 549 63.546 0.00124278 -3.53907 63.546000 Cu 0.46673 0.399083 0.5 550 63.546 0.00307077 -3.53891 63.546000 Cu 0.614651 0.372066 0 503 63.546 0.00014591 -3.53969 63.546000 Cu 0.708852 0.389074 0 504 63.546 0.00223163 -3.54085 63.546000 Cu 0.695533 0.368725 0.5 505 63.546 0.0006655 -3.54062 63.546000 Cu 0.627827 0.392516 0.5 506 63.546 0.00178832 -3.54023 63.546000 Cu 0.776668 0.365318 2.94463e-17 507 63.546 0.000749704 -3.54088 63.546000 Cu 0.790294 0.385572 0.5 510 63.546 0.000494077 -3.54075 63.546000 Cu 0.804105 0.405717 0 533 63.546 0.00123555 -3.5394 63.546000 Cu 0.871788 0.382105 0 508 63.546 0.000560184 -3.54001 63.546000 Cu 0.952958 0.378706 0.5 514 63.546 0.00124278 -3.53907 63.546000 Cu 0.885655 0.40233 0.5 535 63.546 0.00354018 -3.53915 63.546000 Cu 0.96673 0.399083 0 537 63.546 0.00307077 -3.53891 63.546000 Cu 0.0604295 0.416414 0 538 63.546 0.005408 -3.54173 63.546000 Cu 0.141222 0.412938 0.5 544 63.546 0.0058441 -3.54089 63.546000 Cu 0.0736123 0.43685 0.5 563 63.546 0.0210641 -3.54579 63.546000 Cu 0.15541 0.433201 7.18203e-19 565 63.546 0.00747615 -3.54199 63.546000 Cu 0.170844 0.453185 0.5 568 63.546 0.0246113 -3.54155 63.546000 Cu 0.222463 0.409295 0 542 63.546 0.00232236 -3.53969 63.546000 Cu 0.252221 0.449613 0 566 63.546 0.0229948 -3.53507 63.546000 Cu 0.236818 0.429408 0.5 567 63.546 0.00340981 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63.546000 Cu 0.899099 0.42261 1 534 63.546 0.00854799 -3.53738 63.546000 Cu 0.979828 0.419593 0.5 540 63.546 0.00222019 -3.54029 63.546000 Cu 0.831908 0.446111 1.20419e-16 557 63.546 0.0474942 -3.52544 63.546000 Cu 0.911469 0.443132 0.5 559 63.546 0.01296 -3.53445 63.546000 Cu 0.991945 0.440172 0 561 63.546 0.013801 -3.54443 63.546000 Cu 0.086886 0.456841 0 562 63.546 0.0324606 -3.54381 63.546000 Cu 0.110993 0.494767 0 582 63.546 4.17564 -3.44268 63.546000 Cu 0.100882 0.476036 0.5 583 63.546 0.0452401 -3.52494 63.546000 Cu 0.185956 0.472903 0 585 63.546 0.0973493 -3.53749 63.546000 Cu 0.00324043 0.460538 0.5 564 63.546 0.076652 -3.54349 63.546000 Cu 0.0137241 0.480176 1.21855e-16 581 63.546 0.882187 -3.45345 63.546000 Cu 0.0282583 0.498705 0.5 584 63.546 9.30511 -3.28238 63.546000 Cu 0.200809 0.491963 0.5 588 63.546 0.448725 -3.49877 63.546000 Cu 0.36176 0.489962 0.5 8 63.546 0.480953 -3.47264 63.546000 Cu 0.345929 0.467198 0 296 63.546 0.0753787 -3.50192 63.546000 Cu 0.283304 0.491023 0 586 63.546 0.346235 -3.52775 63.546000 Cu 0.269143 0.47004 0.5 587 63.546 0.185419 -3.5221 63.546000 Cu 0.422229 0.464032 0.5 10 63.546 0.130615 -3.51442 63.546000 Cu 0.513724 0.480176 0.5 1 63.546 0.882187 -3.45345 63.546000 Cu 0.50324 0.460538 5.70254e-16 2 63.546 0.076652 -3.54349 63.546000 Cu 0.433737 0.485649 2.40598e-16 288 63.546 0.919686 -3.4139 63.546000 Cu 0.586886 0.456841 0.5 552 63.546 0.0324606 -3.54381 63.546000 Cu 0.528258 0.498705 1.694e-15 575 63.546 9.30511 -3.28238 63.546000 Cu 0.600882 0.476036 3.50675e-15 551 63.546 0.0452401 -3.52494 63.546000 Cu 0.610993 0.494767 0.5 576 63.546 4.17564 -3.44268 63.546000 Cu 0.769143 0.47004 3.61496e-16 554 63.546 0.185419 -3.5221 63.546000 Cu 0.685956 0.472903 0.5 556 63.546 0.0973493 -3.53749 63.546000 Cu 0.700809 0.491963 2.54005e-15 577 63.546 0.448725 -3.49877 63.546000 Cu 0.783304 0.491023 0.5 578 63.546 0.346235 -3.52775 63.546000 Cu 0.922229 0.464032 6.94263e-18 558 63.546 0.130615 -3.51442 63.546000 Cu 0.845929 0.467198 0.5 560 63.546 0.0753787 -3.50192 63.546000 Cu 0.86176 0.489962 1.19461e-16 579 63.546 0.480953 -3.47264 63.546000 Cu 0.933737 0.485649 0.5 580 63.546 0.919686 -3.4139 63.546000 Cu 0.12647 0.511969 0.5 4 63.546 6.41969 -3.22734 63.546000 Cu 0.0144074 0.543754 4.42892e-17 20 63.546 0.790742 -3.45471 63.546000 Cu 0.0292052 0.525337 0.5 21 63.546 9.13571 -3.27915 63.546000 Cu 0.111799 0.529241 7.18203e-17 23 63.546 4.06359 -3.4436 63.546000 Cu 0.206384 0.511941 5.38653e-17 3 63.546 0.636937 -3.51612 63.546000 Cu 0.373523 0.511938 0 5 63.546 1.81818 -3.51824 63.546000 Cu 0.288234 0.511949 0.5 6 63.546 0.343261 -3.53083 63.546000 Cu 0.201089 0.531947 0.5 25 63.546 0.42563 -3.50159 63.546000 Cu 0.283482 0.532844 3.25586e-17 27 63.546 0.327142 -3.52877 63.546000 Cu 0.361966 0.533947 0.5 29 63.546 0.428187 -3.47846 63.546000 Cu 0.457602 0.512316 0.5 7 63.546 7.95589 -3.47441 63.546000 Cu 0.529205 0.525337 1.69352e-15 9 63.546 9.13571 -3.27915 63.546000 Cu 0.434186 0.538164 1.91282e-16 31 63.546 0.825932 -3.42515 63.546000 Cu 0.514407 0.543754 0.5 34 63.546 0.790742 -3.45471 63.546000 Cu 0.62647 0.511969 1.31879e-14 11 63.546 6.41969 -3.22734 63.546000 Cu 0.701089 0.531947 2.66166e-15 12 63.546 0.42563 -3.50159 63.546000 Cu 0.706384 0.511941 0.5 13 63.546 0.636937 -3.51612 63.546000 Cu 0.611799 0.529241 0.5 14 63.546 4.06359 -3.4436 63.546000 Cu 0.788234 0.511949 9.67659e-16 15 63.546 0.343261 -3.53083 63.546000 Cu 0.783482 0.532844 0.5 18 63.546 0.327142 -3.52877 63.546000 Cu 0.861966 0.533947 2.42513e-16 16 63.546 0.428187 -3.47846 63.546000 Cu 0.873523 0.511938 0.5 17 63.546 1.81818 -3.51824 63.546000 Cu 0.957602 0.512316 0 19 63.546 7.95589 -3.47441 63.546000 Cu 0.934186 0.538164 0.5 22 63.546 0.825932 -3.42515 63.546000 Cu 0.101761 0.547965 0.5 26 63.546 0.0490016 -3.52323 63.546000 Cu 0.00408037 0.563313 0.5 45 63.546 0.0835051 -3.54266 63.546000 Cu 0.0878122 0.567088 0 47 63.546 0.0336824 -3.54294 63.546000 Cu 0.171826 0.570782 0.5 49 63.546 0.024698 -3.54108 63.546000 Cu 0.0746567 0.587039 0.5 50 63.546 0.0215383 -3.54595 63.546000 Cu 0.186788 0.551077 3.49526e-17 24 63.546 0.101996 -3.53764 63.546000 Cu 0.156525 0.590723 6.96657e-17 48 63.546 0.00658886 -3.54215 63.546000 Cu 0.346631 0.556615 2.42992e-16 28 63.546 0.0678592 -3.5035 63.546000 Cu 0.269723 0.553861 0.5 30 63.546 0.175121 -3.52343 63.546000 Cu 0.253244 0.57431 1.22334e-16 51 63.546 0.0258082 -3.53476 63.546000 Cu 0.332902 0.57773 0.5 53 63.546 0.044494 -3.52538 63.546000 Cu 0.422988 0.559811 0.5 32 63.546 0.129932 -3.51432 63.546000 Cu 0.50408 0.563313 6.04727e-16 33 63.546 0.0835051 -3.54266 63.546000 Cu 0.412488 0.580681 1.8003e-16 55 63.546 0.0120311 -3.53452 63.546000 Cu 0.493014 0.583682 0.5 58 63.546 0.0143562 -3.5445 63.546000 Cu 0.587812 0.567088 0.5 38 63.546 0.0336824 -3.54294 63.546000 Cu 0.574657 0.587039 4.85506e-16 59 63.546 0.0215383 -3.54595 63.546000 Cu 0.601761 0.547965 3.75094e-15 35 63.546 0.0490016 -3.52323 63.546000 Cu 0.671826 0.570782 6.04967e-16 36 63.546 0.024698 -3.54108 63.546000 Cu 0.686788 0.551077 0.5 37 63.546 0.101996 -3.53764 63.546000 Cu 0.769723 0.553861 3.62214e-16 39 63.546 0.175121 -3.52343 63.546000 Cu 0.753244 0.57431 0.5 42 63.546 0.0258082 -3.53476 63.546000 Cu 0.656525 0.590723 0.5 61 63.546 0.00658886 -3.54215 63.546000 Cu 0.993014 0.583682 3.04039e-17 44 63.546 0.0143562 -3.5445 63.546000 Cu 0.832902 0.57773 1.21137e-16 40 63.546 0.044494 -3.52538 63.546000 Cu 0.846631 0.556615 0.5 41 63.546 0.0678592 -3.5035 63.546000 Cu 0.922988 0.559811 1.01985e-16 43 63.546 0.129932 -3.51432 63.546000 Cu 0.912488 0.580681 0.5 46 63.546 0.0120311 -3.53452 63.546000 Cu 0.0615895 0.607456 3.73466e-17 71 63.546 0.00480618 -3.54185 63.546000 Cu 0.129209 0.631312 1.43641e-17 72 63.546 0.00171388 -3.54036 63.546000 Cu 0.142514 0.61094 0.5 73 63.546 0.00520576 -3.54117 63.546000 Cu 0.0485155 0.62796 0.5 74 63.546 0.000444061 -3.53941 63.546000 Cu 0.319306 0.598027 1.22334e-16 52 63.546 0.0114726 -3.53562 63.546000 Cu 0.238087 0.594495 0.5 54 63.546 0.00384766 -3.53702 63.546000 Cu 0.223877 0.614582 1.72369e-17 75 63.546 0.00168357 -3.53978 63.546000 Cu 0.305575 0.618143 0.5 77 63.546 0.00160417 -3.53926 63.546000 Cu 0.210349 0.634767 0.5 78 63.546 0.00165402 -3.54091 63.546000 Cu 0.387008 0.621507 6.24837e-17 79 63.546 0.0036413 -3.53882 63.546000 Cu 0.40031 0.601203 0.5 56 63.546 0.00701755 -3.5373 63.546000 Cu 0.480982 0.604236 1.21855e-16 57 63.546 0.00232787 -3.54025 63.546000 Cu 0.561589 0.607456 0.5 62 63.546 0.00480618 -3.54185 63.546000 Cu 0.467939 0.624729 0.5 82 63.546 0.00189554 -3.53875 63.546000 Cu 0.548515 0.62796 2.44668e-16 83 63.546 0.000444061 -3.53941 63.546000 Cu 0.642514 0.61094 2.4371e-16 60 63.546 0.00520576 -3.54117 63.546000 Cu 0.738087 0.594495 1.63511e-16 63 63.546 0.00384766 -3.53702 63.546000 Cu 0.723877 0.614582 0.5 66 63.546 0.00168357 -3.53978 63.546000 Cu 0.629209 0.631312 0.5 85 63.546 0.00171388 -3.54036 63.546000 Cu 0.710349 0.634767 3.11221e-17 87 63.546 0.00165402 -3.54091 63.546000 Cu 0.980982 0.604236 0.5 69 63.546 0.00232787 -3.54025 63.546000 Cu 0.805575 0.618143 4.78802e-19 64 63.546 0.00160417 -3.53926 63.546000 Cu 0.819306 0.598027 0.5 65 63.546 0.0114726 -3.53562 63.546000 Cu 0.90031 0.601203 3.11221e-18 67 63.546 0.00701755 -3.5373 63.546000 Cu 0.967939 0.624729 3.6389e-17 68 63.546 0.00189554 -3.53875 63.546000 Cu 0.887008 0.621507 0.5 70 63.546 0.0036413 -3.53882 63.546000 Cu 0.0352536 0.648404 9.57605e-17 95 63.546 0.000458114 -3.53897 63.546000 Cu 0.102744 0.672092 3.11221e-18 96 63.546 0.000157287 -3.53951 63.546000 Cu 0.116048 0.651707 0.5 97 63.546 0.000214884 -3.53983 63.546000 Cu 0.0218024 0.668754 0.5 98 63.546 0.000434382 -3.53913 63.546000 Cu 0.197004 0.65508 3.49526e-17 99 63.546 0.000601074 -3.54082 63.546000 Cu 0.18366 0.675436 0.5 102 63.546 9.09087e-05 -3.54014 63.546000 Cu 0.291796 0.638276 4.78802e-19 76 63.546 0.000365767 -3.54062 63.546000 Cu 0.373268 0.641729 0.5 81 63.546 0.000733263 -3.53972 63.546000 Cu 0.264692 0.678829 5.67381e-17 100 63.546 0.000140019 -3.54057 63.546000 Cu 0.278187 0.658511 0.5 101 63.546 0.00045247 -3.54097 63.546000 Cu 0.359446 0.66196 2.89675e-17 103 63.546 0.000128162 -3.54028 63.546000 Cu 0.454407 0.645096 3.25586e-17 80 63.546 0.00122378 -3.53893 63.546000 Cu 0.535254 0.648404 0.5 86 63.546 0.000458114 -3.53897 63.546000 Cu 0.440713 0.665379 0.5 105 63.546 0.000215066 -3.53946 63.546000 Cu 0.521802 0.668754 4.78802e-19 107 63.546 0.000434382 -3.53913 63.546000 Cu 0.616048 0.651707 1.12519e-16 84 63.546 0.000214884 -3.53983 63.546000 Cu 0.697004 0.65508 0.5 90 63.546 0.000601074 -3.54082 63.546000 Cu 0.602744 0.672092 0.5 109 63.546 0.000157287 -3.53951 63.546000 Cu 0.68366 0.675436 4.78802e-19 111 63.546 9.09087e-05 -3.54014 63.546000 Cu 0.764692 0.678829 0.5 113 63.546 0.000140019 -3.54057 63.546000 Cu 0.778187 0.658511 7.18203e-19 88 63.546 0.00045247 -3.54097 63.546000 Cu 0.791796 0.638276 0.5 89 63.546 0.000365767 -3.54062 63.546000 Cu 0.873268 0.641729 6.46383e-18 91 63.546 0.000733263 -3.53972 63.546000 Cu 0.940713 0.665379 1.12519e-17 92 63.546 0.000215066 -3.53946 63.546000 Cu 0.954407 0.645096 0.5 93 63.546 0.00122378 -3.53893 63.546000 Cu 0.859446 0.66196 0.5 94 63.546 0.000128162 -3.54028 63.546000 Cu 0.00816582 0.689051 2.84887e-17 119 63.546 5.39707e-05 -3.5397 63.546000 Cu 0.0756505 0.712741 2.39401e-19 120 63.546 1.27888e-05 -3.53981 63.546000 Cu 0.0892125 0.692427 0.5 121 63.546 7.81261e-05 -3.53955 63.546000 Cu 0.170251 0.695786 6.12867e-17 123 63.546 3.47192e-05 -3.53971 63.546000 Cu 0.156737 0.716116 0.5 126 63.546 6.25393e-05 -3.5397 63.546000 Cu 0.345858 0.68224 0.5 106 63.546 9.97858e-05 -3.54042 63.546000 Cu 0.237742 0.719495 0 124 63.546 3.08895e-05 -3.53984 63.546000 Cu 0.251276 0.699159 0.5 125 63.546 4.93228e-05 -3.54003 63.546000 Cu 0.332351 0.702562 0 127 63.546 2.02123e-05 -3.5403 63.546000 Cu 0.318767 0.722887 0.5 130 63.546 1.38142e-05 -3.54011 63.546000 Cu 0.399878 0.726285 4.78802e-19 128 63.546 1.10528e-05 -3.54013 63.546000 Cu 0.427014 0.68565 4.4768e-17 104 63.546 5.3075e-05 -3.54007 63.546000 Cu 0.508166 0.689051 0.5 110 63.546 5.39707e-05 -3.5397 63.546000 Cu 0.413421 0.705964 0.5 129 63.546 1.17571e-05 -3.54028 63.546000 Cu 0.494525 0.709357 5.74563e-18 131 63.546 1.86452e-05 -3.54008 63.546000 Cu 0.589213 0.692427 3.32768e-17 108 63.546 7.81261e-05 -3.53955 63.546000 Cu 0.57565 0.712741 0.5 133 63.546 1.27888e-05 -3.53981 63.546000 Cu 0.751276 0.699159 4.78802e-19 112 63.546 4.93228e-05 -3.54003 63.546000 Cu 0.670251 0.695786 0.5 114 63.546 3.47192e-05 -3.53971 63.546000 Cu 0.656737 0.716116 2.39401e-19 135 63.546 6.25393e-05 -3.5397 63.546000 Cu 0.737742 0.719495 0.5 137 63.546 3.08895e-05 -3.53984 63.546000 Cu 0.994525 0.709357 0.5 122 63.546 1.86452e-05 -3.54008 63.546000 Cu 0.845858 0.68224 4.78802e-19 115 63.546 9.97858e-05 -3.54042 63.546000 Cu 0.913421 0.705964 1.91521e-18 116 63.546 1.17571e-05 -3.54028 63.546000 Cu 0.927014 0.68565 0.5 117 63.546 5.3075e-05 -3.54007 63.546000 Cu 0.832351 0.702562 0.5 118 63.546 2.02123e-05 -3.5403 63.546000 Cu 0.818767 0.722887 4.7162e-17 139 63.546 1.38142e-05 -3.54011 63.546000 Cu 0.899878 0.726285 0.5 141 63.546 1.10528e-05 -3.54013 63.546000 Cu 0.0483416 0.753402 8.88178e-17 144 63.546 1.80407e-05 -3.54002 63.546000 Cu 0.0620631 0.73306 0.5 145 63.546 6.39954e-05 -3.54003 63.546000 Cu 0.143062 0.736446 1.05337e-16 147 63.546 5.75219e-06 -3.53986 63.546000 Cu 0.129347 0.756782 0.5 150 63.546 2.59459e-05 -3.53995 63.546000 Cu 0.210414 0.76015 4.78802e-19 148 63.546 7.79032e-06 -3.53992 63.546000 Cu 0.224065 0.739824 0.5 149 63.546 1.7626e-05 -3.53984 63.546000 Cu 0.305155 0.743207 5.53017e-17 151 63.546 8.71681e-06 -3.53996 63.546000 Cu 0.372546 0.766918 3.37556e-17 152 63.546 2.17714e-05 -3.53998 63.546000 Cu 0.291496 0.763522 0.5 154 63.546 4.72242e-05 -3.53997 63.546000 Cu 0.386274 0.746598 0.5 153 63.546 4.48952e-05 -3.54002 63.546000 Cu 0.562063 0.73306 1.07012e-16 132 63.546 6.39954e-05 -3.54003 63.546000 Cu 0.481002 0.729675 0.5 134 63.546 5.90055e-05 -3.54009 63.546000 Cu 0.453575 0.770329 0.5 155 63.546 1.46607e-05 -3.53994 63.546000 Cu 0.467338 0.750002 5.96109e-17 156 63.546 3.61462e-05 -3.54005 63.546000 Cu 0.548342 0.753402 0.5 158 63.546 1.80407e-05 -3.54002 63.546000 Cu 0.724065 0.739824 1.5585e-16 136 63.546 1.7626e-05 -3.53984 63.546000 Cu 0.643062 0.736446 0.5 138 63.546 5.75219e-06 -3.53986 63.546000 Cu 0.629347 0.756782 0 159 63.546 2.59459e-05 -3.53995 63.546000 Cu 0.710414 0.76015 0.5 161 63.546 7.79032e-06 -3.53992 63.546000 Cu 0.791496 0.763522 2.56159e-17 163 63.546 4.72242e-05 -3.53997 63.546000 Cu 0.981002 0.729675 7.94812e-17 143 63.546 5.90055e-05 -3.54009 63.546000 Cu 0.886274 0.746598 7.97206e-17 140 63.546 4.48952e-05 -3.54002 63.546000 Cu 0.805155 0.743207 0.5 142 63.546 8.71681e-06 -3.53996 63.546000 Cu 0.967338 0.750002 0.5 146 63.546 3.61462e-05 -3.54005 63.546000 Cu 0.872546 0.766918 0.5 165 63.546 2.17714e-05 -3.53998 63.546000 Cu 0.953575 0.770329 4.33316e-17 167 63.546 1.46607e-05 -3.53994 63.546000 Cu 0.0210017 0.794057 9.57605e-19 168 63.546 8.72362e-06 -3.54018 63.546000 Cu 0.0346264 0.773731 0.5 169 63.546 3.70498e-05 -3.53994 63.546000 Cu 0.115718 0.777116 1.08928e-16 171 63.546 1.26034e-05 -3.53995 63.546000 Cu 0.102104 0.797451 0.5 174 63.546 2.09649e-05 -3.54015 63.546000 Cu 0.00740583 0.814387 0.5 193 63.546 1.47209e-05 -3.5402 63.546000 Cu 0.0884952 0.8178 4.54862e-18 195 63.546 3.78138e-05 -3.54036 63.546000 Cu 0.183156 0.80084 4.78802e-19 172 63.546 1.20501e-05 -3.54004 63.546000 Cu 0.196777 0.780486 0.5 173 63.546 1.39943e-05 -3.53993 63.546000 Cu 0.277802 0.783862 0 175 63.546 2.48361e-05 -3.53995 63.546000 Cu 0.345179 0.807591 0 176 63.546 5.16021e-05 -3.53987 63.546000 Cu 0.358832 0.787252 0.5 177 63.546 2.77937e-05 -3.53996 63.546000 Cu 0.264163 0.804215 0.5 178 63.546 1.31191e-05 -3.53993 63.546000 Cu 0.534626 0.773731 2.39401e-19 157 63.546 3.70498e-05 -3.53994 63.546000 Cu 0.439881 0.790654 4.54862e-18 179 63.546 3.2571e-05 -3.54008 63.546000 Cu 0.42628 0.81098 0.5 180 63.546 1.77193e-05 -3.53997 63.546000 Cu 0.507406 0.814387 0 181 63.546 1.47209e-05 -3.5402 63.546000 Cu 0.521002 0.794057 0.5 182 63.546 8.72362e-06 -3.54018 63.546000 Cu 0.588495 0.8178 0.5 186 63.546 3.78138e-05 -3.54036 63.546000 Cu 0.696777 0.780486 2.39401e-19 160 63.546 1.39943e-05 -3.53993 63.546000 Cu 0.615718 0.777116 0.5 162 63.546 1.26034e-05 -3.53995 63.546000 Cu 0.602104 0.797451 0 183 63.546 2.09649e-05 -3.54015 63.546000 Cu 0.683156 0.80084 0.5 185 63.546 1.20501e-05 -3.54004 63.546000 Cu 0.764163 0.804215 0 187 63.546 1.31191e-05 -3.53993 63.546000 Cu 0.777802 0.783862 0.5 166 63.546 2.48361e-05 -3.53995 63.546000 Cu 0.858832 0.787252 4.78802e-19 164 63.546 2.77937e-05 -3.53996 63.546000 Cu 0.939881 0.790654 0.5 170 63.546 3.2571e-05 -3.54008 63.546000 Cu 0.845179 0.807591 0.5 189 63.546 5.16021e-05 -3.53987 63.546000 Cu 0.92628 0.81098 8.01994e-17 191 63.546 1.77193e-05 -3.53997 63.546000 Cu 0.15603 0.841556 0 196 63.546 0.000231721 -3.54031 63.546000 Cu 0.169546 0.821203 0.5 197 63.546 6.20345e-05 -3.54027 63.546000 Cu 0.074889 0.838131 0.5 198 63.546 7.58412e-05 -3.54002 63.546000 Cu 0.0612016 0.858417 0 219 63.546 0.000142409 -3.53954 63.546000 Cu 0.142511 0.86185 0.5 221 63.546 0.000236913 -3.54026 63.546000 Cu 0.250558 0.824582 6.89475e-17 199 63.546 7.57535e-05 -3.54004 63.546000 Cu 0.318136 0.848302 1.11561e-16 200 63.546 6.39607e-05 -3.53995 63.546000 Cu 0.331625 0.827937 0.5 201 63.546 5.001e-05 -3.53971 63.546000 Cu 0.237149 0.844944 0.5 202 63.546 0.000129928 -3.54034 63.546000 Cu 0.399074 0.851652 0.5 204 63.546 0.000243389 -3.53951 63.546000 Cu 0.412648 0.831302 1.06773e-16 203 63.546 0.000124206 -3.53962 63.546000 Cu 0.480075 0.855019 0 205 63.546 0.000316689 -3.53928 63.546000 Cu 0.493747 0.834704 0.5 206 63.546 3.02526e-05 -3.53981 63.546000 Cu 0.561202 0.858417 0.5 210 63.546 0.000142409 -3.53954 63.546000 Cu 0.574889 0.838131 1.22573e-16 207 63.546 7.58412e-05 -3.54002 63.546000 Cu 0.669546 0.821203 7.6369e-17 184 63.546 6.20345e-05 -3.54027 63.546000 Cu 0.750558 0.824582 0.5 190 63.546 7.57535e-05 -3.54004 63.546000 Cu 0.642511 0.86185 5.36259e-17 208 63.546 0.000236913 -3.54026 63.546000 Cu 0.65603 0.841556 0.5 209 63.546 0.000231721 -3.54031 63.546000 Cu 0.737149 0.844944 0 211 63.546 0.000129928 -3.54034 63.546000 Cu 0.993747 0.834704 1.12519e-17 192 63.546 3.02526e-05 -3.53981 63.546000 Cu 0.980075 0.855019 0.5 217 63.546 0.000316689 -3.53928 63.546000 Cu 0.831625 0.827937 1.22334e-16 188 63.546 5.001e-05 -3.53971 63.546000 Cu 0.912648 0.831302 0.5 194 63.546 0.000124206 -3.53962 63.546000 Cu 0.818136 0.848302 0.5 213 63.546 6.39607e-05 -3.53995 63.546000 Cu 0.899074 0.851652 1.3191e-16 215 63.546 0.000243389 -3.53951 63.546000 Cu 0.128662 0.882101 3.32768e-17 220 63.546 0.000450724 -3.54006 63.546000 Cu 0.0474708 0.87871 0.5 222 63.546 0.00103939 -3.53925 63.546000 Cu 0.03375 0.899078 3.42344e-17 243 63.546 0.00265591 -3.53895 63.546000 Cu 0.114837 0.902334 0.5 245 63.546 0.00306112 -3.53917 63.546000 Cu 0.196354 0.905725 0 247 63.546 0.00104745 -3.53947 63.546000 Cu 0.223741 0.865297 0 223 63.546 0.000721857 -3.54084 63.546000 Cu 0.291532 0.889058 2.15461e-18 224 63.546 0.00201185 -3.54074 63.546000 Cu 0.30482 0.868701 0.5 225 63.546 0.000500236 -3.54057 63.546000 Cu 0.210123 0.885563 0.5 226 63.546 0.000464913 -3.54074 63.546000 Cu 0.372526 0.8925 0.5 229 63.546 0.00143964 -3.54021 63.546000 Cu 0.385682 0.87205 0 227 63.546 0.000155243 -3.53972 63.546000 Cu 0.453152 0.895842 2.39401e-19 228 63.546 0.0004081 -3.53951 63.546000 Cu 0.466502 0.875376 0.5 230 63.546 0.000738438 -3.53913 63.546000 Cu 0.547471 0.87871 0 231 63.546 0.00103939 -3.53925 63.546000 Cu 0.53375 0.899078 0.5 234 63.546 0.00265591 -3.53895 63.546000 Cu 0.723741 0.865297 0.5 214 63.546 0.000721857 -3.54084 63.546000 Cu 0.614837 0.902334 0 232 63.546 0.00306112 -3.53917 63.546000 Cu 0.628662 0.882101 0.5 233 63.546 0.000450724 -3.54006 63.546000 Cu 0.710123 0.885563 4.04588e-17 235 63.546 0.000464913 -3.54074 63.546000 Cu 0.696354 0.905725 0.5 238 63.546 0.00104745 -3.53947 63.546000 Cu 0.791532 0.889058 0.5 237 63.546 0.00201185 -3.54074 63.546000 Cu 0.80482 0.868701 0 212 63.546 0.000500236 -3.54057 63.546000 Cu 0.966502 0.875376 3.30374e-17 216 63.546 0.000738438 -3.53913 63.546000 Cu 0.885682 0.87205 0.5 218 63.546 0.000155243 -3.53972 63.546000 Cu 0.872526 0.8925 0 239 63.546 0.00143964 -3.54021 63.546000 Cu 0.953152 0.895842 0.5 241 63.546 0.0004081 -3.53951 63.546000 Cu 0.101386 0.922615 6.46383e-17 244 63.546 0.00778013 -3.53733 63.546000 Cu 0.0206637 0.919575 0.5 246 63.546 0.00178316 -3.54026 63.546000 Cu 0.00845399 0.940147 4.78802e-19 267 63.546 0.0127217 -3.54443 63.546000 Cu 0.0889366 0.943125 0.5 269 63.546 0.0126554 -3.53455 63.546000 Cu 0.168525 0.946119 7.32567e-17 271 63.546 0.0458362 -3.52543 63.546000 Cu 0.182471 0.92585 0.5 250 63.546 0.00996093 -3.53591 63.546000 Cu 0.27794 0.909294 0.5 249 63.546 0.00211232 -3.53967 63.546000 Cu 0.263637 0.929418 0 248 63.546 0.00315002 -3.53706 63.546000 Cu 0.359176 0.91292 4.78802e-19 251 63.546 0.00531269 -3.5409 63.546000 Cu 0.345031 0.933186 0.5 254 63.546 0.0070731 -3.54201 63.546000 Cu 0.248247 0.949623 0.5 273 63.546 0.0215925 -3.53508 63.546000 Cu 0.329635 0.953179 8.92966e-17 275 63.546 0.0228909 -3.54158 63.546000 Cu 0.426837 0.936823 0 252 63.546 0.0196767 -3.5458 63.546000 Cu 0.440011 0.916384 0.5 253 63.546 0.00457386 -3.54179 63.546000 Cu 0.520664 0.919575 2.39401e-19 255 63.546 0.00178316 -3.54026 63.546000 Cu 0.508454 0.940147 0.5 258 63.546 0.0127217 -3.54443 63.546000 Cu 0.588937 0.943125 0 256 63.546 0.0126554 -3.53455 63.546000 Cu 0.77794 0.909294 4.78802e-19 236 63.546 0.00211232 -3.53967 63.546000 Cu 0.601386 0.922615 0.5 257 63.546 0.00778013 -3.53733 63.546000 Cu 0.682471 0.92585 2.34613e-17 259 63.546 0.00996093 -3.53591 63.546000 Cu 0.748247 0.949623 5.88927e-17 260 63.546 0.0215925 -3.53508 63.546000 Cu 0.763637 0.929418 0.5 261 63.546 0.00315002 -3.53706 63.546000 Cu 0.668525 0.946119 0.5 262 63.546 0.0458362 -3.52543 63.546000 Cu 0.940011 0.916384 4.78802e-19 240 63.546 0.00457386 -3.54179 63.546000 Cu 0.859176 0.91292 0.5 242 63.546 0.00531269 -3.5409 63.546000 Cu 0.845031 0.933186 0 263 63.546 0.0070731 -3.54201 63.546000 Cu 0.926837 0.936823 0.5 265 63.546 0.0196767 -3.5458 63.546000 Cu 0.829635 0.953179 0.5 266 63.546 0.0228909 -3.54158 63.546000 Cu 0.0780667 0.964013 9.57605e-19 268 63.546 0.127903 -3.51468 63.546000 Cu 0.154389 0.967184 0.5 274 63.546 0.0752537 -3.50222 63.546000 Cu 0.0664852 0.985601 0.5 292 63.546 0.935367 -3.41341 63.546000 Cu 0.138436 0.989921 0 293 63.546 0.481564 -3.47198 63.546000 Cu 0.389277 0.994796 0.5 327 63.546 4.18413 -3.44277 63.546000 Cu 0.231251 0.970032 4.78802e-19 272 63.546 0.181002 -3.52179 63.546000 Cu 0.314453 0.972909 0.5 278 63.546 0.0942286 -3.53745 63.546000 Cu 0.21694 0.991002 0.5 294 63.546 0.341876 -3.52732 63.546000 Cu 0.299426 0.991959 1 295 63.546 0.448271 -3.49802 63.546000 Cu 0.399454 0.976044 1 276 63.546 0.0444668 -3.52588 63.546000 Cu 0.471981 0.998745 1.91521e-18 297 63.546 9.32505 -3.28308 63.546000 Cu 0.413492 0.956823 0.5 277 63.546 0.0312344 -3.54394 63.546000 Cu 0.497065 0.960516 0 279 63.546 0.0733514 -3.54357 63.546000 Cu 0.566485 0.985601 0 280 63.546 0.935367 -3.41341 63.546000 Cu 0.486493 0.980166 0.5 282 63.546 0.886276 -3.45473 63.546000 Cu 0.578067 0.964013 0.5 281 63.546 0.127903 -3.51468 63.546000 Cu 0.654389 0.967184 0 283 63.546 0.0752537 -3.50222 63.546000 Cu 0.71694 0.991002 1 284 63.546 0.341876 -3.52732 63.546000 Cu 0.731251 0.970032 0.5 285 63.546 0.181002 -3.52179 63.546000 Cu 0.638436 0.989921 0.5 286 63.546 0.481564 -3.47198 63.546000 Cu 0.799426 0.991959 0.5 290 63.546 0.448271 -3.49802 63.546000 Cu 0.971981 0.998745 0.5 304 63.546 9.32505 -3.28308 63.546000 Cu 0.889277 0.994796 1 302 63.546 4.18413 -3.44277 63.546000 Cu 0.997065 0.960516 0.5 270 63.546 0.0733514 -3.54357 63.546000 Cu 0.986493 0.980166 1 291 63.546 0.886276 -3.45473 63.546000 Cu 0.913492 0.956823 1 264 63.546 0.0312344 -3.54394 63.546000 Cu 0.814453 0.972909 1 287 63.546 0.0942286 -3.53745 63.546000 Cu 0.899454 0.976044 0.5 289 63.546 0.0444668 -3.52588