Number of particles = 836 A = 1 Angstrom (basic length-scale) H0(1,1) = 26.2728 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 105.423 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.59968 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 0.130885 0.00402403 4.3372e-17 448 63.546 4.08902 -3.52486 63.546000 Cu 0.0651871 0.0106115 0.5 449 63.546 2.18302 -3.43372 63.546000 Cu 0.0182241 0.0317187 0.5 467 63.546 0.0103778 -3.53762 63.546000 Cu 0.085802 0.026604 4.81911e-19 469 63.546 0.047669 -3.50195 63.546000 Cu 0.150862 0.0214764 0.5 471 63.546 0.036439 -3.52256 63.546000 Cu 0.198005 0.000326132 0.5 450 63.546 12.0239 -3.3382 63.546000 Cu 0.216045 0.016644 4.81911e-19 473 63.546 1.01823 -3.48224 63.546000 Cu 0.299593 0.0294305 3.56614e-17 474 63.546 0.052739 -3.49746 63.546000 Cu 0.280053 0.0119495 0.5 475 63.546 1.82376 -3.42815 63.546000 Cu 0.235004 0.0336726 0.5 476 63.546 0.00565016 -3.53689 63.546000 Cu 0.342219 0.00837662 4.81911e-19 477 63.546 1.59885 -3.43038 63.546000 Cu 0.43123 0.0200896 5.49378e-17 478 63.546 0.0510634 -3.53416 63.546000 Cu 0.414222 0.00366668 0.5 479 63.546 3.81041 -3.52187 63.546000 Cu 0.3654 0.0246063 0.5 480 63.546 0.0373707 -3.52381 63.546000 Cu 0.499878 0.0153872 0.5 429 63.546 1.07186 -3.47741 63.546000 Cu 0.451688 0.0363407 0.5 510 63.546 0.00800622 -3.54082 63.546000 Cu 0.565187 0.0106115 1.14695e-16 428 63.546 2.18302 -3.43372 63.546000 Cu 0.630885 0.00402403 0.5 431 63.546 4.08902 -3.52486 63.546000 Cu 0.518224 0.0317187 3.95167e-17 432 63.546 0.0103778 -3.53762 63.546000 Cu 0.585802 0.026604 0.5 434 63.546 0.047669 -3.50195 63.546000 Cu 0.650862 0.0214764 1.14695e-16 436 63.546 0.036439 -3.52256 63.546000 Cu 0.698005 0.000326132 1.79271e-16 430 63.546 12.0239 -3.3382 63.546000 Cu 0.735004 0.0336726 2.45293e-16 437 63.546 0.00565016 -3.53689 63.546000 Cu 0.716045 0.016644 0.5 438 63.546 1.01823 -3.48224 63.546000 Cu 0.780053 0.0119495 1.73488e-16 440 63.546 1.82376 -3.42815 63.546000 Cu 0.799593 0.0294305 0.5 443 63.546 0.052739 -3.49746 63.546000 Cu 0.999878 0.0153872 4.81911e-19 445 63.546 1.07186 -3.47741 63.546000 Cu 0.8654 0.0246063 6.36122e-17 441 63.546 0.0373707 -3.52381 63.546000 Cu 0.842219 0.00837662 0.5 442 63.546 1.59885 -3.43038 63.546000 Cu 0.914222 0.00366668 4.3372e-17 444 63.546 3.81041 -3.52187 63.546000 Cu 0.93123 0.0200896 0.5 447 63.546 0.0510634 -3.53416 63.546000 Cu 0.951688 0.0363407 0 465 63.546 0.00800622 -3.54082 63.546000 Cu 0.037731 0.047992 4.81911e-19 466 63.546 0.00403644 -3.54416 63.546000 Cu 0.10412 0.0431006 0.5 472 63.546 0.00767261 -3.54426 63.546000 Cu 0.0568594 0.0645737 0.5 498 63.546 0.00147846 -3.54353 63.546000 Cu 0.122815 0.0597713 1.6385e-17 500 63.546 0.0022642 -3.54323 63.546000 Cu 0.170097 0.038265 3.95167e-17 470 63.546 0.010218 -3.53294 63.546000 Cu 0.20745 0.0718773 4.3372e-17 501 63.546 0.000930406 -3.53767 63.546000 Cu 0.188517 0.0551195 0.5 502 63.546 0.00124493 -3.53881 63.546000 Cu 0.25395 0.0505836 4.81911e-19 504 63.546 0.00588106 -3.53219 63.546000 Cu 0.319613 0.0459349 0.5 506 63.546 0.00435082 -3.53264 63.546000 Cu 0.273299 0.0672297 0.5 507 63.546 0.00132819 -3.53746 63.546000 Cu 0.490791 0.0694102 0.5 452 63.546 0.000642428 -3.54085 63.546000 Cu 0.339182 0.0625111 2.18787e-16 505 63.546 0.000776566 -3.53944 63.546000 Cu 0.385339 0.0411817 6.69856e-17 508 63.546 0.00152926 -3.53773 63.546000 Cu 0.47124 0.0528835 4.81911e-19 509 63.546 0.00113913 -3.54016 63.546000 Cu 0.405199 0.0576915 0.5 511 63.546 0.00027134 -3.53941 63.546000 Cu 0.60412 0.0431006 2.29871e-16 433 63.546 0.00767261 -3.54426 63.546000 Cu 0.537731 0.047992 0.5 435 63.546 0.00403644 -3.54416 63.546000 Cu 0.556859 0.0645737 5.20464e-17 453 63.546 0.00147846 -3.54353 63.546000 Cu 0.622815 0.0597713 0.5 455 63.546 0.0022642 -3.54323 63.546000 Cu 0.670097 0.038265 0.5 439 63.546 0.010218 -3.53294 63.546000 Cu 0.688517 0.0551195 2.36618e-16 457 63.546 0.00124493 -3.53881 63.546000 Cu 0.773299 0.0672297 0 458 63.546 0.00132819 -3.53746 63.546000 Cu 0.75395 0.0505836 0.5 459 63.546 0.00588106 -3.53219 63.546000 Cu 0.70745 0.0718773 0.5 460 63.546 0.000930406 -3.53767 63.546000 Cu 0.819613 0.0459349 4.81911e-19 461 63.546 0.00435082 -3.53264 63.546000 Cu 0.905199 0.0576915 1.45537e-16 462 63.546 0.00027134 -3.53941 63.546000 Cu 0.885339 0.0411817 0.5 463 63.546 0.00152926 -3.53773 63.546000 Cu 0.839182 0.0625111 0.5 464 63.546 0.000776566 -3.53944 63.546000 Cu 0.97124 0.0528835 0.5 468 63.546 0.00113913 -3.54016 63.546000 Cu 0.990791 0.0694102 1.12767e-16 496 63.546 0.000642428 -3.54085 63.546000 Cu 0.0759512 0.0812433 0 497 63.546 0.000459286 -3.54109 63.546000 Cu 0.0100647 0.0860358 0.5 499 63.546 0.000342139 -3.54094 63.546000 Cu 0.141739 0.0765208 0.5 503 63.546 0.000305921 -3.5399 63.546000 Cu 0.0292317 0.102693 1.42646e-16 528 63.546 0.000114378 -3.54031 63.546000 Cu 0.0950739 0.0979419 0.5 530 63.546 7.78171e-05 -3.53981 63.546000 Cu 0.160863 0.0932275 1.22405e-16 532 63.546 0.00017634 -3.53879 63.546000 Cu 0.246035 0.105165 5.44559e-17 533 63.546 0.000109104 -3.53955 63.546000 Cu 0.226699 0.0885322 0.5 534 63.546 0.000333171 -3.53858 63.546000 Cu 0.180146 0.109891 0.5 535 63.546 7.66331e-05 -3.5392 63.546000 Cu 0.292654 0.0838287 4.3372e-17 536 63.546 0.000312799 -3.53945 63.546000 Cu 0.312018 0.100422 0.5 539 63.546 7.61835e-05 -3.54018 63.546000 Cu 0.37806 0.0956525 1.49392e-17 537 63.546 7.67268e-05 -3.54017 63.546000 Cu 0.3587 0.0790644 0.5 538 63.546 0.000153931 -3.53984 63.546000 Cu 0.42471 0.0742606 1.17586e-16 540 63.546 0.000129122 -3.5397 63.546000 Cu 0.444082 0.0908474 0.5 541 63.546 0.000155429 -3.5403 63.546000 Cu 0.463307 0.107469 4.3372e-17 571 63.546 0.000111307 -3.54042 63.546000 Cu 0.510065 0.0860358 4.3372e-17 451 63.546 0.000342139 -3.54094 63.546000 Cu 0.641739 0.0765208 4.96368e-17 454 63.546 0.000305921 -3.5399 63.546000 Cu 0.575951 0.0812433 0.5 456 63.546 0.000459286 -3.54109 63.546000 Cu 0.529232 0.102693 0.5 482 63.546 0.000114378 -3.54031 63.546000 Cu 0.595074 0.0979419 1.64332e-16 484 63.546 7.78171e-05 -3.53981 63.546000 Cu 0.660863 0.0932275 0.5 486 63.546 0.00017634 -3.53879 63.546000 Cu 0.680146 0.109891 7.22866e-17 485 63.546 7.66331e-05 -3.5392 63.546000 Cu 0.726699 0.0885322 1.56621e-16 488 63.546 0.000333171 -3.53858 63.546000 Cu 0.812018 0.100422 2.40955e-18 489 63.546 7.61835e-05 -3.54018 63.546000 Cu 0.792654 0.0838287 0.5 490 63.546 0.000312799 -3.53945 63.546000 Cu 0.746035 0.105165 0.5 491 63.546 0.000109104 -3.53955 63.546000 Cu 0.8587 0.0790644 4.3372e-17 492 63.546 0.000153931 -3.53984 63.546000 Cu 0.944082 0.0908474 7.75876e-17 493 63.546 0.000155429 -3.5403 63.546000 Cu 0.92471 0.0742606 0.5 494 63.546 0.000129122 -3.5397 63.546000 Cu 0.87806 0.0956525 0.5 495 63.546 7.67268e-05 -3.54017 63.546000 Cu 0.963307 0.107469 0.5 526 63.546 0.000111307 -3.54042 63.546000 Cu 0.114273 0.114617 4.3372e-17 529 63.546 3.80907e-05 -3.53944 63.546000 Cu 0.0484001 0.119358 0.5 531 63.546 5.3229e-05 -3.54 63.546000 Cu 0.00155246 0.140752 0.5 557 63.546 6.17991e-05 -3.5397 63.546000 Cu 0.0675144 0.13601 4.3372e-17 559 63.546 8.25098e-05 -3.53953 63.546000 Cu 0.133431 0.131271 0.5 561 63.546 6.72605e-05 -3.53937 63.546000 Cu 0.152473 0.147908 4.3372e-17 560 63.546 3.52265e-05 -3.5395 63.546000 Cu 0.199346 0.126533 4.3372e-17 563 63.546 6.74269e-05 -3.53935 63.546000 Cu 0.284445 0.138406 4.81911e-19 564 63.546 1.65601e-05 -3.53976 63.546000 Cu 0.265294 0.121789 0.5 565 63.546 6.48473e-05 -3.53974 63.546000 Cu 0.218438 0.143161 0.5 566 63.546 2.62675e-05 -3.5396 63.546000 Cu 0.331304 0.117029 4.81911e-19 567 63.546 4.62317e-05 -3.54017 63.546000 Cu 0.482458 0.124111 0.5 483 63.546 4.89408e-05 -3.5402 63.546000 Cu 0.416497 0.128873 0 568 63.546 7.69465e-05 -3.5402 63.546000 Cu 0.397309 0.112251 0.5 569 63.546 4.89128e-05 -3.54025 63.546000 Cu 0.350465 0.133642 0.5 570 63.546 2.71548e-05 -3.54007 63.546000 Cu 0.435553 0.145502 0.5 600 63.546 3.72771e-05 -3.5398 63.546000 Cu 0.5484 0.119358 1.72524e-16 481 63.546 5.3229e-05 -3.54 63.546000 Cu 0.614273 0.114617 0.5 487 63.546 3.80907e-05 -3.53944 63.546000 Cu 0.501552 0.140752 0 512 63.546 6.17991e-05 -3.5397 63.546000 Cu 0.567514 0.13601 0.5 514 63.546 8.25098e-05 -3.53953 63.546000 Cu 0.633431 0.131271 1.51802e-16 516 63.546 6.72605e-05 -3.53937 63.546000 Cu 0.652473 0.147908 0.5 519 63.546 3.52265e-05 -3.5395 63.546000 Cu 0.718438 0.143161 7.22866e-17 517 63.546 2.62675e-05 -3.5396 63.546000 Cu 0.699346 0.126533 0.5 518 63.546 6.74269e-05 -3.53935 63.546000 Cu 0.765294 0.121789 1.2096e-16 520 63.546 6.48473e-05 -3.53974 63.546000 Cu 0.784445 0.138406 0.5 523 63.546 1.65601e-05 -3.53976 63.546000 Cu 0.831304 0.117029 0.5 522 63.546 4.62317e-05 -3.54017 63.546000 Cu 0.850465 0.133642 3.51795e-17 521 63.546 2.71548e-05 -3.54007 63.546000 Cu 0.897309 0.112251 4.81911e-19 524 63.546 4.89128e-05 -3.54025 63.546000 Cu 0.982458 0.124111 0 525 63.546 4.89408e-05 -3.5402 63.546000 Cu 0.916497 0.128873 0.5 527 63.546 7.69465e-05 -3.5402 63.546000 Cu 0.935553 0.145502 1.15659e-17 555 63.546 3.72771e-05 -3.5398 63.546000 Cu 0.0205198 0.157388 6.60218e-17 556 63.546 4.33039e-06 -3.53966 63.546000 Cu 0.0864897 0.152647 0.5 562 63.546 7.21054e-06 -3.53948 63.546000 Cu 0.0394735 0.174026 0.5 588 63.546 8.23824e-06 -3.53984 63.546000 Cu 0.105454 0.16928 0 590 63.546 1.76517e-05 -3.53977 63.546000 Cu 0.19047 0.181148 7.566e-17 591 63.546 1.08318e-05 -3.53984 63.546000 Cu 0.171465 0.164532 0.5 592 63.546 1.16988e-05 -3.53983 63.546000 Cu 0.237512 0.159781 8.38525e-17 594 63.546 2.86553e-05 -3.53975 63.546000 Cu 0.322513 0.171645 0 595 63.546 1.80427e-05 -3.53982 63.546000 Cu 0.303519 0.155024 0.5 596 63.546 1.81392e-05 -3.53981 63.546000 Cu 0.256489 0.176394 0.5 597 63.546 1.07726e-05 -3.53965 63.546000 Cu 0.369537 0.150263 1.27224e-16 598 63.546 2.03424e-05 -3.53993 63.546000 Cu 0.454529 0.162136 0 599 63.546 7.50758e-06 -3.53992 63.546000 Cu 0.388541 0.166889 0.5 601 63.546 2.53709e-05 -3.54003 63.546000 Cu 0.407476 0.183523 0 630 63.546 1.83503e-05 -3.54001 63.546000 Cu 0.473498 0.178776 0.5 631 63.546 2.281e-05 -3.53999 63.546000 Cu 0.58649 0.152647 4.81911e-19 513 63.546 7.21054e-06 -3.53948 63.546000 Cu 0.52052 0.157388 0.5 515 63.546 4.33039e-06 -3.53966 63.546000 Cu 0.539474 0.174026 1.04093e-16 543 63.546 8.23824e-06 -3.53984 63.546000 Cu 0.605454 0.16928 0.5 545 63.546 1.76517e-05 -3.53977 63.546000 Cu 0.671465 0.164532 4.3372e-17 547 63.546 1.16988e-05 -3.53983 63.546000 Cu 0.756489 0.176394 7.27685e-17 548 63.546 1.07726e-05 -3.53965 63.546000 Cu 0.737512 0.159781 0.5 549 63.546 2.86553e-05 -3.53975 63.546000 Cu 0.69047 0.181148 0.5 550 63.546 1.08318e-05 -3.53984 63.546000 Cu 0.803519 0.155024 1.64332e-16 551 63.546 1.81392e-05 -3.53981 63.546000 Cu 0.822513 0.171645 0.5 554 63.546 1.80427e-05 -3.53982 63.546000 Cu 0.888541 0.166889 7.32504e-17 552 63.546 2.53709e-05 -3.54003 63.546000 Cu 0.869537 0.150263 0.5 553 63.546 2.03424e-05 -3.53993 63.546000 Cu 0.954529 0.162136 0.5 558 63.546 7.50758e-06 -3.53992 63.546000 Cu 0.907476 0.183523 0.5 584 63.546 1.83503e-05 -3.54001 63.546000 Cu 0.973498 0.178776 0 586 63.546 2.281e-05 -3.53999 63.546000 Cu 0.0584581 0.190654 5.30102e-18 587 63.546 3.89689e-05 -3.53971 63.546000 Cu 0.124461 0.185903 0.5 593 63.546 2.15182e-05 -3.53974 63.546000 Cu 0.0113049 0.212014 1.53248e-16 618 63.546 2.32211e-06 -3.53967 63.546000 Cu 0.0773581 0.207268 0.5 620 63.546 1.47762e-05 -3.53957 63.546000 Cu 0.143396 0.202517 1.05057e-16 622 63.546 2.75106e-05 -3.53957 63.546000 Cu 0.162241 0.219126 0.5 625 63.546 4.95981e-06 -3.53965 63.546000 Cu 0.228271 0.214375 0 623 63.546 6.70392e-06 -3.53965 63.546000 Cu 0.209409 0.197763 0.5 624 63.546 1.67963e-05 -3.53963 63.546000 Cu 0.275416 0.193009 3.08423e-17 626 63.546 1.00321e-05 -3.5397 63.546000 Cu 0.294304 0.20963 0.5 629 63.546 2.57429e-06 -3.53972 63.546000 Cu 0.492419 0.195401 2.31317e-17 542 63.546 1.74349e-05 -3.53972 63.546000 Cu 0.360327 0.204888 2.0674e-16 627 63.546 1.50912e-06 -3.53982 63.546000 Cu 0.341439 0.188264 0.5 628 63.546 5.9609e-06 -3.53984 63.546000 Cu 0.426375 0.200144 0.5 632 63.546 4.03995e-06 -3.53981 63.546000 Cu 0.379209 0.221509 0.5 659 63.546 1.21216e-05 -3.53982 63.546000 Cu 0.445248 0.216762 0 661 63.546 6.5542e-06 -3.53975 63.546000 Cu 0.624461 0.185903 0 544 63.546 2.15182e-05 -3.53974 63.546000 Cu 0.558458 0.190654 0.5 546 63.546 3.89689e-05 -3.53971 63.546000 Cu 0.511305 0.212014 0.5 573 63.546 2.32211e-06 -3.53967 63.546000 Cu 0.577358 0.207268 0 574 63.546 1.47762e-05 -3.53957 63.546000 Cu 0.643396 0.202517 0.5 576 63.546 2.75106e-05 -3.53957 63.546000 Cu 0.662241 0.219126 0 575 63.546 4.95981e-06 -3.53965 63.546000 Cu 0.709409 0.197763 4.81911e-19 578 63.546 1.67963e-05 -3.53963 63.546000 Cu 0.794304 0.20963 4.3372e-17 579 63.546 2.57429e-06 -3.53972 63.546000 Cu 0.775416 0.193009 0.5 580 63.546 1.00321e-05 -3.5397 63.546000 Cu 0.728271 0.214375 0.5 581 63.546 6.70392e-06 -3.53965 63.546000 Cu 0.992419 0.195401 0.5 589 63.546 1.74349e-05 -3.53972 63.546000 Cu 0.841439 0.188264 6.21665e-17 582 63.546 5.9609e-06 -3.53984 63.546000 Cu 0.926375 0.200144 5.87931e-17 583 63.546 4.03995e-06 -3.53981 63.546000 Cu 0.860327 0.204888 0.5 585 63.546 1.50912e-06 -3.53982 63.546000 Cu 0.879209 0.221509 4.81911e-19 614 63.546 1.21216e-05 -3.53982 63.546000 Cu 0.945248 0.216762 0.5 616 63.546 6.5542e-06 -3.53975 63.546000 Cu 0.0961985 0.223876 0 619 63.546 1.3765e-05 -3.53969 63.546000 Cu 0.0301696 0.228625 0.5 621 63.546 1.39306e-05 -3.53973 63.546000 Cu 0.049098 0.245234 9.01173e-17 649 63.546 2.67225e-06 -3.53983 63.546000 Cu 0.134053 0.257088 7.71057e-17 650 63.546 3.07149e-05 -3.53984 63.546000 Cu 0.115102 0.240483 0.5 651 63.546 5.57939e-06 -3.53984 63.546000 Cu 0.181128 0.235732 1.34935e-17 653 63.546 1.10971e-05 -3.5399 63.546000 Cu 0.266084 0.247601 1.03611e-16 654 63.546 2.65174e-06 -3.53978 63.546000 Cu 0.24716 0.23099 0.5 655 63.546 6.20679e-06 -3.53988 63.546000 Cu 0.20006 0.252342 0.5 656 63.546 5.9136e-06 -3.53981 63.546000 Cu 0.313181 0.226251 1.30598e-16 657 63.546 9.83697e-06 -3.53987 63.546000 Cu 0.332107 0.242865 0.5 660 63.546 1.07107e-05 -3.53976 63.546000 Cu 0.483086 0.249983 0 602 63.546 1.42973e-05 -3.53972 63.546000 Cu 0.398139 0.238121 2.02403e-17 658 63.546 6.05492e-06 -3.53979 63.546000 Cu 0.464146 0.233373 0.5 662 63.546 6.65851e-06 -3.53977 63.546000 Cu 0.417054 0.254725 0.5 691 63.546 6.01107e-06 -3.5396 63.546000 Cu 0.53017 0.228625 1.20478e-16 572 63.546 1.39306e-05 -3.53973 63.546000 Cu 0.596198 0.223876 0.5 577 63.546 1.3765e-05 -3.53969 63.546000 Cu 0.549098 0.245234 0.5 604 63.546 2.67225e-06 -3.53983 63.546000 Cu 0.615102 0.240483 4.3372e-17 606 63.546 5.57939e-06 -3.53984 63.546000 Cu 0.634053 0.257088 0.5 609 63.546 3.07149e-05 -3.53984 63.546000 Cu 0.70006 0.252342 0 607 63.546 5.9136e-06 -3.53981 63.546000 Cu 0.681128 0.235732 0.5 608 63.546 1.10971e-05 -3.5399 63.546000 Cu 0.74716 0.23099 4.81911e-19 610 63.546 6.20679e-06 -3.53988 63.546000 Cu 0.813181 0.226251 0.5 612 63.546 9.83697e-06 -3.53987 63.546000 Cu 0.766084 0.247601 0.5 613 63.546 2.65174e-06 -3.53978 63.546000 Cu 0.832107 0.242865 8.77078e-17 611 63.546 1.07107e-05 -3.53976 63.546000 Cu 0.964146 0.233373 4.77092e-17 615 63.546 6.65851e-06 -3.53977 63.546000 Cu 0.898139 0.238121 0.5 617 63.546 6.05492e-06 -3.53979 63.546000 Cu 0.917054 0.254725 1.38308e-16 645 63.546 6.01107e-06 -3.5396 63.546000 Cu 0.983086 0.249983 0.5 647 63.546 1.42973e-05 -3.53972 63.546000 Cu 0.00195732 0.26659 4.81911e-19 646 63.546 1.82181e-06 -3.5396 63.546000 Cu 0.0680013 0.261844 0.5 652 63.546 8.05481e-06 -3.53974 63.546000 Cu 0.0208391 0.283202 0.5 679 63.546 3.90099e-06 -3.53995 63.546000 Cu 0.0868597 0.278452 1.99511e-16 681 63.546 1.10967e-05 -3.54008 63.546000 Cu 0.152911 0.273701 0.5 683 63.546 5.44123e-06 -3.54004 63.546000 Cu 0.105764 0.29507 0.5 684 63.546 2.30166e-05 -3.54024 63.546000 Cu 0.171814 0.290311 0 682 63.546 6.98835e-06 -3.54008 63.546000 Cu 0.218963 0.268951 1.54693e-16 685 63.546 4.77927e-06 -3.53973 63.546000 Cu 0.303902 0.280811 2.1686e-17 686 63.546 5.44903e-06 -3.53959 63.546000 Cu 0.284988 0.264208 0.5 687 63.546 1.1775e-06 -3.53954 63.546000 Cu 0.237863 0.285557 0.5 688 63.546 4.79647e-06 -3.53977 63.546000 Cu 0.351014 0.259465 1.24815e-16 689 63.546 1.65087e-06 -3.53956 63.546000 Cu 0.435927 0.27133 0 690 63.546 5.976e-06 -3.53967 63.546000 Cu 0.36992 0.276071 0.5 692 63.546 3.08656e-06 -3.53961 63.546000 Cu 0.388818 0.29268 1.22405e-16 720 63.546 9.04449e-06 -3.53968 63.546000 Cu 0.454822 0.287946 0.5 722 63.546 3.57595e-06 -3.53969 63.546000 Cu 0.568001 0.261844 1.16622e-16 603 63.546 8.05481e-06 -3.53974 63.546000 Cu 0.501957 0.26659 0.5 605 63.546 1.82181e-06 -3.5396 63.546000 Cu 0.520839 0.283202 3.90348e-17 633 63.546 3.90099e-06 -3.53995 63.546000 Cu 0.605764 0.29507 1.74934e-16 634 63.546 2.30166e-05 -3.54024 63.546000 Cu 0.58686 0.278452 0.5 635 63.546 1.10967e-05 -3.54008 63.546000 Cu 0.652911 0.273701 1.65777e-16 637 63.546 5.44123e-06 -3.54004 63.546000 Cu 0.737863 0.285557 1.46019e-16 638 63.546 4.79647e-06 -3.53977 63.546000 Cu 0.718963 0.268951 0.5 639 63.546 4.77927e-06 -3.53973 63.546000 Cu 0.671814 0.290311 0.5 640 63.546 6.98835e-06 -3.54008 63.546000 Cu 0.784988 0.264208 8.19248e-17 641 63.546 1.1775e-06 -3.53954 63.546000 Cu 0.803902 0.280811 0.5 644 63.546 5.44903e-06 -3.53959 63.546000 Cu 0.86992 0.276071 9.63821e-19 642 63.546 3.08656e-06 -3.53961 63.546000 Cu 0.851014 0.259465 0.5 643 63.546 1.65087e-06 -3.53956 63.546000 Cu 0.935927 0.27133 0.5 648 63.546 5.976e-06 -3.53967 63.546000 Cu 0.888818 0.29268 0.5 675 63.546 9.04449e-06 -3.53968 63.546000 Cu 0.954822 0.287946 9.59002e-17 677 63.546 3.57595e-06 -3.53969 63.546000 Cu 0.0397098 0.299824 4.3372e-17 678 63.546 2.12818e-05 -3.53991 63.546000 Cu 0.0775301 0.333042 0 709 63.546 6.43048e-05 -3.54025 63.546000 Cu 0.0585651 0.316436 0.5 710 63.546 8.63965e-05 -3.54004 63.546000 Cu 0.124634 0.311671 9.78279e-17 712 63.546 2.9831e-05 -3.53992 63.546000 Cu 0.143582 0.328258 0.5 715 63.546 5.24543e-05 -3.53997 63.546000 Cu 0.209652 0.323501 2.21679e-17 713 63.546 6.09644e-05 -3.53963 63.546000 Cu 0.190739 0.306909 0.5 714 63.546 1.18776e-05 -3.53985 63.546000 Cu 0.256806 0.302161 4.81911e-19 716 63.546 2.33191e-05 -3.53967 63.546000 Cu 0.322806 0.297421 0.5 718 63.546 7.38806e-06 -3.5397 63.546000 Cu 0.275716 0.318767 0.5 719 63.546 2.05168e-05 -3.53941 63.546000 Cu 0.492571 0.321193 0.5 664 63.546 4.52008e-05 -3.54005 63.546000 Cu 0.341736 0.314038 2.26498e-17 717 63.546 1.44953e-05 -3.53932 63.546000 Cu 0.473698 0.304562 2.38546e-16 721 63.546 9.61935e-06 -3.5396 63.546000 Cu 0.407706 0.309303 0.5 723 63.546 8.63029e-06 -3.53946 63.546000 Cu 0.360665 0.330651 0.5 750 63.546 6.32625e-05 -3.53932 63.546000 Cu 0.426618 0.325929 1.92282e-16 752 63.546 1.78978e-05 -3.53958 63.546000 Cu 0.53971 0.299824 0.5 636 63.546 2.12818e-05 -3.53991 63.546000 Cu 0.558565 0.316436 1.28188e-16 665 63.546 8.63965e-05 -3.54004 63.546000 Cu 0.643582 0.328258 7.85515e-17 666 63.546 5.24543e-05 -3.53997 63.546000 Cu 0.624634 0.311671 0.5 667 63.546 2.9831e-05 -3.53992 63.546000 Cu 0.57753 0.333042 0.5 668 63.546 6.43048e-05 -3.54025 63.546000 Cu 0.690739 0.306909 1.33489e-16 669 63.546 1.18776e-05 -3.53985 63.546000 Cu 0.775716 0.318767 8.52982e-17 670 63.546 2.05168e-05 -3.53941 63.546000 Cu 0.756806 0.302161 0.5 671 63.546 2.33191e-05 -3.53967 63.546000 Cu 0.709652 0.323501 0.5 672 63.546 6.09644e-05 -3.53963 63.546000 Cu 0.822806 0.297421 2.06258e-16 673 63.546 7.38806e-06 -3.5397 63.546000 Cu 0.992571 0.321193 1.54211e-17 708 63.546 4.52008e-05 -3.54005 63.546000 Cu 0.907706 0.309303 3.04568e-16 674 63.546 8.63029e-06 -3.53946 63.546000 Cu 0.841736 0.314038 0.5 676 63.546 1.44953e-05 -3.53932 63.546000 Cu 0.973698 0.304562 0.5 680 63.546 9.61935e-06 -3.5396 63.546000 Cu 0.860665 0.330651 1.71078e-16 704 63.546 6.32625e-05 -3.53932 63.546000 Cu 0.926618 0.325929 0.5 706 63.546 1.78978e-05 -3.53958 63.546000 Cu 0.0114873 0.337823 0.5 711 63.546 0.000169182 -3.54034 63.546000 Cu 0.030443 0.354422 3.13242e-17 740 63.546 0.000171504 -3.54036 63.546000 Cu 0.11564 0.366183 1.00719e-16 741 63.546 9.80985e-05 -3.54016 63.546000 Cu 0.096545 0.349621 0.5 742 63.546 3.47569e-05 -3.54014 63.546000 Cu 0.162639 0.34484 1.22405e-16 744 63.546 7.49494e-05 -3.53991 63.546000 Cu 0.24775 0.356702 3.13242e-17 745 63.546 0.000201265 -3.53921 63.546000 Cu 0.22868 0.340094 0.5 746 63.546 9.4603e-05 -3.5395 63.546000 Cu 0.181716 0.361419 0.5 747 63.546 0.000214131 -3.5396 63.546000 Cu 0.294671 0.335372 1.10358e-16 748 63.546 7.87998e-05 -3.53933 63.546000 Cu 0.313688 0.352003 0.5 751 63.546 0.000111566 -3.53927 63.546000 Cu 0.332647 0.368668 4.3372e-17 779 63.546 9.45274e-05 -3.53919 63.546000 Cu 0.379571 0.347298 4.81911e-19 749 63.546 3.38696e-05 -3.53975 63.546000 Cu 0.445489 0.342577 0.5 753 63.546 0.000127845 -3.54016 63.546000 Cu 0.398498 0.363969 0.5 781 63.546 0.000223463 -3.53996 63.546000 Cu 0.464413 0.359217 1.03129e-16 783 63.546 0.000377052 -3.54028 63.546000 Cu 0.511487 0.337823 4.3372e-17 663 63.546 0.000169182 -3.54034 63.546000 Cu 0.530443 0.354422 0.5 694 63.546 0.000171504 -3.54036 63.546000 Cu 0.596545 0.349621 1.60476e-16 696 63.546 3.47569e-05 -3.54014 63.546000 Cu 0.61564 0.366183 0.5 699 63.546 9.80985e-05 -3.54016 63.546000 Cu 0.662639 0.34484 0.5 698 63.546 7.49494e-05 -3.53991 63.546000 Cu 0.681716 0.361419 7.13228e-17 697 63.546 0.000214131 -3.5396 63.546000 Cu 0.72868 0.340094 6.40941e-17 700 63.546 9.4603e-05 -3.5395 63.546000 Cu 0.813688 0.352003 9.05992e-17 701 63.546 0.000111566 -3.53927 63.546000 Cu 0.794671 0.335372 0.5 702 63.546 7.87998e-05 -3.53933 63.546000 Cu 0.74775 0.356702 0.5 703 63.546 0.000201265 -3.53921 63.546000 Cu 0.832647 0.368668 0.5 734 63.546 9.45274e-05 -3.53919 63.546000 Cu 0.945489 0.342577 3.46976e-17 705 63.546 0.000127845 -3.54016 63.546000 Cu 0.879571 0.347298 0.5 707 63.546 3.38696e-05 -3.53975 63.546000 Cu 0.898498 0.363969 4.3372e-17 736 63.546 0.000223463 -3.53996 63.546000 Cu 0.964413 0.359217 0.5 738 63.546 0.000377052 -3.54028 63.546000 Cu 0.0495214 0.370993 0.5 743 63.546 7.09059e-05 -3.54052 63.546000 Cu 0.00244589 0.392394 0.5 769 63.546 0.000370937 -3.54082 63.546000 Cu 0.0686306 0.387539 2.60232e-17 771 63.546 0.000162287 -3.54018 63.546000 Cu 0.154045 0.399268 7.08409e-17 772 63.546 0.00179715 -3.53811 63.546000 Cu 0.134802 0.38273 0.5 773 63.546 0.000381436 -3.53962 63.546000 Cu 0.0879227 0.404045 0.5 774 63.546 0.000543709 -3.53993 63.546000 Cu 0.200882 0.377997 3.05531e-16 775 63.546 0.000705893 -3.53863 63.546000 Cu 0.28576 0.390012 1.02165e-16 776 63.546 0.000475297 -3.53827 63.546000 Cu 0.266815 0.373332 0.5 777 63.546 0.000403446 -3.53835 63.546000 Cu 0.219988 0.394609 0.5 778 63.546 0.00175462 -3.53692 63.546000 Cu 0.304425 0.406775 0.5 808 63.546 0.00123064 -3.53947 63.546000 Cu 0.483411 0.375821 0.5 695 63.546 0.00033582 -3.54062 63.546000 Cu 0.41739 0.380631 5.59016e-17 780 63.546 0.00069784 -3.54082 63.546000 Cu 0.351515 0.38537 0.5 782 63.546 0.000504346 -3.5401 63.546000 Cu 0.370224 0.402082 1.01683e-16 810 63.546 0.0021412 -3.54208 63.546000 Cu 0.436264 0.397264 0.5 812 63.546 0.00128119 -3.54169 63.546000 Cu 0.549521 0.370993 8.48163e-17 693 63.546 7.09059e-05 -3.54052 63.546000 Cu 0.502446 0.392394 7.42143e-17 724 63.546 0.000370937 -3.54082 63.546000 Cu 0.587923 0.404045 5.68655e-17 725 63.546 0.000543709 -3.53993 63.546000 Cu 0.568631 0.387539 0.5 726 63.546 0.000162287 -3.54018 63.546000 Cu 0.634802 0.38273 1.01201e-17 728 63.546 0.000381436 -3.53962 63.546000 Cu 0.654045 0.399268 0.5 731 63.546 0.00179715 -3.53811 63.546000 Cu 0.719988 0.394609 4.81911e-19 729 63.546 0.00175462 -3.53692 63.546000 Cu 0.700882 0.377997 0.5 730 63.546 0.000705893 -3.53863 63.546000 Cu 0.766815 0.373332 2.43847e-16 732 63.546 0.000403446 -3.53835 63.546000 Cu 0.78576 0.390012 0.5 735 63.546 0.000475297 -3.53827 63.546000 Cu 0.804425 0.406775 4.3372e-17 763 63.546 0.00123064 -3.53947 63.546000 Cu 0.851515 0.38537 4.43358e-17 733 63.546 0.000504346 -3.5401 63.546000 Cu 0.983411 0.375821 2.74689e-17 737 63.546 0.00033582 -3.54062 63.546000 Cu 0.91739 0.380631 0.5 739 63.546 0.00069784 -3.54082 63.546000 Cu 0.870224 0.402082 0.5 765 63.546 0.0021412 -3.54208 63.546000 Cu 0.936264 0.397264 2.22643e-16 767 63.546 0.00128119 -3.54169 63.546000 Cu 0.02165 0.408916 9.54183e-17 768 63.546 0.000437733 -3.54123 63.546000 Cu 0.0607939 0.441695 9.49364e-17 799 63.546 0.0177823 -3.54482 63.546000 Cu 0.0411154 0.42536 0.5 800 63.546 0.00181542 -3.54383 63.546000 Cu 0.107426 0.42054 4.81911e-19 802 63.546 0.00337846 -3.53669 63.546000 Cu 0.127371 0.437028 0.5 805 63.546 0.0248242 -3.527 63.546000 Cu 0.192499 0.432597 4.81911e-19 803 63.546 0.0102568 -3.52546 63.546000 Cu 0.173371 0.415844 0.5 804 63.546 0.00660877 -3.53369 63.546000 Cu 0.238923 0.411323 1.88909e-16 806 63.546 0.00201141 -3.53476 63.546000 Cu 0.322825 0.42357 0 807 63.546 0.00692947 -3.54256 63.546000 Cu 0.257506 0.428203 0.5 809 63.546 0.00403315 -3.53547 63.546000 Cu 0.474372 0.430262 0.5 424 63.546 0.00209571 -3.54554 63.546000 Cu 0.407678 0.435228 2.74689e-17 425 63.546 0.00264043 -3.53905 63.546000 Cu 0.455279 0.413806 4.3372e-17 811 63.546 0.00108569 -3.54244 63.546000 Cu 0.388859 0.418732 0.5 813 63.546 0.00390753 -3.54315 63.546000 Cu 0.341167 0.440284 0.5 836 63.546 0.0138253 -3.53906 63.546000 Cu 0.52165 0.408916 0.5 727 63.546 0.000437733 -3.54123 63.546000 Cu 0.541115 0.42536 0 755 63.546 0.00181542 -3.54383 63.546000 Cu 0.627371 0.437028 1.21442e-16 756 63.546 0.0248242 -3.527 63.546000 Cu 0.607426 0.42054 0.5 757 63.546 0.00337846 -3.53669 63.546000 Cu 0.560794 0.441695 0.5 758 63.546 0.0177823 -3.54482 63.546000 Cu 0.673371 0.415844 1.0602e-17 759 63.546 0.00660877 -3.53369 63.546000 Cu 0.757506 0.428203 4.14443e-17 760 63.546 0.00403315 -3.53547 63.546000 Cu 0.738923 0.411323 0.5 761 63.546 0.00201141 -3.53476 63.546000 Cu 0.692499 0.432597 0.5 762 63.546 0.0102568 -3.52546 63.546000 Cu 0.822825 0.42357 0.5 766 63.546 0.00692947 -3.54256 63.546000 Cu 0.888859 0.418732 3.85529e-17 764 63.546 0.00390753 -3.54315 63.546000 Cu 0.955279 0.413806 0.5 770 63.546 0.00108569 -3.54244 63.546000 Cu 0.841167 0.440284 1.24333e-16 794 63.546 0.0138253 -3.53906 63.546000 Cu 0.907678 0.435228 0.5 796 63.546 0.00264043 -3.53905 63.546000 Cu 0.974372 0.430262 5.68655e-17 798 63.546 0.00209571 -3.54554 63.546000 Cu 0.0115232 0.462462 1.03129e-16 826 63.546 0.215954 -3.47757 63.546000 Cu 0.0975721 0.47407 1.10839e-16 827 63.546 2.24924 -3.48695 63.546000 Cu 0.0810844 0.457706 0.5 828 63.546 0.134069 -3.52738 63.546000 Cu 0.031209 0.477487 0.5 829 63.546 8.92455 -3.33463 63.546000 Cu 0.147191 0.453915 0 830 63.546 0.0729554 -3.51903 63.546000 Cu 0.275735 0.445288 8.24067e-17 834 63.546 0.0394415 -3.54157 63.546000 Cu 0.316493 0.477993 4.3372e-17 10 63.546 7.44743 -3.37636 63.546000 Cu 0.294404 0.462113 0.5 426 63.546 0.154075 -3.50115 63.546000 Cu 0.230447 0.467699 1.21442e-16 831 63.546 0.287978 -3.49123 63.546000 Cu 0.211415 0.449683 0.5 832 63.546 0.0233911 -3.51305 63.546000 Cu 0.16711 0.471096 0.5 833 63.546 0.421664 -3.48801 63.546000 Cu 0.445976 0.468184 0 3 63.546 0.146332 -3.49646 63.546000 Cu 0.381434 0.473512 0.5 6 63.546 1.64922 -3.48375 63.546000 Cu 0.426255 0.451676 0.5 421 63.546 0.0195253 -3.52084 63.546000 Cu 0.493392 0.44653 0 754 63.546 0.011391 -3.54652 63.546000 Cu 0.360768 0.456708 0 835 63.546 0.0141873 -3.5284 63.546000 Cu 0.531209 0.477487 2.1686e-17 784 63.546 8.92455 -3.33463 63.546000 Cu 0.511523 0.462462 0.5 785 63.546 0.215954 -3.47757 63.546000 Cu 0.581084 0.457706 1.1855e-16 786 63.546 0.134069 -3.52738 63.546000 Cu 0.647191 0.453915 0.5 788 63.546 0.0729554 -3.51903 63.546000 Cu 0.597572 0.47407 0.5 789 63.546 2.24924 -3.48695 63.546000 Cu 0.775735 0.445288 0.5 792 63.546 0.0394415 -3.54157 63.546000 Cu 0.66711 0.471096 7.61419e-17 787 63.546 0.421664 -3.48801 63.546000 Cu 0.711415 0.449683 1.21442e-16 790 63.546 0.0233911 -3.51305 63.546000 Cu 0.794404 0.462113 4.81911e-19 791 63.546 0.154075 -3.50115 63.546000 Cu 0.730447 0.467699 0.5 793 63.546 0.287978 -3.49123 63.546000 Cu 0.816493 0.477993 0.5 820 63.546 7.44743 -3.37636 63.546000 Cu 0.993392 0.44653 0.5 801 63.546 0.011391 -3.54652 63.546000 Cu 0.926255 0.451676 2.79508e-17 795 63.546 0.0195253 -3.52084 63.546000 Cu 0.860768 0.456708 0.5 797 63.546 0.0141873 -3.5284 63.546000 Cu 0.881434 0.473512 4.09624e-17 822 63.546 1.64922 -3.48375 63.546000 Cu 0.945976 0.468184 0.5 824 63.546 0.146332 -3.49646 63.546000 Cu 0.158029 0.508378 0.5 12 63.546 1.5288 -3.4374 63.546000 Cu 0.109909 0.489356 0.5 411 63.546 8.51 -3.27177 63.546000 Cu 0.0858359 0.50375 1.85536e-16 413 63.546 3.7338 -3.51793 63.546000 Cu 0.000315814 0.515467 4.81911e-19 7 63.546 1.06931 -3.47731 63.546000 Cu 0.0184597 0.499782 0.5 419 63.546 9.95596 -3.36639 63.546000 Cu 0.252587 0.48644 0.5 24 63.546 8.12233 -3.52445 63.546000 Cu 0.220212 0.512096 1.22405e-16 14 63.546 1.81571 -3.42906 63.546000 Cu 0.302036 0.500446 0 26 63.546 12.0205 -3.33804 63.546000 Cu 0.180802 0.489669 6.31303e-17 406 63.546 6.06921 -3.51013 63.546000 Cu 0.284346 0.516791 0.5 16 63.546 1.00405 -3.48196 63.546000 Cu 0.471016 0.486082 0.5 1 63.546 8.3435 -3.57668 63.546000 Cu 0.43491 0.510661 4.3372e-17 2 63.546 2.1459 -3.43406 63.546000 Cu 0.369171 0.50412 0.5 5 63.546 4.06799 -3.52236 63.546000 Cu 0.400824 0.489276 1.65295e-16 8 63.546 10.8692 -3.36407 63.546000 Cu 0.500316 0.515467 0.5 4 63.546 1.06931 -3.47731 63.546000 Cu 0.51846 0.499782 0 814 63.546 9.95596 -3.36639 63.546000 Cu 0.658029 0.508378 3.90348e-17 27 63.546 1.5288 -3.4374 63.546000 Cu 0.585836 0.50375 0.5 815 63.546 3.7338 -3.51793 63.546000 Cu 0.609909 0.489356 2.77099e-16 816 63.546 8.51 -3.27177 63.546000 Cu 0.752587 0.48644 1.04575e-16 818 63.546 8.12233 -3.52445 63.546000 Cu 0.720212 0.512096 0.5 29 63.546 1.81571 -3.42906 63.546000 Cu 0.680802 0.489669 0.5 817 63.546 6.06921 -3.51013 63.546000 Cu 0.802036 0.500446 0.5 821 63.546 12.0205 -3.33804 63.546000 Cu 0.784346 0.516791 0 31 63.546 1.00405 -3.48196 63.546000 Cu 0.93491 0.510661 0.5 9 63.546 2.1459 -3.43406 63.546000 Cu 0.869171 0.50412 4.3372e-17 819 63.546 4.06799 -3.52236 63.546000 Cu 0.971016 0.486082 5.49378e-17 823 63.546 8.3435 -3.57668 63.546000 Cu 0.900824 0.489276 0.5 825 63.546 10.8692 -3.36407 63.546000 Cu 0.134912 0.524661 1.22405e-16 11 63.546 0.0362011 -3.52516 63.546000 Cu 0.069008 0.520141 0.5 13 63.546 0.0513224 -3.53444 63.546000 Cu 0.0487114 0.536419 1.00237e-16 39 63.546 0.00787577 -3.54132 63.546000 Cu 0.115108 0.541252 0.5 41 63.546 0.00136508 -3.538 63.546000 Cu 0.0292431 0.552977 0.5 42 63.546 0.000943414 -3.54035 63.546000 Cu 0.265563 0.533815 4.04805e-17 15 63.546 0.00449498 -3.53727 63.546000 Cu 0.200793 0.52951 0.5 17 63.546 0.0471936 -3.49936 63.546000 Cu 0.330482 0.538414 0.5 21 63.546 0.00826988 -3.5324 63.546000 Cu 0.180913 0.546015 4.3372e-17 43 63.546 0.00339442 -3.53346 63.546000 Cu 0.246617 0.550694 0.5 45 63.546 0.00508198 -3.53291 63.546000 Cu 0.312112 0.555276 0 47 63.546 0.00120712 -3.53882 63.546000 Cu 0.349551 0.521597 1.17104e-16 18 63.546 0.034981 -3.52215 63.546000 Cu 0.396404 0.543244 0 19 63.546 0.00705492 -3.54394 63.546000 Cu 0.414577 0.52672 0.5 20 63.546 0.0459586 -3.50191 63.546000 Cu 0.482113 0.531807 4.81911e-19 22 63.546 0.00956488 -3.53815 63.546000 Cu 0.462785 0.548101 0.5 23 63.546 0.00416822 -3.54407 63.546000 Cu 0.569008 0.520141 4.3372e-17 25 63.546 0.0513224 -3.53444 63.546000 Cu 0.634912 0.524661 0.5 30 63.546 0.0362011 -3.52516 63.546000 Cu 0.529243 0.552977 0 55 63.546 0.000943414 -3.54035 63.546000 Cu 0.548711 0.536419 0.5 56 63.546 0.00787577 -3.54132 63.546000 Cu 0.615108 0.541252 4.3372e-17 57 63.546 0.00136508 -3.538 63.546000 Cu 0.700793 0.52951 1.04575e-16 28 63.546 0.0471936 -3.49936 63.546000 Cu 0.830482 0.538414 0 32 63.546 0.00826988 -3.5324 63.546000 Cu 0.765563 0.533815 0.5 34 63.546 0.00449498 -3.53727 63.546000 Cu 0.680913 0.546015 0.5 59 63.546 0.00339442 -3.53346 63.546000 Cu 0.746617 0.550694 4.3372e-17 61 63.546 0.00508198 -3.53291 63.546000 Cu 0.812112 0.555276 0.5 63 63.546 0.00120712 -3.53882 63.546000 Cu 0.849551 0.521597 0.5 33 63.546 0.034981 -3.52215 63.546000 Cu 0.914577 0.52672 2.40955e-18 35 63.546 0.0459586 -3.50191 63.546000 Cu 0.962785 0.548101 0 36 63.546 0.00416822 -3.54407 63.546000 Cu 0.982113 0.531807 0.5 37 63.546 0.00956488 -3.53815 63.546000 Cu 0.896404 0.543244 0.5 38 63.546 0.00705492 -3.54394 63.546000 Cu 0.095361 0.557774 1.52284e-16 40 63.546 0.000235552 -3.53978 63.546000 Cu 0.161441 0.562595 0.5 46 63.546 0.000584481 -3.53962 63.546000 Cu 0.0098329 0.569517 6.60218e-17 69 63.546 0.000688507 -3.54071 63.546000 Cu 0.0567209 0.590928 0 70 63.546 0.000191201 -3.54038 63.546000 Cu 0.0759652 0.57434 0.5 71 63.546 0.000141804 -3.53965 63.546000 Cu 0.142019 0.579146 4.81911e-17 73 63.546 7.03651e-05 -3.53959 63.546000 Cu 0.227335 0.567338 1.54211e-17 44 63.546 0.00112878 -3.53787 63.546000 Cu 0.293214 0.572016 0.5 50 63.546 0.000878804 -3.53808 63.546000 Cu 0.208054 0.583928 0.5 75 63.546 0.000277232 -3.53928 63.546000 Cu 0.274049 0.588656 4.81911e-19 77 63.546 0.000375275 -3.53869 63.546000 Cu 0.358983 0.576678 1.80717e-16 48 63.546 0.000184671 -3.53994 63.546000 Cu 0.377832 0.559936 0.5 49 63.546 0.00138294 -3.54299 63.546000 Cu 0.443766 0.564706 4.81911e-19 51 63.546 0.00128928 -3.5433 63.546000 Cu 0.490736 0.586145 7.13228e-17 52 63.546 0.000308011 -3.54082 63.546000 Cu 0.42482 0.581386 0.5 54 63.546 0.000265785 -3.54082 63.546000 Cu 0.509833 0.569517 0.5 53 63.546 0.000688507 -3.54071 63.546000 Cu 0.661441 0.562595 1.59031e-17 58 63.546 0.000584481 -3.53962 63.546000 Cu 0.595361 0.557774 0.5 60 63.546 0.000235552 -3.53978 63.546000 Cu 0.575965 0.57434 5.34921e-17 85 63.546 0.000141804 -3.53965 63.546000 Cu 0.642019 0.579146 0.5 87 63.546 7.03651e-05 -3.53959 63.546000 Cu 0.556721 0.590928 0.5 88 63.546 0.000191201 -3.54038 63.546000 Cu 0.793214 0.572016 4.3372e-17 62 63.546 0.000878804 -3.53808 63.546000 Cu 0.727335 0.567338 0.5 64 63.546 0.00112878 -3.53787 63.546000 Cu 0.708054 0.583928 9.63821e-17 89 63.546 0.000277232 -3.53928 63.546000 Cu 0.774049 0.588656 0.5 91 63.546 0.000375275 -3.53869 63.546000 Cu 0.877832 0.559936 8.6262e-17 65 63.546 0.00138294 -3.54299 63.546000 Cu 0.92482 0.581386 4.3372e-17 66 63.546 0.000265785 -3.54082 63.546000 Cu 0.943766 0.564706 0.5 67 63.546 0.00128928 -3.5433 63.546000 Cu 0.858983 0.576678 0.5 68 63.546 0.000184671 -3.53994 63.546000 Cu 0.990736 0.586145 0.5 72 63.546 0.000308011 -3.54082 63.546000 Cu 0.122719 0.59572 0.5 76 63.546 0.000100232 -3.53992 63.546000 Cu 0.0184954 0.62418 4.3372e-17 98 63.546 4.34002e-05 -3.54005 63.546000 Cu 0.0375562 0.607555 0.5 99 63.546 0.000114411 -3.5404 63.546000 Cu 0.103567 0.612308 3.99986e-17 101 63.546 7.77395e-05 -3.54 63.546000 Cu 0.0844034 0.628922 0.5 104 63.546 4.39775e-05 -3.53982 63.546000 Cu 0.169516 0.617076 0.5 103 63.546 5.82497e-05 -3.54017 63.546000 Cu 0.188789 0.600491 1.45537e-16 74 63.546 2.38542e-05 -3.53981 63.546000 Cu 0.320743 0.610004 4.48177e-17 78 63.546 0.000121066 -3.5393 63.546000 Cu 0.2548 0.605259 0.5 80 63.546 0.000107346 -3.53939 63.546000 Cu 0.235518 0.621851 1.67705e-16 105 63.546 2.59386e-05 -3.53995 63.546000 Cu 0.301466 0.626612 0.5 107 63.546 9.32923e-05 -3.53955 63.546000 Cu 0.339927 0.59337 0.5 79 63.546 0.000239537 -3.53907 63.546000 Cu 0.40581 0.598077 6.65037e-17 81 63.546 9.86916e-05 -3.53989 63.546000 Cu 0.452532 0.61946 8.96354e-17 82 63.546 4.31221e-05 -3.53988 63.546000 Cu 0.471639 0.602805 0.5 83 63.546 8.31176e-05 -3.54019 63.546000 Cu 0.386632 0.614737 0.5 84 63.546 0.000100615 -3.53947 63.546000 Cu 0.622719 0.59572 5.59016e-17 86 63.546 0.000100232 -3.53992 63.546000 Cu 0.537556 0.607555 0 115 63.546 0.000114411 -3.5404 63.546000 Cu 0.603567 0.612308 0.5 117 63.546 7.77395e-05 -3.54 63.546000 Cu 0.518495 0.62418 0.5 118 63.546 4.34002e-05 -3.54005 63.546000 Cu 0.584403 0.628922 6.60218e-17 116 63.546 4.39775e-05 -3.53982 63.546000 Cu 0.669516 0.617076 4.81911e-19 119 63.546 5.82497e-05 -3.54017 63.546000 Cu 0.7548 0.605259 4.81911e-19 90 63.546 0.000107346 -3.53939 63.546000 Cu 0.688789 0.600491 0.5 92 63.546 2.38542e-05 -3.53981 63.546000 Cu 0.820743 0.610004 0.5 96 63.546 0.000121066 -3.5393 63.546000 Cu 0.735518 0.621851 0.5 121 63.546 2.59386e-05 -3.53995 63.546000 Cu 0.801466 0.626612 4.81911e-19 123 63.546 9.32923e-05 -3.53955 63.546000 Cu 0.839927 0.59337 2.65051e-17 93 63.546 0.000239537 -3.53907 63.546000 Cu 0.886632 0.614737 9.25269e-17 94 63.546 0.000100615 -3.53947 63.546000 Cu 0.90581 0.598077 0.5 95 63.546 9.86916e-05 -3.53989 63.546000 Cu 0.971639 0.602805 1.39754e-17 97 63.546 8.31176e-05 -3.54019 63.546000 Cu 0.952532 0.61946 0.5 100 63.546 4.31221e-05 -3.53988 63.546000 Cu 0.150338 0.633682 3.7589e-17 102 63.546 2.71858e-05 -3.53996 63.546000 Cu 0.0652594 0.645545 4.3372e-17 131 63.546 1.88723e-05 -3.53964 63.546000 Cu 0.13117 0.650285 0.5 133 63.546 0.00010529 -3.53994 63.546000 Cu 0.0461675 0.662165 0.5 134 63.546 1.64301e-05 -3.53964 63.546000 Cu 0.282335 0.643206 0 106 63.546 5.02492e-06 -3.5398 63.546000 Cu 0.21631 0.638448 0.5 108 63.546 2.76208e-05 -3.54004 63.546000 Cu 0.197189 0.655045 4.3372e-17 135 63.546 1.36206e-05 -3.54011 63.546000 Cu 0.263213 0.659802 0.5 137 63.546 1.15279e-05 -3.53997 63.546000 Cu 0.329185 0.664556 1.83126e-17 139 63.546 7.793e-06 -3.53974 63.546000 Cu 0.367462 0.631357 2.12041e-17 109 63.546 6.37537e-05 -3.53936 63.546000 Cu 0.414293 0.652693 3.7589e-17 110 63.546 8.17194e-06 -3.53931 63.546000 Cu 0.433429 0.636085 0.5 111 63.546 2.48845e-05 -3.53941 63.546000 Cu 0.348348 0.647955 0.5 112 63.546 2.83074e-05 -3.53951 63.546000 Cu 0.499368 0.640816 1.06502e-16 113 63.546 2.37547e-05 -3.53974 63.546000 Cu 0.480209 0.657426 0.5 114 63.546 1.20551e-05 -3.53948 63.546000 Cu 0.650338 0.633682 0.5 122 63.546 2.71858e-05 -3.53996 63.546000 Cu 0.546168 0.662165 5.54197e-17 146 63.546 1.64301e-05 -3.53964 63.546000 Cu 0.565259 0.645545 0.5 147 63.546 1.88723e-05 -3.53964 63.546000 Cu 0.63117 0.650285 0 148 63.546 0.00010529 -3.53994 63.546000 Cu 0.71631 0.638448 1.44573e-17 120 63.546 2.76208e-05 -3.54004 63.546000 Cu 0.782335 0.643206 0.5 126 63.546 5.02492e-06 -3.5398 63.546000 Cu 0.697189 0.655045 0.5 150 63.546 1.36206e-05 -3.54011 63.546000 Cu 0.763213 0.659802 8.67439e-18 152 63.546 1.15279e-05 -3.53997 63.546000 Cu 0.829185 0.664556 0.5 154 63.546 7.793e-06 -3.53974 63.546000 Cu 0.848348 0.647955 4.81911e-19 124 63.546 2.83074e-05 -3.53951 63.546000 Cu 0.867462 0.631357 0.5 125 63.546 6.37537e-05 -3.53936 63.546000 Cu 0.933429 0.636085 4.81911e-19 127 63.546 2.48845e-05 -3.53941 63.546000 Cu 0.980209 0.657426 0 128 63.546 1.20551e-05 -3.53948 63.546000 Cu 0.999368 0.640816 0.5 129 63.546 2.37547e-05 -3.53974 63.546000 Cu 0.914293 0.652693 0.5 130 63.546 8.17194e-06 -3.53931 63.546000 Cu 0.112129 0.666906 2.52521e-16 132 63.546 9.15175e-06 -3.53986 63.546000 Cu 0.0270734 0.67877 2.07222e-17 160 63.546 4.53762e-06 -3.53955 63.546000 Cu 0.0739587 0.700117 4.3372e-17 161 63.546 1.78223e-05 -3.53973 63.546000 Cu 0.0930699 0.683509 0.5 162 63.546 1.63609e-05 -3.53959 63.546000 Cu 0.00798914 0.695379 0.5 163 63.546 1.38323e-05 -3.53975 63.546000 Cu 0.159046 0.688263 2.45293e-16 164 63.546 1.87228e-05 -3.53994 63.546000 Cu 0.244069 0.676404 0 136 63.546 2.02529e-05 -3.53993 63.546000 Cu 0.178105 0.671646 0.5 138 63.546 2.23374e-05 -3.5401 63.546000 Cu 0.310031 0.68116 0.5 142 63.546 1.98467e-05 -3.53963 63.546000 Cu 0.225012 0.693015 0.5 166 63.546 1.15853e-05 -3.53982 63.546000 Cu 0.290948 0.697765 8.6262e-17 168 63.546 6.45684e-06 -3.53973 63.546000 Cu 0.375984 0.685908 6.26484e-18 140 63.546 3.4691e-05 -3.53965 63.546000 Cu 0.395124 0.669301 0.5 141 63.546 1.35334e-05 -3.53977 63.546000 Cu 0.461093 0.674039 4.81911e-19 143 63.546 1.03865e-05 -3.53979 63.546000 Cu 0.442001 0.690648 0.5 145 63.546 5.54297e-06 -3.53972 63.546000 Cu 0.356944 0.702513 0.5 170 63.546 3.36798e-05 -3.53975 63.546000 Cu 0.507989 0.695379 9.1563e-18 144 63.546 1.38323e-05 -3.53975 63.546000 Cu 0.612129 0.666906 0.5 151 63.546 9.15175e-06 -3.53986 63.546000 Cu 0.527073 0.67877 0.5 176 63.546 4.53762e-06 -3.53955 63.546000 Cu 0.59307 0.683509 5.54197e-17 177 63.546 1.63609e-05 -3.53959 63.546000 Cu 0.659046 0.688263 0.5 179 63.546 1.87228e-05 -3.53994 63.546000 Cu 0.573959 0.700117 0.5 180 63.546 1.78223e-05 -3.53973 63.546000 Cu 0.678105 0.671646 7.42143e-17 149 63.546 2.23374e-05 -3.5401 63.546000 Cu 0.810031 0.68116 6.93951e-17 153 63.546 1.98467e-05 -3.53963 63.546000 Cu 0.744069 0.676404 0.5 155 63.546 2.02529e-05 -3.53993 63.546000 Cu 0.725012 0.693015 3.51795e-17 181 63.546 1.15853e-05 -3.53982 63.546000 Cu 0.790948 0.697765 0.5 183 63.546 6.45684e-06 -3.53973 63.546000 Cu 0.895124 0.669301 1.25297e-16 156 63.546 1.35334e-05 -3.53977 63.546000 Cu 0.942001 0.690648 5.25283e-17 157 63.546 5.54297e-06 -3.53972 63.546000 Cu 0.961093 0.674039 0.5 158 63.546 1.03865e-05 -3.53979 63.546000 Cu 0.875984 0.685908 0.5 159 63.546 3.4691e-05 -3.53965 63.546000 Cu 0.856944 0.702513 2.2698e-16 185 63.546 3.36798e-05 -3.53975 63.546000 Cu 0.139914 0.704864 0.5 167 63.546 1.0912e-05 -3.53974 63.546000 Cu 0.0356567 0.733347 8.57801e-17 190 63.546 4.92901e-06 -3.53984 63.546000 Cu 0.0548046 0.716733 0.5 191 63.546 3.73026e-06 -3.53984 63.546000 Cu 0.120781 0.721469 0 193 63.546 2.24922e-05 -3.53984 63.546000 Cu 0.10161 0.738083 0.5 196 63.546 6.29782e-06 -3.53979 63.546000 Cu 0.205913 0.709622 0 165 63.546 3.57997e-05 -3.5398 63.546000 Cu 0.271867 0.714374 0.5 171 63.546 3.29494e-05 -3.53987 63.546000 Cu 0.18672 0.726215 0.5 195 63.546 1.81128e-05 -3.53973 63.546000 Cu 0.252678 0.730976 1.92764e-18 197 63.546 7.49002e-06 -3.53986 63.546000 Cu 0.318626 0.735736 0.5 199 63.546 3.88515e-05 -3.54006 63.546000 Cu 0.337795 0.719124 1.83126e-17 169 63.546 5.69037e-06 -3.54008 63.546000 Cu 0.422888 0.707254 1.6144e-16 172 63.546 1.681e-05 -3.53991 63.546000 Cu 0.469693 0.728613 3.37338e-17 173 63.546 7.44005e-06 -3.53987 63.546000 Cu 0.488866 0.711998 0.5 174 63.546 1.24633e-05 -3.53995 63.546000 Cu 0.403735 0.723874 0.5 175 63.546 1.00165e-05 -3.54005 63.546000 Cu 0.384613 0.740487 1.74934e-16 201 63.546 1.59824e-05 -3.53999 63.546000 Cu 0.639914 0.704864 3.13242e-17 178 63.546 1.0912e-05 -3.53974 63.546000 Cu 0.554805 0.716733 1.62404e-16 206 63.546 3.73026e-06 -3.53984 63.546000 Cu 0.60161 0.738083 0 207 63.546 6.29782e-06 -3.53979 63.546000 Cu 0.620781 0.721469 0.5 208 63.546 2.24922e-05 -3.53984 63.546000 Cu 0.535657 0.733347 0.5 209 63.546 4.92901e-06 -3.53984 63.546000 Cu 0.771867 0.714374 1.04575e-16 182 63.546 3.29494e-05 -3.53987 63.546000 Cu 0.705913 0.709622 0.5 184 63.546 3.57997e-05 -3.5398 63.546000 Cu 0.68672 0.726215 5.34921e-17 210 63.546 1.81128e-05 -3.53973 63.546000 Cu 0.752678 0.730976 0.5 212 63.546 7.49002e-06 -3.53986 63.546000 Cu 0.818626 0.735736 0 214 63.546 3.88515e-05 -3.54006 63.546000 Cu 0.837795 0.719124 0.5 188 63.546 5.69037e-06 -3.54008 63.546000 Cu 0.903735 0.723874 7.18047e-17 186 63.546 1.00165e-05 -3.54005 63.546000 Cu 0.922888 0.707254 0.5 187 63.546 1.681e-05 -3.53991 63.546000 Cu 0.988866 0.711998 0 189 63.546 1.24633e-05 -3.53995 63.546000 Cu 0.969693 0.728613 0.5 192 63.546 7.44005e-06 -3.53987 63.546000 Cu 0.884613 0.740487 0.5 216 63.546 1.59824e-05 -3.53999 63.546000 Cu 0.0165419 0.749968 0.5 220 63.546 6.34676e-06 -3.5398 63.546000 Cu 0.0824597 0.754698 5.15644e-17 222 63.546 2.43915e-05 -3.53957 63.546000 Cu 0.129362 0.776039 7.22866e-18 223 63.546 3.14903e-05 -3.53948 63.546000 Cu 0.14842 0.759428 0.5 224 63.546 2.06958e-05 -3.53949 63.546000 Cu 0.0633978 0.771315 0.5 225 63.546 1.04163e-06 -3.53951 63.546000 Cu 0.167535 0.742819 2.64569e-16 194 63.546 3.86184e-05 -3.53964 63.546000 Cu 0.299516 0.752334 2.40955e-17 198 63.546 7.58679e-06 -3.53988 63.546000 Cu 0.233492 0.747568 0.5 200 63.546 5.12604e-05 -3.53976 63.546000 Cu 0.2144 0.764165 0 226 63.546 3.87335e-05 -3.53959 63.546000 Cu 0.280408 0.768921 0.5 228 63.546 2.85059e-05 -3.53974 63.546000 Cu 0.431497 0.76185 1.68669e-16 202 63.546 3.08085e-05 -3.53978 63.546000 Cu 0.450577 0.745229 0.5 203 63.546 5.56701e-06 -3.5399 63.546000 Cu 0.365535 0.7571 0.5 204 63.546 5.72818e-05 -3.53989 63.546000 Cu 0.497434 0.766587 0.5 205 63.546 1.16181e-05 -3.53965 63.546000 Cu 0.346393 0.773694 1.70596e-16 230 63.546 6.31901e-06 -3.53972 63.546000 Cu 0.516542 0.749968 1.40718e-16 236 63.546 6.34676e-06 -3.5398 63.546000 Cu 0.563398 0.771315 1.32525e-16 237 63.546 1.04163e-06 -3.53951 63.546000 Cu 0.58246 0.754698 0.5 238 63.546 2.43915e-05 -3.53957 63.546000 Cu 0.64842 0.759428 1.20478e-17 239 63.546 2.06958e-05 -3.53949 63.546000 Cu 0.629362 0.776039 0.5 242 63.546 3.14903e-05 -3.53948 63.546000 Cu 0.667535 0.742819 0.5 213 63.546 3.86184e-05 -3.53964 63.546000 Cu 0.733492 0.747568 4.81911e-19 211 63.546 5.12604e-05 -3.53976 63.546000 Cu 0.799516 0.752334 0.5 217 63.546 7.58679e-06 -3.53988 63.546000 Cu 0.7144 0.764165 0.5 241 63.546 3.87335e-05 -3.53959 63.546000 Cu 0.780408 0.768921 4.81911e-19 243 63.546 2.85059e-05 -3.53974 63.546000 Cu 0.865535 0.7571 0 215 63.546 5.72818e-05 -3.53989 63.546000 Cu 0.950577 0.745229 0 218 63.546 5.56701e-06 -3.5399 63.546000 Cu 0.997434 0.766587 0 219 63.546 1.16181e-05 -3.53965 63.546000 Cu 0.931497 0.76185 0.5 221 63.546 3.08085e-05 -3.53978 63.546000 Cu 0.846393 0.773694 0.5 245 63.546 6.31901e-06 -3.53972 63.546000 Cu 0.0443275 0.787934 1.20478e-17 251 63.546 4.9782e-05 -3.53972 63.546000 Cu 0.0910492 0.809302 1.58549e-16 252 63.546 3.46783e-05 -3.53979 63.546000 Cu 0.110226 0.792662 0.5 253 63.546 1.96441e-05 -3.53978 63.546000 Cu 0.0251622 0.804566 0.5 254 63.546 3.02316e-05 -3.53995 63.546000 Cu 0.156951 0.814019 0.5 258 63.546 5.5566e-05 -3.53952 63.546000 Cu 0.261253 0.785521 0 227 63.546 3.17254e-05 -3.53993 63.546000 Cu 0.195309 0.78077 0.5 229 63.546 6.03936e-05 -3.53972 63.546000 Cu 0.327234 0.790283 0.5 233 63.546 9.45402e-06 -3.53996 63.546000 Cu 0.176134 0.797395 1.21923e-16 255 63.546 1.69164e-05 -3.53981 63.546000 Cu 0.242073 0.802129 0.5 257 63.546 3.40933e-05 -3.53981 63.546000 Cu 0.308072 0.806879 4.3372e-17 259 63.546 2.84586e-05 -3.54015 63.546000 Cu 0.393253 0.795051 0 231 63.546 1.79213e-05 -3.53999 63.546000 Cu 0.412391 0.778459 0.5 232 63.546 5.10285e-05 -3.53969 63.546000 Cu 0.478369 0.783202 1.22405e-16 234 63.546 3.54574e-05 -3.5397 63.546000 Cu 0.459254 0.799815 0.5 235 63.546 7.51404e-05 -3.53994 63.546000 Cu 0.374077 0.811649 0.5 261 63.546 1.21284e-05 -3.54028 63.546000 Cu 0.525162 0.804566 4.3372e-17 267 63.546 3.02316e-05 -3.53995 63.546000 Cu 0.544327 0.787934 0.5 268 63.546 4.9782e-05 -3.53972 63.546000 Cu 0.610226 0.792662 4.3372e-17 269 63.546 1.96441e-05 -3.53978 63.546000 Cu 0.656951 0.814019 8.14429e-17 270 63.546 5.5566e-05 -3.53952 63.546000 Cu 0.591049 0.809302 0.5 272 63.546 3.46783e-05 -3.53979 63.546000 Cu 0.695309 0.78077 5.3974e-17 240 63.546 6.03936e-05 -3.53972 63.546000 Cu 0.827234 0.790283 1.01683e-16 244 63.546 9.45402e-06 -3.53996 63.546000 Cu 0.761253 0.785521 0.5 246 63.546 3.17254e-05 -3.53993 63.546000 Cu 0.676134 0.797395 0.5 271 63.546 1.69164e-05 -3.53981 63.546000 Cu 0.742073 0.802129 0 273 63.546 3.40933e-05 -3.53981 63.546000 Cu 0.808072 0.806879 0.5 275 63.546 2.84586e-05 -3.54015 63.546000 Cu 0.912391 0.778459 5.97569e-17 247 63.546 5.10285e-05 -3.53969 63.546000 Cu 0.959254 0.799815 0 248 63.546 7.51404e-05 -3.53994 63.546000 Cu 0.978369 0.783202 0.5 249 63.546 3.54574e-05 -3.5397 63.546000 Cu 0.893253 0.795051 0.5 250 63.546 1.79213e-05 -3.53999 63.546000 Cu 0.874077 0.811649 0 277 63.546 1.21284e-05 -3.54028 63.546000 Cu 0.00600138 0.821195 5.83112e-17 281 63.546 7.82971e-05 -3.53986 63.546000 Cu 0.0528959 0.842567 4.3372e-17 282 63.546 7.40678e-05 -3.53976 63.546000 Cu 0.0719557 0.825937 0.5 283 63.546 4.42463e-05 -3.53963 63.546000 Cu 0.137888 0.830655 4.3372e-17 285 63.546 9.77966e-06 -3.53942 63.546000 Cu 0.118811 0.847301 0.5 288 63.546 4.59562e-05 -3.53936 63.546000 Cu 0.222909 0.818738 0 256 63.546 7.56986e-05 -3.53954 63.546000 Cu 0.288868 0.823482 0.5 262 63.546 6.04997e-05 -3.53991 63.546000 Cu 0.203775 0.835364 0.5 287 63.546 6.36963e-05 -3.53944 63.546000 Cu 0.2697 0.840092 1.22405e-16 289 63.546 0.000126683 -3.53971 63.546000 Cu 0.335701 0.844851 0.5 291 63.546 5.73748e-05 -3.5401 63.546000 Cu 0.35486 0.828253 0 260 63.546 2.08943e-05 -3.54024 63.546000 Cu 0.440043 0.816426 0 263 63.546 2.43039e-05 -3.54012 63.546000 Cu 0.486915 0.837809 2.17824e-16 264 63.546 4.56231e-05 -3.54 63.546000 Cu 0.420878 0.833036 0.5 266 63.546 3.09052e-05 -3.5402 63.546000 Cu 0.401768 0.849632 4.81911e-19 293 63.546 1.10135e-05 -3.54032 63.546000 Cu 0.506001 0.821195 0.5 265 63.546 7.82971e-05 -3.53986 63.546000 Cu 0.571956 0.825937 1.09394e-16 297 63.546 4.42463e-05 -3.53963 63.546000 Cu 0.618811 0.847301 4.3372e-17 298 63.546 4.59562e-05 -3.53936 63.546000 Cu 0.637888 0.830655 0.5 299 63.546 9.77966e-06 -3.53942 63.546000 Cu 0.552896 0.842567 0.5 300 63.546 7.40678e-05 -3.53976 63.546000 Cu 0.788868 0.823482 6.21665e-17 274 63.546 6.04997e-05 -3.53991 63.546000 Cu 0.722909 0.818738 0.5 276 63.546 7.56986e-05 -3.53954 63.546000 Cu 0.703775 0.835364 0 301 63.546 6.36963e-05 -3.53944 63.546000 Cu 0.7697 0.840092 0.5 303 63.546 0.000126683 -3.53971 63.546000 Cu 0.835701 0.844851 1.12285e-16 305 63.546 5.73748e-05 -3.5401 63.546000 Cu 0.920878 0.833036 5.54197e-17 278 63.546 3.09052e-05 -3.5402 63.546000 Cu 0.940043 0.816426 0.5 279 63.546 2.43039e-05 -3.54012 63.546000 Cu 0.85486 0.828253 0.5 280 63.546 2.08943e-05 -3.54024 63.546000 Cu 0.986915 0.837809 0.5 284 63.546 4.56231e-05 -3.54 63.546000 Cu 0.901768 0.849632 0.5 307 63.546 1.10135e-05 -3.54032 63.546000 Cu 0.0147459 0.875832 5.30102e-17 310 63.546 0.000250537 -3.54083 63.546000 Cu 0.033802 0.859198 0.5 311 63.546 0.000100381 -3.54031 63.546000 Cu 0.0997021 0.863949 4.3372e-17 313 63.546 0.000115381 -3.53969 63.546000 Cu 0.146598 0.885327 6.16846e-17 314 63.546 0.000349365 -3.53988 63.546000 Cu 0.165584 0.868655 0.5 315 63.546 7.65176e-05 -3.53891 63.546000 Cu 0.0807234 0.880609 0.5 316 63.546 0.000364864 -3.5407 63.546000 Cu 0.184677 0.852009 2.00475e-16 286 63.546 2.27818e-05 -3.53911 63.546000 Cu 0.316588 0.861441 4.81911e-19 290 63.546 0.000134669 -3.53996 63.546000 Cu 0.250599 0.856711 0.5 292 63.546 0.000116149 -3.53933 63.546000 Cu 0.231469 0.873333 1.59031e-17 317 63.546 0.000231143 -3.53859 63.546000 Cu 0.297451 0.87803 0.5 319 63.546 0.000336098 -3.53915 63.546000 Cu 0.44872 0.871023 8.0961e-17 294 63.546 8.99416e-05 -3.54076 63.546000 Cu 0.467805 0.85442 0.5 295 63.546 5.09129e-05 -3.54045 63.546000 Cu 0.382653 0.866217 0.5 296 63.546 3.9005e-05 -3.54058 63.546000 Cu 0.363516 0.882783 4.81911e-19 321 63.546 0.000187613 -3.54007 63.546000 Cu 0.429661 0.8876 0.5 323 63.546 0.000188325 -3.54052 63.546000 Cu 0.533802 0.859198 1.19996e-16 327 63.546 0.000100381 -3.54031 63.546000 Cu 0.580723 0.880609 4.91549e-17 328 63.546 0.000364864 -3.5407 63.546000 Cu 0.599702 0.863949 0.5 329 63.546 0.000115381 -3.53969 63.546000 Cu 0.514746 0.875832 0.5 330 63.546 0.000250537 -3.54083 63.546000 Cu 0.665584 0.868655 4.81911e-19 331 63.546 7.65176e-05 -3.53891 63.546000 Cu 0.646598 0.885327 0.5 334 63.546 0.000349365 -3.53988 63.546000 Cu 0.684677 0.852009 0.5 304 63.546 2.27818e-05 -3.53911 63.546000 Cu 0.750599 0.856711 6.26484e-18 302 63.546 0.000116149 -3.53933 63.546000 Cu 0.816588 0.861441 0.5 308 63.546 0.000134669 -3.53996 63.546000 Cu 0.731469 0.873333 0.5 333 63.546 0.000231143 -3.53859 63.546000 Cu 0.797451 0.87803 4.3372e-17 335 63.546 0.000336098 -3.53915 63.546000 Cu 0.882653 0.866217 4.3372e-17 306 63.546 3.9005e-05 -3.54058 63.546000 Cu 0.967805 0.85442 0 309 63.546 5.09129e-05 -3.54045 63.546000 Cu 0.94872 0.871023 0.5 312 63.546 8.99416e-05 -3.54076 63.546000 Cu 0.863516 0.882783 0.5 337 63.546 0.000187613 -3.54007 63.546000 Cu 0.929661 0.8876 2.31317e-17 339 63.546 0.000188325 -3.54052 63.546000 Cu 0.0619108 0.89726 4.81911e-19 343 63.546 0.000941113 -3.5415 63.546000 Cu 0.109481 0.918702 6.31303e-17 344 63.546 0.0031538 -3.54296 63.546000 Cu 0.127911 0.902034 0.5 345 63.546 0.00128365 -3.54183 63.546000 Cu 0.0430986 0.913838 0.5 346 63.546 0.00152552 -3.54219 63.546000 Cu 0.278309 0.894619 2.21679e-17 318 63.546 0.00139091 -3.53729 63.546000 Cu 0.212426 0.889984 0.5 320 63.546 0.000637055 -3.53848 63.546000 Cu 0.193756 0.906711 4.3372e-17 347 63.546 0.000872009 -3.5396 63.546000 Cu 0.259426 0.911283 0.5 349 63.546 0.00248766 -3.53523 63.546000 Cu 0.175578 0.923495 0.5 350 63.546 0.00492562 -3.54262 63.546000 Cu 0.32511 0.915858 6.93951e-17 351 63.546 0.00567458 -3.53375 63.546000 Cu 0.410505 0.904113 4.81911e-19 322 63.546 0.000316109 -3.53974 63.546000 Cu 0.34434 0.899321 0.5 324 63.546 0.000994466 -3.53802 63.546000 Cu 0.49579 0.892436 0 325 63.546 0.000466652 -3.54085 63.546000 Cu 0.476788 0.908979 0.5 326 63.546 0.000837882 -3.54106 63.546000 Cu 0.39114 0.92058 0.5 353 63.546 0.00266582 -3.53637 63.546000 Cu 0.457501 0.925411 1.13249e-16 355 63.546 0.00186503 -3.54348 63.546000 Cu 0.543099 0.913838 2.89146e-18 358 63.546 0.00152552 -3.54219 63.546000 Cu 0.561911 0.89726 0.5 359 63.546 0.000941113 -3.5415 63.546000 Cu 0.627911 0.902034 4.81911e-19 360 63.546 0.00128365 -3.54183 63.546000 Cu 0.609481 0.918702 0.5 363 63.546 0.0031538 -3.54296 63.546000 Cu 0.712426 0.889984 7.13228e-17 332 63.546 0.000637055 -3.53848 63.546000 Cu 0.778309 0.894619 0.5 338 63.546 0.00139091 -3.53729 63.546000 Cu 0.675578 0.923495 8.04791e-17 361 63.546 0.00492562 -3.54262 63.546000 Cu 0.693756 0.906711 0.5 362 63.546 0.000872009 -3.5396 63.546000 Cu 0.759426 0.911283 1.92764e-16 364 63.546 0.00248766 -3.53523 63.546000 Cu 0.82511 0.915858 0.5 366 63.546 0.00567458 -3.53375 63.546000 Cu 0.84434 0.899321 2.34209e-16 336 63.546 0.000994466 -3.53802 63.546000 Cu 0.976788 0.908979 0 340 63.546 0.000837882 -3.54106 63.546000 Cu 0.99579 0.892436 0.5 341 63.546 0.000466652 -3.54085 63.546000 Cu 0.910505 0.904113 0.5 342 63.546 0.000316109 -3.53974 63.546000 Cu 0.89114 0.92058 1.01683e-16 368 63.546 0.00266582 -3.53637 63.546000 Cu 0.957501 0.925411 0.5 370 63.546 0.00186503 -3.54348 63.546000 Cu 0.0242619 0.930309 6.40941e-17 372 63.546 0.0028442 -3.54536 63.546000 Cu 0.0727456 0.951697 5.06006e-17 373 63.546 0.0204815 -3.52046 63.546000 Cu 0.0910031 0.935224 0.5 374 63.546 0.00280686 -3.53911 63.546000 Cu 0.00553802 0.946573 0.5 375 63.546 0.0115996 -3.54595 63.546000 Cu 0.157519 0.940222 8.19248e-18 376 63.546 0.012081 -3.5388 63.546000 Cu 0.138274 0.956663 0.5 379 63.546 0.0132167 -3.52821 63.546000 Cu 0.240996 0.928119 8.19248e-17 348 63.546 0.0032937 -3.53608 63.546000 Cu 0.306112 0.93256 0.5 354 63.546 0.0103813 -3.5264 63.546000 Cu 0.204659 0.961991 1.00719e-16 377 63.546 0.149765 -3.50064 63.546000 Cu 0.222998 0.945179 0.5 378 63.546 0.032718 -3.54144 63.546000 Cu 0.287428 0.949587 1.51802e-16 380 63.546 0.0222209 -3.51411 63.546000 Cu 0.371375 0.93703 5.83112e-17 352 63.546 0.0231923 -3.52746 63.546000 Cu 0.43804 0.941721 0.5 357 63.546 0.0172675 -3.54457 63.546000 Cu 0.351746 0.953871 0.5 382 63.546 0.0712806 -3.52004 63.546000 Cu 0.417964 0.957699 3.46976e-17 384 63.546 0.13054 -3.52748 63.546000 Cu 0.487654 0.962478 0.5 386 63.546 0.209924 -3.47558 63.546000 Cu 0.505538 0.946573 9.54183e-17 356 63.546 0.0115996 -3.54595 63.546000 Cu 0.524262 0.930309 0.5 388 63.546 0.0028442 -3.54536 63.546000 Cu 0.591003 0.935224 0 389 63.546 0.00280686 -3.53911 63.546000 Cu 0.638274 0.956663 6.98771e-17 390 63.546 0.0132167 -3.52821 63.546000 Cu 0.657519 0.940222 0.5 391 63.546 0.012081 -3.5388 63.546000 Cu 0.572746 0.951697 0.5 392 63.546 0.0204815 -3.52046 63.546000 Cu 0.806112 0.93256 4.3372e-17 365 63.546 0.0103813 -3.5264 63.546000 Cu 0.740996 0.928119 0.5 367 63.546 0.0032937 -3.53608 63.546000 Cu 0.722998 0.945179 4.81911e-19 393 63.546 0.032718 -3.54144 63.546000 Cu 0.787428 0.949587 0.5 395 63.546 0.0222209 -3.51411 63.546000 Cu 0.704659 0.961991 0.5 396 63.546 0.149765 -3.50064 63.546000 Cu 0.93804 0.941721 8.72258e-17 369 63.546 0.0172675 -3.54457 63.546000 Cu 0.871375 0.93703 0.5 371 63.546 0.0231923 -3.52746 63.546000 Cu 0.851746 0.953871 5.34921e-17 397 63.546 0.0712806 -3.52004 63.546000 Cu 0.917964 0.957699 0.5 399 63.546 0.13054 -3.52748 63.546000 Cu 0.987654 0.962478 1.3108e-16 401 63.546 0.209924 -3.47558 63.546000 Cu 0.0286233 0.986044 1.99029e-16 402 63.546 8.32827 -3.5783 63.546000 Cu 0.0533423 0.968194 0.5 403 63.546 0.149358 -3.49647 63.546000 Cu 0.118003 0.973465 4.81911e-19 405 63.546 1.6436 -3.48299 63.546000 Cu 0.0989273 0.989209 0.5 408 63.546 10.8371 -3.3632 63.546000 Cu 0.332002 0.971015 0 381 63.546 0.422456 -3.49052 63.546000 Cu 0.268691 0.96752 0.5 383 63.546 0.258245 -3.49256 63.546000 Cu 0.183017 0.977901 0.5 407 63.546 7.42739 -3.37728 63.546000 Cu 0.246954 0.986302 0 409 63.546 8.13003 -3.52612 63.546000 Cu 0.318577 0.989482 0.5 410 63.546 6.17902 -3.50906 63.546000 Cu 0.481511 0.999736 4.81911e-19 427 63.546 9.99613 -3.3649 63.546000 Cu 0.468137 0.977476 2.93966e-17 385 63.546 6.55333 -3.33567 63.546000 Cu 0.401565 0.974009 0.5 387 63.546 2.20627 -3.48586 63.546000 Cu 0.38949 0.989298 4.3372e-17 412 63.546 8.55683 -3.27085 63.546000 Cu 0.553342 0.968194 2.1686e-17 414 63.546 0.149358 -3.49647 63.546000 Cu 0.598927 0.989209 1.80717e-16 415 63.546 10.8371 -3.3632 63.546000 Cu 0.618003 0.973465 0.5 416 63.546 1.6436 -3.48299 63.546000 Cu 0.528623 0.986044 0.5 417 63.546 8.32827 -3.5783 63.546000 Cu 0.768691 0.96752 1.32525e-16 394 63.546 0.258245 -3.49256 63.546000 Cu 0.832002 0.971015 0.5 400 63.546 0.422456 -3.49052 63.546000 Cu 0.683017 0.977901 5.87931e-17 418 63.546 7.42739 -3.37728 63.546000 Cu 0.746954 0.986302 0.5 420 63.546 8.13003 -3.52612 63.546000 Cu 0.818577 0.989482 4.14443e-17 422 63.546 6.17902 -3.50906 63.546000 Cu 0.981511 0.999736 0.5 446 63.546 9.99613 -3.3649 63.546000 Cu 0.901565 0.974009 1.92764e-18 398 63.546 2.20627 -3.48586 63.546000 Cu 0.968137 0.977476 0.5 404 63.546 6.55333 -3.33567 63.546000 Cu 0.88949 0.989298 0.5 423 63.546 8.55683 -3.27085