Number of particles = 850 A = 1 Angstrom (basic length-scale) H0(1,1) = 26.3266 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 106.116 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.609 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 0.0645245 0.0189078 1 443 63.546 0.45299 -3.4709 63.546000 Cu 0.0447686 0.00487281 0.5 444 63.546 10.0905 -3.26362 63.546000 Cu 0.128942 0.0135844 0.5 447 63.546 0.418193 -3.47723 63.546000 Cu 0.148323 0.0298375 1.59821e-17 467 63.546 0.0258188 -3.53633 63.546000 Cu 0.195193 0.00929967 0 446 63.546 2.83829 -3.42588 63.546000 Cu 0.262363 0.00524318 0.5 448 63.546 8.89381 -3.35567 63.546000 Cu 0.214342 0.0255055 0.5 469 63.546 0.0834489 -3.53241 63.546000 Cu 0.282617 0.0197053 1 471 63.546 0.348056 -3.47524 63.546000 Cu 0.36561 0.0311558 3.6771e-17 472 63.546 0.0459456 -3.53489 63.546000 Cu 0.347539 0.0141677 0.5 473 63.546 0.491254 -3.47203 63.546000 Cu 0.412307 0.0100734 1 475 63.546 2.89009 -3.42488 63.546000 Cu 0.430107 0.0270031 0.5 478 63.546 0.0259599 -3.53205 63.546000 Cu 0.544769 0.00487281 6.47698e-17 425 63.546 10.0905 -3.26362 63.546000 Cu 0.564525 0.0189078 0.5 427 63.546 0.45299 -3.4709 63.546000 Cu 0.493437 0.0235062 0 476 63.546 0.398656 -3.50398 63.546000 Cu 0.479905 0.00611792 0.5 477 63.546 8.89893 -3.34197 63.546000 Cu 0.628942 0.0135844 1 426 63.546 0.418193 -3.47723 63.546000 Cu 0.695193 0.00929967 0.5 429 63.546 2.83829 -3.42588 63.546000 Cu 0.648323 0.0298375 0.5 432 63.546 0.0258188 -3.53633 63.546000 Cu 0.714342 0.0255055 1 434 63.546 0.0834489 -3.53241 63.546000 Cu 0.762363 0.00524318 1 428 63.546 8.89381 -3.35567 63.546000 Cu 0.782617 0.0197053 0.5 436 63.546 0.348056 -3.47524 63.546000 Cu 0.847539 0.0141677 1.72799e-16 438 63.546 0.491254 -3.47203 63.546000 Cu 0.930107 0.0270031 1 439 63.546 0.0259599 -3.53205 63.546000 Cu 0.912307 0.0100734 0.5 440 63.546 2.89009 -3.42488 63.546000 Cu 0.86561 0.0311558 0.5 441 63.546 0.0459456 -3.53489 63.546000 Cu 0.979905 0.00611792 1 442 63.546 8.89893 -3.34197 63.546000 Cu 0.993437 0.0235062 0.5 445 63.546 0.398656 -3.50398 63.546000 Cu 0.0812498 0.0349264 0.5 465 63.546 0.029351 -3.53609 63.546000 Cu 0.0147659 0.03926 3.32861e-17 463 63.546 0.0371438 -3.53835 63.546000 Cu 0.100142 0.0509377 1 464 63.546 0.0033913 -3.53897 63.546000 Cu 0.0334152 0.0556304 0.5 466 63.546 0.00270394 -3.53945 63.546000 Cu 0.23419 0.0411281 0 468 63.546 0.0245009 -3.53521 63.546000 Cu 0.166492 0.046174 0.5 470 63.546 0.00839069 -3.53829 63.546000 Cu 0.185617 0.0622304 0 498 63.546 0.00495029 -3.53891 63.546000 Cu 0.252035 0.0574355 0.5 500 63.546 0.00648101 -3.53911 63.546000 Cu 0.300273 0.0361823 0.5 474 63.546 0.0320936 -3.53538 63.546000 Cu 0.318164 0.0527004 1.05987e-16 502 63.546 0.00854535 -3.53799 63.546000 Cu 0.4014 0.0648843 1 503 63.546 0.0110518 -3.53882 63.546000 Cu 0.383344 0.0481305 0.5 504 63.546 0.00921886 -3.53725 63.546000 Cu 0.448028 0.0440842 1 506 63.546 0.070312 -3.53381 63.546000 Cu 0.533415 0.0556304 1 507 63.546 0.00270394 -3.53945 63.546000 Cu 0.514766 0.03926 0.5 508 63.546 0.0371438 -3.53835 63.546000 Cu 0.467478 0.0602617 0.5 509 63.546 0.00514453 -3.53969 63.546000 Cu 0.58125 0.0349264 2.74821e-16 430 63.546 0.029351 -3.53609 63.546000 Cu 0.666492 0.046174 1.91425e-16 431 63.546 0.00839069 -3.53829 63.546000 Cu 0.600142 0.0509377 0.5 433 63.546 0.0033913 -3.53897 63.546000 Cu 0.685617 0.0622304 0.5 453 63.546 0.00495029 -3.53891 63.546000 Cu 0.800273 0.0361823 1.12836e-16 435 63.546 0.0320936 -3.53538 63.546000 Cu 0.73419 0.0411281 0.5 437 63.546 0.0245009 -3.53521 63.546000 Cu 0.752035 0.0574355 0 455 63.546 0.00648101 -3.53911 63.546000 Cu 0.818164 0.0527004 0.5 457 63.546 0.00854535 -3.53799 63.546000 Cu 0.883344 0.0481305 1 459 63.546 0.00921886 -3.53725 63.546000 Cu 0.967478 0.0602617 0 460 63.546 0.00514453 -3.53969 63.546000 Cu 0.948028 0.0440842 0.5 461 63.546 0.070312 -3.53381 63.546000 Cu 0.9014 0.0648843 0.5 462 63.546 0.0110518 -3.53882 63.546000 Cu 0.118833 0.067135 0.5 496 63.546 0.00122685 -3.5395 63.546000 Cu 0.0524654 0.0718506 0 494 63.546 0.000463786 -3.5398 63.546000 Cu 0.137689 0.0833246 1 495 63.546 0.0011213 -3.5396 63.546000 Cu 0.0712802 0.0881138 0.5 497 63.546 0.000122245 -3.53982 63.546000 Cu 0.00502462 0.0928543 1 491 63.546 0.00020512 -3.53985 63.546000 Cu 0.270148 0.0738492 0 499 63.546 0.00229776 -3.53959 63.546000 Cu 0.203985 0.0785535 0.5 501 63.546 0.0022478 -3.53965 63.546000 Cu 0.156245 0.0996502 0.5 528 63.546 0.000725111 -3.53983 63.546000 Cu 0.222324 0.0949464 0 530 63.546 0.000833866 -3.53981 63.546000 Cu 0.288277 0.0903278 0.5 532 63.546 0.000417722 -3.53987 63.546000 Cu 0.335928 0.0692787 0.5 505 63.546 0.00145055 -3.53952 63.546000 Cu 0.354111 0.0858099 0 534 63.546 0.00198287 -3.53983 63.546000 Cu 0.420149 0.0812175 0.5 536 63.546 0.00137523 -3.53988 63.546000 Cu 0.57128 0.0881138 1.41436e-16 449 63.546 0.000122245 -3.53982 63.546000 Cu 0.552465 0.0718506 0.5 450 63.546 0.000463786 -3.5398 63.546000 Cu 0.438803 0.0975465 6.71731e-17 535 63.546 0.00048442 -3.53989 63.546000 Cu 0.486192 0.0765917 8.67602e-17 538 63.546 0.000959793 -3.53984 63.546000 Cu 0.505025 0.0928543 0.5 539 63.546 0.00020512 -3.53985 63.546000 Cu 0.618833 0.067135 1 451 63.546 0.00122685 -3.5395 63.546000 Cu 0.703985 0.0785535 4.2539e-17 452 63.546 0.0022478 -3.53965 63.546000 Cu 0.637689 0.0833246 0.5 454 63.546 0.0011213 -3.5396 63.546000 Cu 0.656245 0.0996502 5.64783e-17 482 63.546 0.000725111 -3.53983 63.546000 Cu 0.835928 0.0692787 1 456 63.546 0.00145055 -3.53952 63.546000 Cu 0.770148 0.0738492 0.5 458 63.546 0.00229776 -3.53959 63.546000 Cu 0.722324 0.0949464 0.5 484 63.546 0.000833866 -3.53981 63.546000 Cu 0.788277 0.0903278 1 486 63.546 0.000417722 -3.53987 63.546000 Cu 0.854111 0.0858099 0.5 488 63.546 0.00198287 -3.53983 63.546000 Cu 0.920149 0.0812175 1.54053e-16 490 63.546 0.00137523 -3.53988 63.546000 Cu 0.986192 0.0765917 0.5 492 63.546 0.000959793 -3.53984 63.546000 Cu 0.938803 0.0975465 0.5 493 63.546 0.00048442 -3.53989 63.546000 Cu 0.0424517 0.125425 1 523 63.546 0.000160651 -3.53988 63.546000 Cu 0.0237928 0.109128 0.5 524 63.546 7.52127e-05 -3.53987 63.546000 Cu 0.0900493 0.104389 2.94408e-17 526 63.546 0.000343776 -3.53984 63.546000 Cu 0.108639 0.120717 0.5 529 63.546 0.000274508 -3.53988 63.546000 Cu 0.174711 0.11603 0 527 63.546 0.000233484 -3.5399 63.546000 Cu 0.240719 0.111378 0.5 533 63.546 0.000127008 -3.53994 63.546000 Cu 0.193195 0.132416 0.5 559 63.546 6.39918e-05 -3.53994 63.546000 Cu 0.259202 0.127792 0 561 63.546 0.000122392 -3.53996 63.546000 Cu 0.306644 0.106781 9.30089e-17 531 63.546 0.00045113 -3.53995 63.546000 Cu 0.372681 0.102176 0.5 537 63.546 0.000604091 -3.53994 63.546000 Cu 0.325235 0.123158 0.5 563 63.546 0.000241381 -3.53996 63.546000 Cu 0.391327 0.11851 1.57538e-16 565 63.546 0.000213629 -3.53993 63.546000 Cu 0.542452 0.125425 0.5 481 63.546 0.000160651 -3.53988 63.546000 Cu 0.476216 0.130135 2.14858e-16 566 63.546 4.70747e-05 -3.5399 63.546000 Cu 0.457524 0.113834 0.5 567 63.546 8.72001e-05 -3.53989 63.546000 Cu 0.523793 0.109128 3.36466e-18 569 63.546 7.52127e-05 -3.53987 63.546000 Cu 0.608639 0.120717 2.46101e-16 479 63.546 0.000274508 -3.53988 63.546000 Cu 0.590049 0.104389 0.5 480 63.546 0.000343776 -3.53984 63.546000 Cu 0.674711 0.11603 0.5 485 63.546 0.000233484 -3.5399 63.546000 Cu 0.693195 0.132416 1 514 63.546 6.39918e-05 -3.53994 63.546000 Cu 0.740719 0.111378 1 483 63.546 0.000127008 -3.53994 63.546000 Cu 0.806644 0.106781 0.5 489 63.546 0.00045113 -3.53995 63.546000 Cu 0.759202 0.127792 0.5 516 63.546 0.000122392 -3.53996 63.546000 Cu 0.825235 0.123158 1.95871e-17 518 63.546 0.000241381 -3.53996 63.546000 Cu 0.872681 0.102176 1.75804e-16 487 63.546 0.000604091 -3.53994 63.546000 Cu 0.891327 0.11851 0.5 520 63.546 0.000213629 -3.53993 63.546000 Cu 0.957524 0.113834 0 522 63.546 8.72001e-05 -3.53989 63.546000 Cu 0.976216 0.130135 0.5 525 63.546 4.70747e-05 -3.5399 63.546000 Cu 0.0795036 0.158116 0 554 63.546 5.14337e-05 -3.53994 63.546000 Cu 0.0609783 0.141763 0.5 555 63.546 5.86398e-05 -3.5399 63.546000 Cu 0.0133771 0.16281 0.5 556 63.546 1.8109e-05 -3.53994 63.546000 Cu 0.127112 0.137077 1.37471e-16 557 63.546 8.88097e-05 -3.53992 63.546000 Cu 0.145599 0.153446 0.5 560 63.546 4.1137e-05 -3.53994 63.546000 Cu 0.211677 0.148803 1 558 63.546 3.46468e-05 -3.53996 63.546000 Cu 0.277771 0.144158 0.5 564 63.546 9.23736e-05 -3.53996 63.546000 Cu 0.230212 0.165166 0.5 590 63.546 5.92115e-05 -3.53996 63.546000 Cu 0.343876 0.139501 0 562 63.546 7.19332e-05 -3.53994 63.546000 Cu 0.410013 0.134821 0.5 568 63.546 3.71257e-05 -3.53993 63.546000 Cu 0.296345 0.160503 1 592 63.546 2.38864e-05 -3.53995 63.546000 Cu 0.362497 0.155828 0.5 594 63.546 9.30386e-06 -3.53994 63.546000 Cu 0.428646 0.151153 2.0909e-17 596 63.546 1.89912e-05 -3.53993 63.546000 Cu 0.560978 0.141763 1.49607e-16 510 63.546 5.86398e-05 -3.5399 63.546000 Cu 0.513377 0.16281 6.28471e-17 597 63.546 1.8109e-05 -3.53994 63.546000 Cu 0.494811 0.146453 0.5 598 63.546 5.94295e-05 -3.53992 63.546000 Cu 0.645599 0.153446 3.2445e-17 511 63.546 4.1137e-05 -3.53994 63.546000 Cu 0.627112 0.137077 0.5 512 63.546 8.88097e-05 -3.53992 63.546000 Cu 0.579504 0.158116 0.5 513 63.546 5.14337e-05 -3.53994 63.546000 Cu 0.711677 0.148803 0.5 517 63.546 3.46468e-05 -3.53996 63.546000 Cu 0.777771 0.144158 0 515 63.546 9.23736e-05 -3.53996 63.546000 Cu 0.843876 0.139501 0.5 521 63.546 7.19332e-05 -3.53994 63.546000 Cu 0.730212 0.165166 0 545 63.546 5.92115e-05 -3.53996 63.546000 Cu 0.796345 0.160503 0.5 547 63.546 2.38864e-05 -3.53995 63.546000 Cu 0.910013 0.134821 1 519 63.546 3.71257e-05 -3.53993 63.546000 Cu 0.862497 0.155828 1 549 63.546 9.30386e-06 -3.53994 63.546000 Cu 0.928646 0.151153 0.5 551 63.546 1.89912e-05 -3.53993 63.546000 Cu 0.994811 0.146453 0 553 63.546 5.94295e-05 -3.53992 63.546000 Cu 0.0319749 0.17916 1 584 63.546 2.75474e-05 -3.53995 63.546000 Cu 0.116643 0.190858 1 585 63.546 8.4168e-06 -3.53996 63.546000 Cu 0.098066 0.174488 0.5 586 63.546 1.1387e-05 -3.53995 63.546000 Cu 0.0505471 0.195529 0.5 587 63.546 6.64323e-06 -3.53996 63.546000 Cu 0.164139 0.169823 1 588 63.546 1.29744e-05 -3.53997 63.546000 Cu 0.248836 0.181515 1 589 63.546 1.17591e-05 -3.53996 63.546000 Cu 0.182712 0.186193 0.5 591 63.546 4.40262e-05 -3.53996 63.546000 Cu 0.267468 0.19787 0.5 622 63.546 1.23684e-05 -3.53997 63.546000 Cu 0.381101 0.172172 1.04184e-16 593 63.546 4.79163e-06 -3.53996 63.546000 Cu 0.314949 0.176843 0.5 595 63.546 1.21461e-05 -3.53995 63.546000 Cu 0.333599 0.193192 0 624 63.546 2.98915e-05 -3.53997 63.546000 Cu 0.399702 0.188523 0.5 626 63.546 8.82896e-06 -3.53996 63.546000 Cu 0.550547 0.195529 1 540 63.546 6.64323e-06 -3.53996 63.546000 Cu 0.447244 0.167492 0.5 599 63.546 5.70048e-06 -3.53994 63.546000 Cu 0.465847 0.183843 6.88554e-17 628 63.546 6.18093e-06 -3.53995 63.546000 Cu 0.531975 0.17916 0.5 629 63.546 2.75474e-05 -3.53995 63.546000 Cu 0.598066 0.174488 1 541 63.546 1.1387e-05 -3.53995 63.546000 Cu 0.682712 0.186193 9.61332e-18 542 63.546 4.40262e-05 -3.53996 63.546000 Cu 0.664139 0.169823 0.5 543 63.546 1.29744e-05 -3.53997 63.546000 Cu 0.616643 0.190858 0.5 544 63.546 8.4168e-06 -3.53996 63.546000 Cu 0.814949 0.176843 2.44539e-16 546 63.546 1.21461e-05 -3.53995 63.546000 Cu 0.748836 0.181515 0.5 548 63.546 1.17591e-05 -3.53996 63.546000 Cu 0.767468 0.19787 2.21467e-16 576 63.546 1.23684e-05 -3.53997 63.546000 Cu 0.833599 0.193192 0.5 578 63.546 2.98915e-05 -3.53997 63.546000 Cu 0.947244 0.167492 1 550 63.546 5.70048e-06 -3.53994 63.546000 Cu 0.881101 0.172172 0.5 552 63.546 4.79163e-06 -3.53996 63.546000 Cu 0.899702 0.188523 7.34218e-17 580 63.546 8.82896e-06 -3.53996 63.546000 Cu 0.965847 0.183843 0.5 582 63.546 6.18093e-06 -3.53995 63.546000 Cu 0.069122 0.211906 0 616 63.546 1.31294e-05 -3.53996 63.546000 Cu 0.135222 0.207229 0.5 618 63.546 2.43938e-05 -3.53997 63.546000 Cu 0.0877252 0.228272 0.5 619 63.546 2.80358e-05 -3.53997 63.546000 Cu 0.00300317 0.216582 0.5 614 63.546 1.13494e-05 -3.53995 63.546000 Cu 0.0216117 0.23296 1 613 63.546 5.0092e-05 -3.53997 63.546000 Cu 0.153876 0.223589 0 617 63.546 1.34028e-05 -3.53997 63.546000 Cu 0.201372 0.202544 1.31222e-16 620 63.546 2.11766e-05 -3.53996 63.546000 Cu 0.219981 0.218911 0.5 623 63.546 1.50883e-05 -3.53998 63.546000 Cu 0.28609 0.214237 1 621 63.546 7.61606e-06 -3.53996 63.546000 Cu 0.418332 0.20488 0 625 63.546 3.33812e-05 -3.53996 63.546000 Cu 0.35219 0.209565 0.5 627 63.546 9.29737e-06 -3.53997 63.546000 Cu 0.304715 0.230619 0.5 653 63.546 6.85584e-06 -3.53998 63.546000 Cu 0.370795 0.225939 0 655 63.546 2.2174e-05 -3.53996 63.546000 Cu 0.569122 0.211906 0.5 571 63.546 1.31294e-05 -3.53996 63.546000 Cu 0.484447 0.200203 0.5 630 63.546 2.24471e-05 -3.53995 63.546000 Cu 0.436905 0.221262 0.5 657 63.546 1.27886e-05 -3.53996 63.546000 Cu 0.503003 0.216582 1.06227e-16 659 63.546 1.13494e-05 -3.53995 63.546000 Cu 0.521612 0.23296 0.5 660 63.546 5.0092e-05 -3.53997 63.546000 Cu 0.587725 0.228272 1 570 63.546 2.80358e-05 -3.53997 63.546000 Cu 0.635222 0.207229 1 572 63.546 2.43938e-05 -3.53997 63.546000 Cu 0.701372 0.202544 0.5 574 63.546 2.11766e-05 -3.53996 63.546000 Cu 0.653876 0.223589 0.5 575 63.546 1.34028e-05 -3.53997 63.546000 Cu 0.719981 0.218911 0 573 63.546 1.50883e-05 -3.53998 63.546000 Cu 0.85219 0.209565 2.31921e-17 577 63.546 9.29737e-06 -3.53997 63.546000 Cu 0.78609 0.214237 0.5 579 63.546 7.61606e-06 -3.53996 63.546000 Cu 0.804715 0.230619 1.85417e-16 608 63.546 6.85584e-06 -3.53998 63.546000 Cu 0.984447 0.200203 1 581 63.546 2.24471e-05 -3.53995 63.546000 Cu 0.918332 0.20488 0.5 583 63.546 3.33812e-05 -3.53996 63.546000 Cu 0.870795 0.225939 0.5 610 63.546 2.2174e-05 -3.53996 63.546000 Cu 0.936905 0.221262 8.57989e-17 612 63.546 1.27886e-05 -3.53996 63.546000 Cu 0.0590744 0.265712 1 644 63.546 2.55243e-05 -3.53997 63.546000 Cu 0.0403364 0.24933 0.5 645 63.546 9.75738e-06 -3.53998 63.546000 Cu 0.106416 0.244638 1 647 63.546 5.80551e-05 -3.53997 63.546000 Cu 0.125142 0.261031 0.5 650 63.546 8.92148e-06 -3.53997 63.546000 Cu 0.191172 0.256356 1 648 63.546 3.37657e-05 -3.53998 63.546000 Cu 0.172525 0.239959 0.5 649 63.546 3.94041e-05 -3.53998 63.546000 Cu 0.238602 0.235295 8.31552e-17 651 63.546 1.72018e-05 -3.53997 63.546000 Cu 0.257296 0.251671 0.5 654 63.546 1.57148e-05 -3.53998 63.546000 Cu 0.323376 0.247001 1 652 63.546 6.41138e-06 -3.53998 63.546000 Cu 0.389485 0.242321 0.5 658 63.546 9.9959e-06 -3.53998 63.546000 Cu 0.342082 0.263381 0.5 685 63.546 1.11871e-05 -3.53998 63.546000 Cu 0.408164 0.258711 1.35788e-17 687 63.546 1.59889e-05 -3.53998 63.546000 Cu 0.540336 0.24933 1.65589e-16 600 63.546 9.75738e-06 -3.53998 63.546000 Cu 0.559074 0.265712 0.5 603 63.546 2.55243e-05 -3.53997 63.546000 Cu 0.455518 0.237643 1.3711e-16 656 63.546 5.1377e-05 -3.53997 63.546000 Cu 0.474259 0.254024 0.5 689 63.546 8.08888e-06 -3.53997 63.546000 Cu 0.625142 0.261031 1.18845e-16 601 63.546 8.92148e-06 -3.53997 63.546000 Cu 0.606416 0.244638 0.5 602 63.546 5.80551e-05 -3.53997 63.546000 Cu 0.672525 0.239959 1 604 63.546 3.94041e-05 -3.53998 63.546000 Cu 0.691172 0.256356 0.5 607 63.546 3.37657e-05 -3.53998 63.546000 Cu 0.757296 0.251671 0 605 63.546 1.57148e-05 -3.53998 63.546000 Cu 0.738602 0.235295 0.5 606 63.546 1.72018e-05 -3.53997 63.546000 Cu 0.823376 0.247001 0.5 611 63.546 6.41138e-06 -3.53998 63.546000 Cu 0.842082 0.263381 5.73194e-17 639 63.546 1.11871e-05 -3.53998 63.546000 Cu 0.889485 0.242321 7.53444e-17 609 63.546 9.9959e-06 -3.53998 63.546000 Cu 0.955518 0.237643 0.5 615 63.546 5.1377e-05 -3.53997 63.546000 Cu 0.908164 0.258711 0.5 641 63.546 1.59889e-05 -3.53998 63.546000 Cu 0.974259 0.254024 1 643 63.546 8.08888e-06 -3.53997 63.546000 Cu 0.0116492 0.286783 1.67512e-16 675 63.546 8.99768e-06 -3.53997 63.546000 Cu 0.0964349 0.298487 0 676 63.546 1.61949e-05 -3.53998 63.546000 Cu 0.0777496 0.282107 0.5 677 63.546 1.03341e-05 -3.53997 63.546000 Cu 0.143824 0.277423 1 679 63.546 7.72737e-06 -3.53998 63.546000 Cu 0.228634 0.289122 4.27793e-17 680 63.546 2.29116e-05 -3.53999 63.546000 Cu 0.209899 0.272742 0.5 681 63.546 2.9503e-06 -3.53997 63.546000 Cu 0.162544 0.293813 0.5 682 63.546 1.60151e-05 -3.53998 63.546000 Cu 0.275968 0.268062 1 683 63.546 9.80343e-06 -3.53998 63.546000 Cu 0.36074 0.279774 1 684 63.546 1.88061e-05 -3.53998 63.546000 Cu 0.294675 0.284446 0.5 686 63.546 1.80893e-05 -3.53998 63.546000 Cu 0.426847 0.275094 0.5 690 63.546 1.40634e-05 -3.53997 63.546000 Cu 0.379442 0.296161 0.5 716 63.546 4.337e-05 -3.53998 63.546000 Cu 0.492982 0.270404 1 688 63.546 1.64143e-05 -3.53997 63.546000 Cu 0.445538 0.291468 1 718 63.546 3.00938e-05 -3.53997 63.546000 Cu 0.511649 0.286783 0.5 720 63.546 8.99768e-06 -3.53997 63.546000 Cu 0.57775 0.282107 1 631 63.546 1.03341e-05 -3.53997 63.546000 Cu 0.662544 0.293813 0 632 63.546 1.60151e-05 -3.53998 63.546000 Cu 0.643824 0.277423 0.5 633 63.546 7.72737e-06 -3.53998 63.546000 Cu 0.596435 0.298487 0.5 634 63.546 1.61949e-05 -3.53998 63.546000 Cu 0.709899 0.272742 1.23892e-16 635 63.546 2.9503e-06 -3.53997 63.546000 Cu 0.794675 0.284446 6.76538e-17 636 63.546 1.80893e-05 -3.53998 63.546000 Cu 0.775968 0.268062 0.5 637 63.546 9.80343e-06 -3.53998 63.546000 Cu 0.728634 0.289122 0.5 638 63.546 2.29116e-05 -3.53999 63.546000 Cu 0.926847 0.275094 1 640 63.546 1.40634e-05 -3.53997 63.546000 Cu 0.86074 0.279774 0.5 642 63.546 1.88061e-05 -3.53998 63.546000 Cu 0.992982 0.270404 0.5 646 63.546 1.64143e-05 -3.53997 63.546000 Cu 0.879442 0.296161 2.76383e-18 671 63.546 4.337e-05 -3.53998 63.546000 Cu 0.945538 0.291468 0.5 673 63.546 3.00938e-05 -3.53997 63.546000 Cu 0.03032 0.303171 0.5 678 63.546 5.24989e-05 -3.53997 63.546000 Cu 0.0490996 0.319565 1.27617e-16 706 63.546 1.42962e-05 -3.53997 63.546000 Cu 0.133943 0.331253 1 707 63.546 5.49275e-05 -3.53998 63.546000 Cu 0.115168 0.314878 0.5 708 63.546 2.43798e-05 -3.53998 63.546000 Cu 0.181287 0.310188 0 710 63.546 1.70482e-05 -3.53998 63.546000 Cu 0.266107 0.321905 7.46234e-17 711 63.546 3.79938e-06 -3.53999 63.546000 Cu 0.24738 0.305518 0.5 712 63.546 1.75718e-05 -3.53999 63.546000 Cu 0.200024 0.326574 0.5 713 63.546 2.62139e-05 -3.53999 63.546000 Cu 0.313416 0.300845 1 714 63.546 1.01571e-05 -3.53999 63.546000 Cu 0.398238 0.31255 1 715 63.546 8.33908e-06 -3.53998 63.546000 Cu 0.332183 0.317241 0.5 717 63.546 4.13754e-05 -3.53999 63.546000 Cu 0.416987 0.328951 0.5 748 63.546 1.59607e-05 -3.53998 63.546000 Cu 0.5491 0.319565 0.5 662 63.546 1.42962e-05 -3.53997 63.546000 Cu 0.53032 0.303171 1 719 63.546 5.24989e-05 -3.53997 63.546000 Cu 0.464268 0.30786 0.5 721 63.546 1.75322e-05 -3.53997 63.546000 Cu 0.483061 0.324258 1 750 63.546 9.61393e-06 -3.53997 63.546000 Cu 0.615168 0.314878 1.92266e-18 663 63.546 2.43798e-05 -3.53998 63.546000 Cu 0.700024 0.326574 1 664 63.546 2.62139e-05 -3.53999 63.546000 Cu 0.681287 0.310188 0.5 665 63.546 1.70482e-05 -3.53998 63.546000 Cu 0.633943 0.331253 0.5 666 63.546 5.49275e-05 -3.53998 63.546000 Cu 0.74738 0.305518 4.2539e-17 667 63.546 1.75718e-05 -3.53999 63.546000 Cu 0.832183 0.317241 1 668 63.546 4.13754e-05 -3.53999 63.546000 Cu 0.813416 0.300845 0.5 669 63.546 1.01571e-05 -3.53999 63.546000 Cu 0.766107 0.321905 0.5 670 63.546 3.79938e-06 -3.53999 63.546000 Cu 0.964268 0.30786 0 672 63.546 1.75322e-05 -3.53997 63.546000 Cu 0.898238 0.31255 0.5 674 63.546 8.33908e-06 -3.53998 63.546000 Cu 0.916987 0.328951 3.1003e-17 702 63.546 1.59607e-05 -3.53998 63.546000 Cu 0.983061 0.324258 0.5 704 63.546 9.61393e-06 -3.53997 63.546000 Cu 0.0679201 0.335951 0.5 709 63.546 1.11236e-05 -3.53998 63.546000 Cu 0.0206561 0.357032 0.5 736 63.546 4.72834e-05 -3.53997 63.546000 Cu 0.0867769 0.352336 1 738 63.546 5.08724e-05 -3.53998 63.546000 Cu 0.0018329 0.340656 1 703 63.546 2.85522e-05 -3.53997 63.546000 Cu 0.171782 0.364011 0 739 63.546 8.23454e-05 -3.53998 63.546000 Cu 0.152818 0.347636 0.5 740 63.546 3.91038e-05 -3.53999 63.546000 Cu 0.218818 0.342955 1 742 63.546 0.000102334 -3.53999 63.546000 Cu 0.284861 0.338286 0.5 744 63.546 7.71953e-05 -3.53999 63.546000 Cu 0.237791 0.359337 0.5 745 63.546 0.000134269 -3.53996 63.546000 Cu 0.303734 0.35468 1 743 63.546 0.000109377 -3.53997 63.546000 Cu 0.350937 0.333624 0 746 63.546 2.21249e-05 -3.53999 63.546000 Cu 0.369693 0.350023 0.5 749 63.546 9.30694e-05 -3.53998 63.546000 Cu 0.388549 0.366444 1.02742e-16 777 63.546 0.000179298 -3.53995 63.546000 Cu 0.56792 0.335951 3.19643e-17 661 63.546 1.11236e-05 -3.53998 63.546000 Cu 0.435738 0.345355 1.98755e-16 747 63.546 8.94203e-05 -3.53997 63.546000 Cu 0.501833 0.340656 0.5 751 63.546 2.85522e-05 -3.53997 63.546000 Cu 0.45455 0.36174 0.5 779 63.546 0.000127699 -3.53996 63.546000 Cu 0.520656 0.357032 1.05386e-16 781 63.546 4.72834e-05 -3.53997 63.546000 Cu 0.586777 0.352336 0.5 692 63.546 5.08724e-05 -3.53998 63.546000 Cu 0.652818 0.347636 0 694 63.546 3.91038e-05 -3.53999 63.546000 Cu 0.671782 0.364011 0.5 697 63.546 8.23454e-05 -3.53998 63.546000 Cu 0.737791 0.359337 8.91636e-17 695 63.546 0.000134269 -3.53996 63.546000 Cu 0.718818 0.342955 0.5 696 63.546 0.000102334 -3.53999 63.546000 Cu 0.784861 0.338286 1 698 63.546 7.71953e-05 -3.53999 63.546000 Cu 0.850937 0.333624 0.5 700 63.546 2.21249e-05 -3.53999 63.546000 Cu 0.803734 0.35468 0.5 701 63.546 0.000109377 -3.53997 63.546000 Cu 0.869693 0.350023 1 699 63.546 9.30694e-05 -3.53998 63.546000 Cu 0.935738 0.345355 0.5 705 63.546 8.94203e-05 -3.53997 63.546000 Cu 0.95455 0.36174 0 734 63.546 0.000127699 -3.53996 63.546000 Cu 0.888549 0.366444 0.5 732 63.546 0.000179298 -3.53995 63.546000 Cu 0.0395812 0.3734 2.78786e-17 735 63.546 8.06283e-05 -3.53997 63.546000 Cu 0.105729 0.368689 0.5 741 63.546 5.19971e-05 -3.53997 63.546000 Cu 0.0586366 0.389747 0.5 767 63.546 9.10772e-05 -3.53997 63.546000 Cu 0.124753 0.385043 1 769 63.546 0.000230434 -3.53994 63.546000 Cu 0.209803 0.39681 1 770 63.546 0.000803951 -3.53986 63.546000 Cu 0.190853 0.380371 0.5 771 63.546 0.000722353 -3.53991 63.546000 Cu 0.256766 0.375754 1 773 63.546 0.000242787 -3.53993 63.546000 Cu 0.275634 0.392228 0.5 776 63.546 0.000293595 -3.53987 63.546000 Cu 0.341485 0.387586 1.41076e-16 774 63.546 0.000606945 -3.53986 63.546000 Cu 0.322653 0.371115 0.5 775 63.546 8.42523e-05 -3.53993 63.546000 Cu 0.407438 0.38286 0.5 780 63.546 0.000271249 -3.53991 63.546000 Cu 0.42645 0.399245 3.13635e-17 808 63.546 0.000210865 -3.53994 63.546000 Cu 0.539581 0.3734 0.5 693 63.546 8.06283e-05 -3.53997 63.546000 Cu 0.558637 0.389747 1 722 63.546 9.10772e-05 -3.53997 63.546000 Cu 0.473484 0.378122 1 778 63.546 0.000113287 -3.53997 63.546000 Cu 0.492511 0.394497 0.5 810 63.546 0.000161207 -3.53996 63.546000 Cu 0.605729 0.368689 1 691 63.546 5.19971e-05 -3.53997 63.546000 Cu 0.624753 0.385043 0.5 724 63.546 0.000230434 -3.53994 63.546000 Cu 0.690853 0.380371 1.68233e-17 726 63.546 0.000722353 -3.53991 63.546000 Cu 0.709803 0.39681 0.5 729 63.546 0.000803951 -3.53986 63.546000 Cu 0.775634 0.392228 1 727 63.546 0.000293595 -3.53987 63.546000 Cu 0.756766 0.375754 0.5 728 63.546 0.000242787 -3.53993 63.546000 Cu 0.822653 0.371115 0 730 63.546 8.42523e-05 -3.53993 63.546000 Cu 0.841485 0.387586 0.5 733 63.546 0.000606945 -3.53986 63.546000 Cu 0.907438 0.38286 1 731 63.546 0.000271249 -3.53991 63.546000 Cu 0.973484 0.378122 0.5 737 63.546 0.000113287 -3.53997 63.546000 Cu 0.992511 0.394497 1 765 63.546 0.000161207 -3.53996 63.546000 Cu 0.92645 0.399245 0.5 763 63.546 0.000210865 -3.53994 63.546000 Cu 0.0777844 0.40608 1 766 63.546 0.000535512 -3.53992 63.546000 Cu 0.0116929 0.410821 0.5 768 63.546 0.000139335 -3.53995 63.546000 Cu 0.0309543 0.427143 1.41797e-17 796 63.546 0.00265824 -3.53978 63.546000 Cu 0.097152 0.422346 0.5 798 63.546 0.00791514 -3.53929 63.546000 Cu 0.143882 0.40138 0.5 772 63.546 0.00205835 -3.53981 63.546000 Cu 0.162831 0.417818 1 800 63.546 0.00324332 -3.53967 63.546000 Cu 0.246704 0.429921 6.36883e-18 801 63.546 0.00752593 -3.53889 63.546000 Cu 0.228457 0.413308 0.5 802 63.546 0.000716477 -3.53973 63.546000 Cu 0.294235 0.408741 1 804 63.546 0.00210902 -3.5397 63.546000 Cu 0.379234 0.420352 9.93777e-17 805 63.546 0.000769323 -3.53979 63.546000 Cu 0.360286 0.404025 0.5 806 63.546 0.00128996 -3.53975 63.546000 Cu 0.312727 0.425204 0.5 807 63.546 0.00525697 -3.53921 63.546000 Cu 0.511693 0.410821 7.37822e-17 809 63.546 0.000139335 -3.53995 63.546000 Cu 0.445489 0.415604 0.5 811 63.546 0.000556657 -3.53989 63.546000 Cu 0.530954 0.427143 0.5 837 63.546 0.00265824 -3.53978 63.546000 Cu 0.464717 0.431864 4.326e-18 836 63.546 0.00211639 -3.53954 63.546000 Cu 0.643882 0.40138 4.86674e-17 723 63.546 0.00205835 -3.53981 63.546000 Cu 0.577784 0.40608 0.5 725 63.546 0.000535512 -3.53992 63.546000 Cu 0.597152 0.422346 1 753 63.546 0.00791514 -3.53929 63.546000 Cu 0.662831 0.417818 0.5 755 63.546 0.00324332 -3.53967 63.546000 Cu 0.728457 0.413308 1 757 63.546 0.000716477 -3.53973 63.546000 Cu 0.812727 0.425204 1.56216e-17 758 63.546 0.00525697 -3.53921 63.546000 Cu 0.794235 0.408741 0.5 759 63.546 0.00210902 -3.5397 63.546000 Cu 0.746704 0.429921 0.5 760 63.546 0.00752593 -3.53889 63.546000 Cu 0.860286 0.404025 5.65984e-17 761 63.546 0.00128996 -3.53975 63.546000 Cu 0.945489 0.415604 1.6619e-16 762 63.546 0.000556657 -3.53989 63.546000 Cu 0.879234 0.420352 0.5 764 63.546 0.000769323 -3.53979 63.546000 Cu 0.964717 0.431864 0.5 794 63.546 0.00211639 -3.53954 63.546000 Cu 0.116273 0.438862 0 797 63.546 0.0120579 -3.53852 63.546000 Cu 0.0510576 0.443273 0.5 799 63.546 0.0347483 -3.53485 63.546000 Cu 0.0706749 0.459913 5.93623e-17 824 63.546 0.116077 -3.5288 63.546000 Cu 0.135524 0.455629 0.5 826 63.546 0.0507672 -3.5277 63.546000 Cu 0.00413497 0.463608 0.5 822 63.546 0.177891 -3.51714 63.546000 Cu 0.181379 0.434393 0.5 803 63.546 0.00533659 -3.53865 63.546000 Cu 0.199204 0.451306 1 828 63.546 0.0482423 -3.53092 63.546000 Cu 0.284094 0.46234 1 829 63.546 0.0607374 -3.53595 63.546000 Cu 0.264602 0.446437 0.5 830 63.546 0.0254473 -3.53597 63.546000 Cu 0.331633 0.441437 5.61178e-17 832 63.546 0.00439151 -3.53928 63.546000 Cu 0.416804 0.452775 0 833 63.546 0.0189773 -3.53776 63.546000 Cu 0.397994 0.436662 0.5 834 63.546 0.00179622 -3.53914 63.546000 Cu 0.34979 0.457889 0.5 835 63.546 0.0220178 -3.5373 63.546000 Cu 0.551058 0.443273 9.88971e-17 752 63.546 0.0347483 -3.53485 63.546000 Cu 0.570675 0.459913 0.5 783 63.546 0.116077 -3.5288 63.546000 Cu 0.483547 0.448119 0.5 838 63.546 0.0266293 -3.5357 63.546000 Cu 0.504135 0.463608 1 849 63.546 0.177891 -3.51714 63.546000 Cu 0.681379 0.434393 0 754 63.546 0.00533659 -3.53865 63.546000 Cu 0.616273 0.438862 0.5 756 63.546 0.0120579 -3.53852 63.546000 Cu 0.635524 0.455629 9.98584e-17 784 63.546 0.0507672 -3.5277 63.546000 Cu 0.699204 0.451306 0.5 786 63.546 0.0482423 -3.53092 63.546000 Cu 0.764602 0.446437 1 788 63.546 0.0254473 -3.53597 63.546000 Cu 0.84979 0.457889 6.57311e-17 789 63.546 0.0220178 -3.5373 63.546000 Cu 0.831633 0.441437 0.5 790 63.546 0.00439151 -3.53928 63.546000 Cu 0.784094 0.46234 0.5 791 63.546 0.0607374 -3.53595 63.546000 Cu 0.897994 0.436662 0 792 63.546 0.00179622 -3.53914 63.546000 Cu 0.983547 0.448119 1.30381e-16 793 63.546 0.0266293 -3.5357 63.546000 Cu 0.916804 0.452775 0.5 795 63.546 0.0189773 -3.53776 63.546000 Cu 0.0202289 0.479361 1 821 63.546 3.25579 -3.42687 63.546000 Cu 0.0915865 0.476506 0.5 827 63.546 0.79319 -3.46285 63.546000 Cu 0.102726 0.494166 8.45972e-17 840 63.546 2.76728 -3.49252 63.546000 Cu 0.0345778 0.494172 0.5 839 63.546 7.71703 -3.43327 63.546000 Cu 0.153315 0.473656 0 825 63.546 0.588683 -3.44592 63.546000 Cu 0.217071 0.468145 0.5 831 63.546 0.398518 -3.47684 63.546000 Cu 0.173963 0.494157 0.5 841 63.546 8.07443 -3.3118 63.546000 Cu 0.237768 0.482994 1 842 63.546 8.85886 -3.36353 63.546000 Cu 0.321162 0.494157 1 843 63.546 8.40098 -3.44223 63.546000 Cu 0.304113 0.478813 0.5 844 63.546 2.84424 -3.42417 63.546000 Cu 0.368573 0.474193 1 845 63.546 0.446895 -3.46938 63.546000 Cu 0.390912 0.49416 0.5 848 63.546 8.35248 -3.3713 63.546000 Cu 0.452633 0.483183 1.03584e-16 846 63.546 9.00582 -3.35602 63.546000 Cu 0.433702 0.468911 0.5 847 63.546 0.38957 -3.47186 63.546000 Cu 0.520229 0.479361 0.5 850 63.546 3.25579 -3.42687 63.546000 Cu 0.534578 0.494172 4.80666e-17 812 63.546 7.71703 -3.43327 63.546000 Cu 0.591587 0.476506 1 782 63.546 0.79319 -3.46285 63.546000 Cu 0.653315 0.473656 0.5 787 63.546 0.588683 -3.44592 63.546000 Cu 0.602726 0.494166 0.5 813 63.546 2.76728 -3.49252 63.546000 Cu 0.673963 0.494157 0 814 63.546 8.07443 -3.3118 63.546000 Cu 0.717071 0.468145 1.02983e-16 785 63.546 0.398518 -3.47684 63.546000 Cu 0.737768 0.482994 0.5 815 63.546 8.85886 -3.36353 63.546000 Cu 0.804113 0.478813 1 816 63.546 2.84424 -3.42417 63.546000 Cu 0.821162 0.494157 0.5 819 63.546 8.40098 -3.44223 63.546000 Cu 0.890912 0.49416 0 817 63.546 8.35248 -3.3713 63.546000 Cu 0.868573 0.474193 0.5 818 63.546 0.446895 -3.46938 63.546000 Cu 0.933702 0.468911 2.99215e-16 820 63.546 0.38957 -3.47186 63.546000 Cu 0.952633 0.483183 0.5 823 63.546 9.00582 -3.35602 63.546000 Cu 0.0207072 0.508998 1 10 63.546 3.22937 -3.42755 63.546000 Cu 0.071556 0.528417 6.28471e-17 11 63.546 0.118652 -3.52939 63.546000 Cu 0.0920761 0.511774 0.5 12 63.546 0.79045 -3.4659 63.546000 Cu 0.0049564 0.524746 0.5 13 63.546 0.188699 -3.51711 63.546000 Cu 0.136321 0.532663 0.5 17 63.546 0.0479329 -3.52847 63.546000 Cu 0.238082 0.505334 1.86258e-17 1 63.546 8.85907 -3.36063 63.546000 Cu 0.153809 0.514659 1 14 63.546 0.59256 -3.44599 63.546000 Cu 0.217726 0.520181 0.5 16 63.546 0.394165 -3.47525 63.546000 Cu 0.284781 0.525971 8.67602e-17 18 63.546 0.0601918 -3.53592 63.546000 Cu 0.368966 0.51411 1.01541e-16 2 63.546 0.453949 -3.4691 63.546000 Cu 0.30454 0.509503 0.5 3 63.546 2.8127 -3.42552 63.546000 Cu 0.350526 0.530414 0.5 20 63.546 0.0238324 -3.53679 63.546000 Cu 0.43433 0.519453 0.5 4 63.546 0.392417 -3.4684 63.546000 Cu 0.45305 0.505212 6.22463e-17 24 63.546 8.99623 -3.35224 63.546000 Cu 0.504956 0.524746 1.64748e-16 25 63.546 0.188699 -3.51711 63.546000 Cu 0.520707 0.508998 0.5 26 63.546 3.22937 -3.42755 63.546000 Cu 0.592076 0.511774 1 27 63.546 0.79045 -3.4659 63.546000 Cu 0.636321 0.532663 1.08751e-16 28 63.546 0.0479329 -3.52847 63.546000 Cu 0.653809 0.514659 0.5 29 63.546 0.59256 -3.44599 63.546000 Cu 0.571556 0.528417 0.5 30 63.546 0.118652 -3.52939 63.546000 Cu 0.80454 0.509503 1 5 63.546 2.8127 -3.42552 63.546000 Cu 0.738082 0.505334 0.5 6 63.546 8.85907 -3.36063 63.546000 Cu 0.717726 0.520181 1 31 63.546 0.394165 -3.47525 63.546000 Cu 0.784781 0.525971 0.5 33 63.546 0.0601918 -3.53592 63.546000 Cu 0.850526 0.530414 1 35 63.546 0.0238324 -3.53679 63.546000 Cu 0.93433 0.519453 5.99631e-17 7 63.546 0.392417 -3.4684 63.546000 Cu 0.95305 0.505212 0.5 8 63.546 8.99623 -3.35224 63.546000 Cu 0.868966 0.51411 0.5 9 63.546 0.453949 -3.4691 63.546000 Cu 0.0323132 0.561168 1 40 63.546 0.00289374 -3.53972 63.546000 Cu 0.0521685 0.545063 0.5 41 63.546 0.0387031 -3.53515 63.546000 Cu 0.117408 0.549433 0 43 63.546 0.0116494 -3.53858 63.546000 Cu 0.0985979 0.565956 0.5 46 63.546 0.00909448 -3.53936 63.546000 Cu 0.20012 0.537012 1 15 63.546 0.0465802 -3.53061 63.546000 Cu 0.265584 0.541874 0.5 21 63.546 0.0245814 -3.53551 63.546000 Cu 0.182533 0.553894 0.5 45 63.546 0.00507024 -3.53872 63.546000 Cu 0.247968 0.558375 1.98275e-17 47 63.546 0.00690605 -3.5388 63.546000 Cu 0.417716 0.535545 1.8025e-18 22 63.546 0.0202633 -3.53705 63.546000 Cu 0.332716 0.54685 1 19 63.546 0.00453127 -3.53916 63.546000 Cu 0.399117 0.55162 0.5 23 63.546 0.00223817 -3.53879 63.546000 Cu 0.314083 0.563083 0.5 49 63.546 0.00497012 -3.53901 63.546000 Cu 0.465989 0.556431 0 55 63.546 0.00220412 -3.5395 63.546000 Cu 0.484571 0.540217 0.5 56 63.546 0.0265266 -3.5354 63.546000 Cu 0.552168 0.545063 1 57 63.546 0.0387031 -3.53515 63.546000 Cu 0.532313 0.561168 0.5 60 63.546 0.00289374 -3.53972 63.546000 Cu 0.70012 0.537012 0.5 34 63.546 0.0465802 -3.53061 63.546000 Cu 0.598598 0.565956 2.47543e-17 58 63.546 0.00909448 -3.53936 63.546000 Cu 0.617408 0.549433 0.5 59 63.546 0.0116494 -3.53858 63.546000 Cu 0.682533 0.553894 2.89601e-17 61 63.546 0.00507024 -3.53872 63.546000 Cu 0.765584 0.541874 0 32 63.546 0.0245814 -3.53551 63.546000 Cu 0.832716 0.54685 0.5 38 63.546 0.00453127 -3.53916 63.546000 Cu 0.747968 0.558375 0.5 63 63.546 0.00690605 -3.5388 63.546000 Cu 0.814083 0.563083 3.605e-19 65 63.546 0.00497012 -3.53901 63.546000 Cu 0.917716 0.535545 0.5 37 63.546 0.0202633 -3.53705 63.546000 Cu 0.899117 0.55162 3.36466e-17 36 63.546 0.00223817 -3.53879 63.546000 Cu 0.984571 0.540217 1.33265e-16 39 63.546 0.0265266 -3.5354 63.546000 Cu 0.965989 0.556431 0.5 42 63.546 0.00220412 -3.5395 63.546000 Cu 0.0133679 0.577463 0.5 71 63.546 0.000140755 -3.53988 63.546000 Cu 0.0796141 0.582206 1.013e-16 73 63.546 0.000772283 -3.53987 63.546000 Cu 0.0608301 0.598509 0.5 76 63.546 0.000105528 -3.5399 63.546000 Cu 0.164337 0.570453 6.88554e-17 44 63.546 0.00268115 -3.53976 63.546000 Cu 0.230067 0.574966 0.5 50 63.546 0.000621045 -3.53978 63.546000 Cu 0.145825 0.586894 0.5 75 63.546 0.00242453 -3.53988 63.546000 Cu 0.211799 0.591447 1.33625e-16 77 63.546 0.000648934 -3.53994 63.546000 Cu 0.277703 0.596024 0.5 79 63.546 0.000202854 -3.53989 63.546000 Cu 0.380657 0.567916 1 51 63.546 0.000765057 -3.53969 63.546000 Cu 0.295937 0.579533 5.44354e-17 48 63.546 0.00182723 -3.53963 63.546000 Cu 0.362048 0.584234 0.5 54 63.546 0.00130738 -3.53964 63.546000 Cu 0.428331 0.588995 0 52 63.546 0.000323581 -3.53984 63.546000 Cu 0.447017 0.572667 0.5 53 63.546 0.000591087 -3.53977 63.546000 Cu 0.513368 0.577463 0 85 63.546 0.000140755 -3.53988 63.546000 Cu 0.56083 0.598509 6.35681e-17 86 63.546 0.000105528 -3.5399 63.546000 Cu 0.494548 0.593754 0.5 88 63.546 0.000182705 -3.53984 63.546000 Cu 0.664337 0.570453 0.5 64 63.546 0.00268115 -3.53976 63.546000 Cu 0.579614 0.582206 0.5 87 63.546 0.000772283 -3.53987 63.546000 Cu 0.645825 0.586894 1 89 63.546 0.00242453 -3.53988 63.546000 Cu 0.711799 0.591447 0.5 91 63.546 0.000648934 -3.53994 63.546000 Cu 0.730067 0.574966 0 62 63.546 0.000621045 -3.53978 63.546000 Cu 0.795937 0.579533 0.5 68 63.546 0.00182723 -3.53963 63.546000 Cu 0.777703 0.596024 1.31102e-16 93 63.546 0.000202854 -3.53989 63.546000 Cu 0.880657 0.567916 0.5 67 63.546 0.000765057 -3.53969 63.546000 Cu 0.994548 0.593754 7.18596e-17 70 63.546 0.000182705 -3.53984 63.546000 Cu 0.862048 0.584234 4.80666e-19 66 63.546 0.00130738 -3.53964 63.546000 Cu 0.947017 0.572667 3.605e-19 69 63.546 0.000591087 -3.53977 63.546000 Cu 0.928331 0.588995 0.5 72 63.546 0.000323581 -3.53984 63.546000 Cu 0.127089 0.603218 9.13266e-17 74 63.546 0.000421606 -3.53994 63.546000 Cu 0.0421594 0.614822 0 101 63.546 8.00018e-05 -3.53988 63.546000 Cu 0.108419 0.619537 0.5 103 63.546 4.17669e-05 -3.53992 63.546000 Cu 0.0235829 0.631162 0.5 104 63.546 0.000108775 -3.53987 63.546000 Cu 0.259278 0.612479 1.63066e-16 78 63.546 0.000200706 -3.53996 63.546000 Cu 0.193279 0.607874 0.5 80 63.546 0.000802231 -3.53997 63.546000 Cu 0.174613 0.624228 1 105 63.546 0.000180435 -3.53996 63.546000 Cu 0.24075 0.628889 0.5 107 63.546 0.00022748 -3.53997 63.546000 Cu 0.34366 0.600654 2.42736e-16 81 63.546 0.000544431 -3.53981 63.546000 Cu 0.391289 0.621767 1 82 63.546 0.000137149 -3.53986 63.546000 Cu 0.409735 0.605357 0.5 83 63.546 0.000444692 -3.5398 63.546000 Cu 0.325267 0.617108 0.5 84 63.546 6.55327e-05 -3.53991 63.546000 Cu 0.475921 0.610084 1 115 63.546 0.000250271 -3.53986 63.546000 Cu 0.523583 0.631162 0 116 63.546 0.000108775 -3.53987 63.546000 Cu 0.542159 0.614822 0.5 117 63.546 8.00018e-05 -3.53988 63.546000 Cu 0.45741 0.626456 0.5 118 63.546 0.000152748 -3.53986 63.546000 Cu 0.693279 0.607874 1.46844e-16 90 63.546 0.000802231 -3.53997 63.546000 Cu 0.627089 0.603218 0.5 92 63.546 0.000421606 -3.53994 63.546000 Cu 0.608419 0.619537 2.04043e-16 119 63.546 4.17669e-05 -3.53992 63.546000 Cu 0.674613 0.624228 0.5 121 63.546 0.000180435 -3.53996 63.546000 Cu 0.84366 0.600654 0.5 95 63.546 0.000544431 -3.53981 63.546000 Cu 0.825267 0.617108 1.04905e-16 94 63.546 6.55327e-05 -3.53991 63.546000 Cu 0.759278 0.612479 0.5 96 63.546 0.000200706 -3.53996 63.546000 Cu 0.74075 0.628889 0 123 63.546 0.00022748 -3.53997 63.546000 Cu 0.909735 0.605357 1 97 63.546 0.000444692 -3.5398 63.546000 Cu 0.95741 0.626456 6.70529e-17 98 63.546 0.000152748 -3.53986 63.546000 Cu 0.975921 0.610084 0.5 99 63.546 0.000250271 -3.53986 63.546000 Cu 0.891289 0.621767 0.5 100 63.546 0.000137149 -3.53986 63.546000 Cu 0.0898002 0.635868 0 102 63.546 5.36957e-05 -3.53991 63.546000 Cu 0.00511274 0.64753 1.75083e-16 131 63.546 5.61089e-05 -3.53989 63.546000 Cu 0.0712878 0.652229 0.5 133 63.546 3.1503e-05 -3.5399 63.546000 Cu 0.137435 0.656917 2.30239e-16 135 63.546 3.31432e-05 -3.53993 63.546000 Cu 0.22216 0.645253 0 106 63.546 5.01434e-05 -3.53995 63.546000 Cu 0.155994 0.640572 0.5 108 63.546 2.99826e-05 -3.53993 63.546000 Cu 0.203592 0.661611 0.5 137 63.546 7.64208e-06 -3.53994 63.546000 Cu 0.269735 0.666289 1 139 63.546 1.86945e-05 -3.53995 63.546000 Cu 0.306802 0.633531 1 109 63.546 6.49311e-05 -3.53995 63.546000 Cu 0.354393 0.65458 0 110 63.546 2.86373e-05 -3.53995 63.546000 Cu 0.372865 0.638181 0.5 111 63.546 2.23481e-05 -3.53992 63.546000 Cu 0.288284 0.649923 0.5 112 63.546 6.77775e-05 -3.53996 63.546000 Cu 0.420499 0.659243 0.5 114 63.546 1.80975e-05 -3.53994 63.546000 Cu 0.438958 0.642848 0 113 63.546 3.85473e-05 -3.53989 63.546000 Cu 0.486636 0.663922 1.02382e-16 146 63.546 2.00863e-05 -3.53991 63.546000 Cu 0.505113 0.64753 0.5 147 63.546 5.61089e-05 -3.53989 63.546000 Cu 0.571288 0.652229 7.49839e-17 148 63.546 3.1503e-05 -3.5399 63.546000 Cu 0.655994 0.640572 1.11515e-16 120 63.546 2.99826e-05 -3.53993 63.546000 Cu 0.5898 0.635868 0.5 122 63.546 5.36957e-05 -3.53991 63.546000 Cu 0.637435 0.656917 0.5 150 63.546 3.31432e-05 -3.53993 63.546000 Cu 0.703592 0.661611 1.28338e-16 152 63.546 7.64208e-06 -3.53994 63.546000 Cu 0.806802 0.633531 0.5 125 63.546 6.49311e-05 -3.53995 63.546000 Cu 0.788284 0.649923 1 124 63.546 6.77775e-05 -3.53996 63.546000 Cu 0.72216 0.645253 0.5 126 63.546 5.01434e-05 -3.53995 63.546000 Cu 0.769735 0.666289 0.5 154 63.546 1.86945e-05 -3.53995 63.546000 Cu 0.854393 0.65458 0.5 130 63.546 2.86373e-05 -3.53995 63.546000 Cu 0.872865 0.638181 1 127 63.546 2.23481e-05 -3.53992 63.546000 Cu 0.920499 0.659243 0 128 63.546 1.80975e-05 -3.53994 63.546000 Cu 0.938958 0.642848 0.5 129 63.546 3.85473e-05 -3.53989 63.546000 Cu 0.986636 0.663922 0.5 134 63.546 2.00863e-05 -3.53991 63.546000 Cu 0.0527588 0.668602 1 132 63.546 1.65321e-05 -3.53992 63.546000 Cu 0.118891 0.673293 0.5 138 63.546 1.38313e-05 -3.53994 63.546000 Cu 0.0342124 0.68499 0.5 162 63.546 1.75464e-05 -3.53994 63.546000 Cu 0.100325 0.689667 1.66791e-16 164 63.546 1.51047e-06 -3.53994 63.546000 Cu 0.185007 0.677967 1 136 63.546 2.27128e-05 -3.53994 63.546000 Cu 0.251155 0.68265 0.5 142 63.546 4.13336e-06 -3.53996 63.546000 Cu 0.166442 0.694347 0.5 166 63.546 3.93501e-06 -3.53995 63.546000 Cu 0.232574 0.699019 1 168 63.546 1.65257e-05 -3.53995 63.546000 Cu 0.3173 0.687327 1.0791e-16 140 63.546 1.33509e-05 -3.53995 63.546000 Cu 0.335856 0.670958 0.5 141 63.546 1.25497e-05 -3.53996 63.546000 Cu 0.40197 0.675628 2.87198e-17 143 63.546 4.92061e-06 -3.53995 63.546000 Cu 0.383413 0.692002 0.5 145 63.546 6.8558e-06 -3.53996 63.546000 Cu 0.449523 0.696682 0 144 63.546 1.70007e-06 -3.53995 63.546000 Cu 0.552759 0.668602 0.5 151 63.546 1.65321e-05 -3.53992 63.546000 Cu 0.468091 0.680301 0.5 176 63.546 8.65003e-06 -3.53995 63.546000 Cu 0.534212 0.68499 1.53212e-16 177 63.546 1.75464e-05 -3.53994 63.546000 Cu 0.618891 0.673293 1.9503e-16 149 63.546 1.38313e-05 -3.53994 63.546000 Cu 0.685007 0.677967 0.5 155 63.546 2.27128e-05 -3.53994 63.546000 Cu 0.600325 0.689667 0.5 179 63.546 1.51047e-06 -3.53994 63.546000 Cu 0.666442 0.694347 1.98155e-16 181 63.546 3.93501e-06 -3.53995 63.546000 Cu 0.751155 0.68265 1.71117e-16 153 63.546 4.13336e-06 -3.53996 63.546000 Cu 0.835856 0.670958 2.25553e-16 156 63.546 1.25497e-05 -3.53996 63.546000 Cu 0.8173 0.687327 0.5 159 63.546 1.33509e-05 -3.53995 63.546000 Cu 0.732574 0.699019 0.5 183 63.546 1.65257e-05 -3.53995 63.546000 Cu 0.883413 0.692002 7.33016e-18 157 63.546 6.8558e-06 -3.53996 63.546000 Cu 0.90197 0.675628 0.5 158 63.546 4.92061e-06 -3.53995 63.546000 Cu 0.968091 0.680301 1 160 63.546 8.65003e-06 -3.53995 63.546000 Cu 0.949523 0.696682 0.5 163 63.546 1.70007e-06 -3.53995 63.546000 Cu 0.0156273 0.701359 0 161 63.546 9.72699e-06 -3.53994 63.546000 Cu 0.0817603 0.706044 0.5 167 63.546 2.45848e-06 -3.53994 63.546000 Cu 0.0632001 0.722423 0 193 63.546 1.67313e-05 -3.53995 63.546000 Cu 0.12933 0.72711 0.5 195 63.546 4.01576e-05 -3.53995 63.546000 Cu 0.147905 0.710729 1.08871e-16 165 63.546 1.3043e-05 -3.53994 63.546000 Cu 0.280119 0.720082 2.46341e-16 169 63.546 7.59799e-06 -3.53996 63.546000 Cu 0.214011 0.715404 0.5 171 63.546 6.30077e-06 -3.53995 63.546000 Cu 0.195427 0.731799 5.16716e-18 197 63.546 4.2902e-05 -3.53997 63.546000 Cu 0.298685 0.703697 0.5 170 63.546 1.84979e-05 -3.53996 63.546000 Cu 0.364832 0.708382 5.56371e-17 172 63.546 7.03661e-06 -3.53996 63.546000 Cu 0.412361 0.729436 0 173 63.546 2.07135e-05 -3.53997 63.546000 Cu 0.346213 0.724756 0.5 175 63.546 1.63209e-05 -3.53996 63.546000 Cu 0.43094 0.71306 0.5 174 63.546 3.0974e-06 -3.53995 63.546000 Cu 0.515627 0.701359 0.5 180 63.546 9.72699e-06 -3.53994 63.546000 Cu 0.497079 0.71774 5.13111e-17 206 63.546 7.17398e-06 -3.53995 63.546000 Cu 0.5632 0.722423 0.5 208 63.546 1.67313e-05 -3.53995 63.546000 Cu 0.58176 0.706044 1 178 63.546 2.45848e-06 -3.53994 63.546000 Cu 0.647905 0.710729 0.5 184 63.546 1.3043e-05 -3.53994 63.546000 Cu 0.62933 0.72711 1 210 63.546 4.01576e-05 -3.53995 63.546000 Cu 0.695427 0.731799 0.5 212 63.546 4.2902e-05 -3.53997 63.546000 Cu 0.714011 0.715404 1.33505e-16 182 63.546 6.30077e-06 -3.53995 63.546000 Cu 0.798685 0.703697 1.50208e-17 185 63.546 1.84979e-05 -3.53996 63.546000 Cu 0.846213 0.724756 1.10073e-16 186 63.546 1.63209e-05 -3.53996 63.546000 Cu 0.780119 0.720082 0.5 188 63.546 7.59799e-06 -3.53996 63.546000 Cu 0.997079 0.71774 0.5 191 63.546 7.17398e-06 -3.53995 63.546000 Cu 0.864832 0.708382 0.5 187 63.546 7.03661e-06 -3.53996 63.546000 Cu 0.93094 0.71306 0 189 63.546 3.0974e-06 -3.53995 63.546000 Cu 0.912361 0.729436 0.5 192 63.546 2.07135e-05 -3.53997 63.546000 Cu 0.110642 0.743493 1 194 63.546 1.22954e-05 -3.53997 63.546000 Cu 0.0445852 0.738803 0.5 196 63.546 5.81806e-05 -3.53997 63.546000 Cu 0.0258303 0.755186 1.46363e-16 222 63.546 7.92674e-06 -3.53998 63.546000 Cu 0.0919098 0.759871 0.5 224 63.546 1.10101e-05 -3.53998 63.546000 Cu 0.242842 0.752855 1.9503e-16 198 63.546 7.09954e-06 -3.53998 63.546000 Cu 0.261528 0.736474 0.5 199 63.546 3.06463e-05 -3.53996 63.546000 Cu 0.176749 0.748177 0.5 200 63.546 1.07128e-05 -3.53998 63.546000 Cu 0.158017 0.764554 4.55431e-17 226 63.546 2.81315e-06 -3.53998 63.546000 Cu 0.327614 0.741142 1.26055e-16 201 63.546 1.53502e-05 -3.53998 63.546000 Cu 0.37499 0.762203 0 202 63.546 7.46941e-06 -3.53998 63.546000 Cu 0.39371 0.745814 0.5 203 63.546 3.59966e-05 -3.53997 63.546000 Cu 0.30896 0.757532 0.5 204 63.546 3.14411e-05 -3.53998 63.546000 Cu 0.544585 0.738803 0 207 63.546 5.81806e-05 -3.53997 63.546000 Cu 0.478481 0.734118 0.5 209 63.546 4.85802e-05 -3.53996 63.546000 Cu 0.459765 0.750494 1 236 63.546 1.41512e-05 -3.53998 63.546000 Cu 0.52583 0.755186 0.5 238 63.546 7.92674e-06 -3.53998 63.546000 Cu 0.676749 0.748177 2.30119e-16 211 63.546 1.07128e-05 -3.53998 63.546000 Cu 0.610642 0.743493 0.5 213 63.546 1.22954e-05 -3.53997 63.546000 Cu 0.59191 0.759871 8.57989e-17 239 63.546 1.10101e-05 -3.53998 63.546000 Cu 0.658017 0.764554 0.5 241 63.546 2.81315e-06 -3.53998 63.546000 Cu 0.761528 0.736474 0 214 63.546 3.06463e-05 -3.53996 63.546000 Cu 0.80896 0.757532 0 215 63.546 3.14411e-05 -3.53998 63.546000 Cu 0.827614 0.741142 0.5 216 63.546 1.53502e-05 -3.53998 63.546000 Cu 0.742842 0.752855 0.5 217 63.546 7.09954e-06 -3.53998 63.546000 Cu 0.978481 0.734118 9.43307e-17 190 63.546 4.85802e-05 -3.53996 63.546000 Cu 0.89371 0.745814 1 218 63.546 3.59966e-05 -3.53997 63.546000 Cu 0.959765 0.750494 0.5 220 63.546 1.41512e-05 -3.53998 63.546000 Cu 0.87499 0.762203 0.5 221 63.546 7.46941e-06 -3.53998 63.546000 Cu 0.0732323 0.776251 8.18334e-17 223 63.546 5.22093e-06 -3.53997 63.546000 Cu 0.00711652 0.771562 0.5 225 63.546 2.69185e-05 -3.53997 63.546000 Cu 0.139309 0.780935 0.5 229 63.546 7.11403e-06 -3.53998 63.546000 Cu 0.0545498 0.792627 0.5 253 63.546 2.27954e-05 -3.53998 63.546000 Cu 0.12061 0.797315 0 255 63.546 1.88652e-05 -3.53998 63.546000 Cu 0.205397 0.785618 0 227 63.546 7.50859e-06 -3.53999 63.546000 Cu 0.224138 0.769237 0.5 228 63.546 6.23735e-06 -3.53998 63.546000 Cu 0.271478 0.790297 0.5 233 63.546 1.05132e-05 -3.53999 63.546000 Cu 0.290221 0.773919 3.2445e-18 230 63.546 7.6941e-06 -3.53998 63.546000 Cu 0.337595 0.794977 1 231 63.546 4.56405e-05 -3.53999 63.546000 Cu 0.356314 0.778596 0.5 232 63.546 1.69004e-05 -3.53999 63.546000 Cu 0.42239 0.78327 1.75083e-16 234 63.546 1.05749e-05 -3.53998 63.546000 Cu 0.403683 0.799646 0.5 235 63.546 3.77794e-05 -3.53999 63.546000 Cu 0.44106 0.766883 0.5 205 63.546 1.01838e-05 -3.53998 63.546000 Cu 0.507117 0.771562 2.94408e-16 237 63.546 2.69185e-05 -3.53997 63.546000 Cu 0.488484 0.787944 0.5 268 63.546 2.69327e-05 -3.53998 63.546000 Cu 0.55455 0.792627 0 269 63.546 2.27954e-05 -3.53998 63.546000 Cu 0.639309 0.780935 1 240 63.546 7.11403e-06 -3.53998 63.546000 Cu 0.573232 0.776251 0.5 242 63.546 5.22093e-06 -3.53997 63.546000 Cu 0.705397 0.785618 0.5 246 63.546 7.50859e-06 -3.53999 63.546000 Cu 0.62061 0.797315 0.5 271 63.546 1.88652e-05 -3.53998 63.546000 Cu 0.724138 0.769237 0 243 63.546 6.23735e-06 -3.53998 63.546000 Cu 0.771478 0.790297 1 244 63.546 1.05132e-05 -3.53999 63.546000 Cu 0.790221 0.773919 0.5 245 63.546 7.6941e-06 -3.53998 63.546000 Cu 0.837595 0.794977 0.5 250 63.546 4.56405e-05 -3.53999 63.546000 Cu 0.856314 0.778596 1 247 63.546 1.69004e-05 -3.53999 63.546000 Cu 0.94106 0.766883 4.83069e-17 219 63.546 1.01838e-05 -3.53998 63.546000 Cu 0.903683 0.799646 4.14575e-17 248 63.546 3.77794e-05 -3.53999 63.546000 Cu 0.92239 0.78327 0.5 249 63.546 1.05749e-05 -3.53998 63.546000 Cu 0.988484 0.787944 7.04176e-17 251 63.546 2.69327e-05 -3.53998 63.546000 Cu 0.035791 0.809004 4.35003e-17 252 63.546 4.61335e-06 -3.53999 63.546000 Cu 0.101845 0.813691 0.5 258 63.546 3.24575e-06 -3.53999 63.546000 Cu 0.0170097 0.825377 0.5 283 63.546 9.27518e-06 -3.53999 63.546000 Cu 0.0830722 0.830064 0 285 63.546 8.57117e-06 -3.53999 63.546000 Cu 0.16789 0.818372 0 256 63.546 1.06665e-05 -3.53999 63.546000 Cu 0.186644 0.801995 0.5 257 63.546 8.5577e-06 -3.53999 63.546000 Cu 0.25271 0.806666 1 259 63.546 1.0957e-05 -3.53999 63.546000 Cu 0.233936 0.823037 0.5 262 63.546 1.16079e-05 -3.53999 63.546000 Cu 0.299962 0.827701 2.0909e-17 260 63.546 2.5382e-05 -3.53999 63.546000 Cu 0.318785 0.811336 0.5 261 63.546 7.49274e-06 -3.53999 63.546000 Cu 0.384868 0.816015 3.52088e-17 263 63.546 5.7652e-06 -3.53999 63.546000 Cu 0.366042 0.832372 0.5 266 63.546 1.19377e-05 -3.53999 63.546000 Cu 0.450929 0.820692 0.5 265 63.546 5.40481e-06 -3.53999 63.546000 Cu 0.469762 0.804323 0 267 63.546 4.24546e-05 -3.53999 63.546000 Cu 0.535791 0.809004 0.5 272 63.546 4.61335e-06 -3.53999 63.546000 Cu 0.51701 0.825377 2.27115e-16 297 63.546 9.27518e-06 -3.53999 63.546000 Cu 0.601845 0.813691 2.05485e-17 270 63.546 3.24575e-06 -3.53999 63.546000 Cu 0.686644 0.801995 1 273 63.546 8.5577e-06 -3.53999 63.546000 Cu 0.66789 0.818372 0.5 276 63.546 1.06665e-05 -3.53999 63.546000 Cu 0.583072 0.830064 0.5 299 63.546 8.57117e-06 -3.53999 63.546000 Cu 0.733936 0.823037 5.32338e-17 274 63.546 1.16079e-05 -3.53999 63.546000 Cu 0.75271 0.806666 0.5 275 63.546 1.0957e-05 -3.53999 63.546000 Cu 0.818785 0.811336 3.49685e-17 277 63.546 7.49274e-06 -3.53999 63.546000 Cu 0.799962 0.827701 0.5 280 63.546 2.5382e-05 -3.53999 63.546000 Cu 0.969762 0.804323 0.5 254 63.546 4.24546e-05 -3.53999 63.546000 Cu 0.866042 0.832372 4.28995e-17 278 63.546 1.19377e-05 -3.53999 63.546000 Cu 0.884868 0.816015 0.5 279 63.546 5.7652e-06 -3.53999 63.546000 Cu 0.950929 0.820692 1 281 63.546 5.40481e-06 -3.53999 63.546000 Cu 0.130324 0.851135 1.62225e-16 286 63.546 7.01565e-05 -3.53999 63.546000 Cu 0.0642703 0.846442 0.5 288 63.546 5.45274e-05 -3.53999 63.546000 Cu 0.0453991 0.862798 1 313 63.546 0.000123003 -3.53998 63.546000 Cu 0.149124 0.834753 0.5 287 63.546 3.13842e-05 -3.53999 63.546000 Cu 0.215134 0.839418 0 289 63.546 1.95547e-05 -3.53999 63.546000 Cu 0.262245 0.860453 1 290 63.546 8.23237e-05 -3.53996 63.546000 Cu 0.281165 0.844072 0.5 291 63.546 6.75934e-05 -3.53998 63.546000 Cu 0.196323 0.855808 0.5 292 63.546 6.13787e-05 -3.53999 63.546000 Cu 0.347174 0.848725 1.16201e-16 293 63.546 0.00010406 -3.53997 63.546000 Cu 0.413237 0.853403 0.5 295 63.546 9.47822e-05 -3.53997 63.546000 Cu 0.328203 0.86509 0.5 296 63.546 0.000147575 -3.53993 63.546000 Cu 0.432106 0.837052 6.12849e-17 264 63.546 1.17739e-05 -3.53999 63.546000 Cu 0.56427 0.846442 2.53551e-17 298 63.546 5.45274e-05 -3.53999 63.546000 Cu 0.498194 0.841743 0.5 300 63.546 3.4231e-05 -3.53999 63.546000 Cu 0.479289 0.858089 1 327 63.546 6.19357e-05 -3.53997 63.546000 Cu 0.545399 0.862798 0.5 329 63.546 0.000123003 -3.53998 63.546000 Cu 0.649124 0.834753 5.65984e-17 301 63.546 3.13842e-05 -3.53999 63.546000 Cu 0.696323 0.855808 4.56633e-18 302 63.546 6.13787e-05 -3.53999 63.546000 Cu 0.630324 0.851135 0.5 304 63.546 7.01565e-05 -3.53999 63.546000 Cu 0.715134 0.839418 0.5 303 63.546 1.95547e-05 -3.53999 63.546000 Cu 0.781165 0.844072 4.00155e-17 305 63.546 6.75934e-05 -3.53998 63.546000 Cu 0.828203 0.86509 1.49006e-17 306 63.546 0.000147575 -3.53993 63.546000 Cu 0.847174 0.848725 0.5 307 63.546 0.00010406 -3.53997 63.546000 Cu 0.762245 0.860453 0.5 308 63.546 8.23237e-05 -3.53996 63.546000 Cu 0.998194 0.841743 0 282 63.546 3.4231e-05 -3.53999 63.546000 Cu 0.932106 0.837052 0.5 284 63.546 1.17739e-05 -3.53999 63.546000 Cu 0.913237 0.853403 1 309 63.546 9.47822e-05 -3.53997 63.546000 Cu 0.979289 0.858089 0.5 311 63.546 6.19357e-05 -3.53997 63.546000 Cu 0.0925433 0.883863 1 314 63.546 0.000411979 -3.53996 63.546000 Cu 0.111462 0.867512 0.5 315 63.546 0.000183825 -3.53998 63.546000 Cu 0.0263838 0.879116 0.5 316 63.546 0.000112325 -3.53995 63.546000 Cu 0.0072285 0.89542 1.27377e-16 343 63.546 0.000170797 -3.5399 63.546000 Cu 0.177474 0.872211 0 317 63.546 0.000223113 -3.53997 63.546000 Cu 0.224582 0.893321 6.24866e-18 318 63.546 0.000880089 -3.53991 63.546000 Cu 0.243364 0.87687 0.5 319 63.546 0.000132841 -3.53995 63.546000 Cu 0.158588 0.888606 0.5 320 63.546 0.000651131 -3.53995 63.546000 Cu 0.394177 0.869735 0 294 63.546 0.000177646 -3.53992 63.546000 Cu 0.309194 0.881475 2.29879e-16 321 63.546 0.000465779 -3.53989 63.546000 Cu 0.375118 0.886089 0.5 323 63.546 0.000552604 -3.53988 63.546000 Cu 0.290404 0.897945 0.5 324 63.546 0.000434631 -3.53988 63.546000 Cu 0.441121 0.890726 1 325 63.546 0.000395996 -3.53987 63.546000 Cu 0.526384 0.879116 7.95502e-17 328 63.546 0.000112325 -3.53995 63.546000 Cu 0.460271 0.874414 0.5 330 63.546 8.68026e-05 -3.53993 63.546000 Cu 0.507228 0.89542 0.5 359 63.546 0.000170797 -3.5399 63.546000 Cu 0.611462 0.867512 1 331 63.546 0.000183825 -3.53998 63.546000 Cu 0.658588 0.888606 1.92266e-17 332 63.546 0.000651131 -3.53995 63.546000 Cu 0.677474 0.872211 0.5 333 63.546 0.000223113 -3.53997 63.546000 Cu 0.592543 0.883863 0.5 334 63.546 0.000411979 -3.53996 63.546000 Cu 0.743364 0.87687 0 335 63.546 0.000132841 -3.53995 63.546000 Cu 0.790404 0.897945 2.9561e-17 336 63.546 0.000434631 -3.53988 63.546000 Cu 0.809194 0.881475 0.5 337 63.546 0.000465779 -3.53989 63.546000 Cu 0.724582 0.893321 0.5 338 63.546 0.000880089 -3.53991 63.546000 Cu 0.960271 0.874414 7.47436e-17 310 63.546 8.68026e-05 -3.53993 63.546000 Cu 0.894177 0.869735 0.5 312 63.546 0.000177646 -3.53992 63.546000 Cu 0.875118 0.886089 1 339 63.546 0.000552604 -3.53988 63.546000 Cu 0.941121 0.890726 0.5 341 63.546 0.000395996 -3.53987 63.546000 Cu 0.0541162 0.916438 1.18965e-16 344 63.546 0.000603587 -3.53984 63.546000 Cu 0.0733661 0.900151 0.5 345 63.546 0.000172285 -3.53991 63.546000 Cu 0.139648 0.904953 0 347 63.546 0.00116317 -3.53981 63.546000 Cu 0.120403 0.921162 0.5 350 63.546 0.00127241 -3.53958 63.546000 Cu 0.0347379 0.932673 0.5 374 63.546 0.00327674 -3.53923 63.546000 Cu 0.187096 0.92607 7.52242e-17 348 63.546 0.00477699 -3.53921 63.546000 Cu 0.205824 0.909733 0.5 349 63.546 0.0023031 -3.53982 63.546000 Cu 0.271901 0.914441 1 351 63.546 0.00229947 -3.53974 63.546000 Cu 0.253455 0.930874 0.5 354 63.546 0.00661165 -3.53935 63.546000 Cu 0.356139 0.902471 4.56633e-18 322 63.546 0.0020155 -3.53972 63.546000 Cu 0.422058 0.907073 0.5 326 63.546 0.00133985 -3.53984 63.546000 Cu 0.337583 0.919019 0.5 353 63.546 0.00142168 -3.53951 63.546000 Cu 0.40293 0.923429 1 355 63.546 0.0108386 -3.53862 63.546000 Cu 0.488009 0.911703 1 358 63.546 0.000802281 -3.53978 63.546000 Cu 0.554116 0.916438 0.5 363 63.546 0.000603587 -3.53984 63.546000 Cu 0.4689 0.928052 0.5 388 63.546 0.00480764 -3.53969 63.546000 Cu 0.534738 0.932673 1.2269e-16 389 63.546 0.00327674 -3.53923 63.546000 Cu 0.573366 0.900151 2.35767e-16 360 63.546 0.000172285 -3.53991 63.546000 Cu 0.620403 0.921162 1.68714e-16 361 63.546 0.00127241 -3.53958 63.546000 Cu 0.639648 0.904953 0.5 362 63.546 0.00116317 -3.53981 63.546000 Cu 0.705824 0.909733 1.59701e-16 364 63.546 0.0023031 -3.53982 63.546000 Cu 0.687096 0.92607 0.5 367 63.546 0.00477699 -3.53921 63.546000 Cu 0.753455 0.930874 1 365 63.546 0.00661165 -3.53935 63.546000 Cu 0.771901 0.914441 0.5 366 63.546 0.00229947 -3.53974 63.546000 Cu 0.837583 0.919019 6.74134e-17 368 63.546 0.00142168 -3.53951 63.546000 Cu 0.856139 0.902471 0.5 342 63.546 0.0020155 -3.53972 63.546000 Cu 0.922058 0.907073 1 340 63.546 0.00133985 -3.53984 63.546000 Cu 0.988009 0.911703 0.5 346 63.546 0.000802281 -3.53978 63.546000 Cu 0.90293 0.923429 0.5 370 63.546 0.0108386 -3.53862 63.546000 Cu 0.9689 0.928052 1 372 63.546 0.00480764 -3.53969 63.546000 Cu 0.0158394 0.949061 0 373 63.546 0.0368342 -3.53827 63.546000 Cu 0.101422 0.937365 0 376 63.546 0.00363311 -3.53906 63.546000 Cu 0.082273 0.953375 0.5 379 63.546 0.0301367 -3.53611 63.546000 Cu 0.149295 0.958471 0 377 63.546 0.0247941 -3.53667 63.546000 Cu 0.16772 0.942141 0.5 378 63.546 0.0079467 -3.53835 63.546000 Cu 0.235324 0.947193 1 380 63.546 0.0242708 -3.5357 63.546000 Cu 0.215253 0.962822 0.5 383 63.546 0.0810586 -3.53233 63.546000 Cu 0.319469 0.935611 0 352 63.546 0.00794721 -3.53827 63.546000 Cu 0.384607 0.940198 0.5 357 63.546 0.00934426 -3.53714 63.546000 Cu 0.301361 0.952138 0.5 382 63.546 0.0317989 -3.53605 63.546000 Cu 0.366577 0.957176 1.21368e-16 384 63.546 0.0449561 -3.53508 63.546000 Cu 0.449195 0.944254 0 356 63.546 0.0674967 -3.53337 63.546000 Cu 0.43106 0.961347 0.5 386 63.546 0.0247309 -3.53179 63.546000 Cu 0.515839 0.949061 0.5 392 63.546 0.0368342 -3.53827 63.546000 Cu 0.494344 0.964843 1 414 63.546 0.390567 -3.50263 63.546000 Cu 0.582273 0.953375 7.94301e-17 390 63.546 0.0301367 -3.53611 63.546000 Cu 0.601422 0.937365 0.5 391 63.546 0.00363311 -3.53906 63.546000 Cu 0.66772 0.942141 8.39964e-17 393 63.546 0.0079467 -3.53835 63.546000 Cu 0.649295 0.958471 0.5 396 63.546 0.0247941 -3.53667 63.546000 Cu 0.819469 0.935611 0.5 371 63.546 0.00794721 -3.53827 63.546000 Cu 0.715253 0.962822 8.92837e-17 394 63.546 0.0810586 -3.53233 63.546000 Cu 0.735324 0.947193 0.5 395 63.546 0.0242708 -3.5357 63.546000 Cu 0.801361 0.952138 1 397 63.546 0.0317989 -3.53605 63.546000 Cu 0.884607 0.940198 0 369 63.546 0.00934426 -3.53714 63.546000 Cu 0.949195 0.944254 0.5 375 63.546 0.0674967 -3.53337 63.546000 Cu 0.866577 0.957176 0.5 399 63.546 0.0449561 -3.53508 63.546000 Cu 0.93106 0.961347 1.99116e-16 401 63.546 0.0247309 -3.53179 63.546000 Cu 0.994344 0.964843 0.5 403 63.546 0.390567 -3.50263 63.546000 Cu 0.0653144 0.969412 1 405 63.546 0.457547 -3.47248 63.546000 Cu 0.108673 0.994167 0 406 63.546 7.65319 -3.40993 63.546000 Cu 0.129681 0.974699 0.5 407 63.546 0.415006 -3.47567 63.546000 Cu 0.0455207 0.983464 0.5 408 63.546 10.3166 -3.26812 63.546000 Cu 0.28338 0.968634 2.51028e-16 381 63.546 0.348961 -3.47763 63.546000 Cu 0.1958 0.97905 2.51268e-16 409 63.546 2.88137 -3.42352 63.546000 Cu 0.262814 0.983106 0.5 410 63.546 8.88739 -3.35933 63.546000 Cu 0.179041 0.994164 0.5 411 63.546 8.12525 -3.4409 63.546000 Cu 0.413014 0.978283 8.17132e-18 385 63.546 2.95531 -3.42233 63.546000 Cu 0.348105 0.974148 0.5 387 63.546 0.484071 -3.47215 63.546000 Cu 0.326686 0.994163 1.46603e-17 412 63.546 8.13029 -3.34849 63.546000 Cu 0.397761 0.994167 0.5 413 63.546 8.26943 -3.43668 63.546000 Cu 0.545521 0.983464 7.96704e-17 415 63.546 10.3166 -3.26812 63.546000 Cu 0.565314 0.969412 0.5 416 63.546 0.457547 -3.47248 63.546000 Cu 0.480448 0.982257 0.5 417 63.546 8.90646 -3.34013 63.546000 Cu 0.629681 0.974699 0 418 63.546 0.415006 -3.47567 63.546000 Cu 0.679041 0.994164 1 419 63.546 8.12525 -3.4409 63.546000 Cu 0.6958 0.97905 0.5 420 63.546 2.88137 -3.42352 63.546000 Cu 0.608673 0.994167 0.5 421 63.546 7.65319 -3.40993 63.546000 Cu 0.848105 0.974148 5.05901e-17 398 63.546 0.484071 -3.47215 63.546000 Cu 0.78338 0.968634 0.5 400 63.546 0.348961 -3.47763 63.546000 Cu 0.762814 0.983106 1 422 63.546 8.88739 -3.35933 63.546000 Cu 0.826686 0.994163 0.5 423 63.546 8.13029 -3.34849 63.546000 Cu 0.980448 0.982257 1 402 63.546 8.90646 -3.34013 63.546000 Cu 0.913014 0.978283 0.5 404 63.546 2.95531 -3.42233 63.546000 Cu 0.897761 0.994167 0 424 63.546 8.26943 -3.43668