Number of particles = 850 A = 1 Angstrom (basic length-scale) H0(1,1) = 26.3023 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 106.32 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.6084 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 0.0841363 0.0189012 0 443 63.546 2.27957 -3.42741 63.546000 Cu 0.0688745 0.00485981 0.5 444 63.546 8.30367 -3.17325 63.546000 Cu 0.0113972 0.0223659 0.5 445 63.546 0.868706 -3.46476 63.546000 Cu 0.212545 0.00542031 3.96615e-17 446 63.546 8.54304 -3.52512 63.546000 Cu 0.150802 0.0157925 0.5 447 63.546 7.13177 -3.22165 63.546000 Cu 0.234758 0.0250175 0.5 469 63.546 0.279485 -3.45357 63.546000 Cu 0.279173 0.00496067 0.5 448 63.546 10.6189 -3.25867 63.546000 Cu 0.300417 0.0192463 7.10301e-17 471 63.546 1.80921 -3.42348 63.546000 Cu 0.365341 0.015697 0.5 473 63.546 6.28261 -3.23347 63.546000 Cu 0.429971 0.00472766 3.95413e-17 475 63.546 8.82136 -3.45399 63.546000 Cu 0.499564 0.00459184 0.5 477 63.546 4.51363 -3.49225 63.546000 Cu 0.448962 0.0255194 0.5 478 63.546 0.506392 -3.41297 63.546000 Cu 0.568875 0.00485981 3.96615e-17 425 63.546 8.30367 -3.17325 63.546000 Cu 0.584136 0.0189012 0.5 427 63.546 2.27957 -3.42741 63.546000 Cu 0.511397 0.0223659 5.20407e-17 476 63.546 0.868706 -3.46476 63.546000 Cu 0.650802 0.0157925 2.40373e-18 426 63.546 7.13177 -3.22165 63.546000 Cu 0.712545 0.00542031 0.5 429 63.546 8.54304 -3.52512 63.546000 Cu 0.734758 0.0250175 3.96615e-17 434 63.546 0.279485 -3.45357 63.546000 Cu 0.779173 0.00496067 9.61491e-19 428 63.546 10.6189 -3.25867 63.546000 Cu 0.800417 0.0192463 0.5 436 63.546 1.80921 -3.42348 63.546000 Cu 0.865341 0.015697 1 438 63.546 6.28261 -3.23347 63.546000 Cu 0.948962 0.0255194 5.54059e-17 439 63.546 0.506392 -3.41297 63.546000 Cu 0.929971 0.00472766 0.5 440 63.546 8.82136 -3.45399 63.546000 Cu 0.999564 0.00459184 1.64415e-16 442 63.546 4.51363 -3.49225 63.546000 Cu 0.0317327 0.0393795 3.96615e-17 463 63.546 0.10625 -3.49976 63.546000 Cu 0.117744 0.0512115 0 464 63.546 0.0319896 -3.51841 63.546000 Cu 0.0982216 0.035021 0.5 465 63.546 0.156128 -3.53502 63.546000 Cu 0.0515625 0.0558608 0.5 466 63.546 0.0107354 -3.50929 63.546000 Cu 0.170042 0.030762 3.96615e-17 467 63.546 0.491113 -3.46016 63.546000 Cu 0.185868 0.0462969 0.5 470 63.546 0.0200052 -3.52805 63.546000 Cu 0.254637 0.041685 5.25214e-17 468 63.546 0.112988 -3.49044 63.546000 Cu 0.319277 0.036253 0.5 474 63.546 0.0304136 -3.5229 63.546000 Cu 0.271456 0.057721 0.5 500 63.546 0.0107186 -3.51207 63.546000 Cu 0.338337 0.0527367 2.89649e-17 502 63.546 0.0256919 -3.50935 63.546000 Cu 0.386572 0.0310965 2.90851e-17 472 63.546 0.393161 -3.47872 63.546000 Cu 0.403461 0.0477987 0.5 504 63.546 0.0471282 -3.52402 63.546000 Cu 0.467996 0.043734 1.10571e-16 506 63.546 0.0720805 -3.51285 63.546000 Cu 0.486044 0.0604569 0.5 509 63.546 0.0206175 -3.50684 63.546000 Cu 0.598222 0.035021 0 430 63.546 0.156128 -3.53502 63.546000 Cu 0.617744 0.0512115 0.5 433 63.546 0.0319896 -3.51841 63.546000 Cu 0.551563 0.0558608 1 507 63.546 0.0107354 -3.50929 63.546000 Cu 0.531733 0.0393795 0.5 508 63.546 0.10625 -3.49976 63.546000 Cu 0.670042 0.030762 0.5 432 63.546 0.491113 -3.46016 63.546000 Cu 0.685868 0.0462969 2.40373e-19 431 63.546 0.0200052 -3.52805 63.546000 Cu 0.754637 0.041685 0.5 437 63.546 0.112988 -3.49044 63.546000 Cu 0.819277 0.036253 1.14778e-16 435 63.546 0.0304136 -3.5229 63.546000 Cu 0.771456 0.057721 1 455 63.546 0.0107186 -3.51207 63.546000 Cu 0.838337 0.0527367 0.5 457 63.546 0.0256919 -3.50935 63.546000 Cu 0.886572 0.0310965 0.5 441 63.546 0.393161 -3.47872 63.546000 Cu 0.903461 0.0477987 6.27373e-17 459 63.546 0.0471282 -3.52402 63.546000 Cu 0.986044 0.0604569 3.96615e-17 460 63.546 0.0206175 -3.50684 63.546000 Cu 0.967996 0.043734 0.5 461 63.546 0.0720805 -3.51285 63.546000 Cu 0.0704323 0.0721547 3.96615e-17 494 63.546 0.00334588 -3.51431 63.546000 Cu 0.0889865 0.0883561 0.5 497 63.546 0.000569827 -3.51674 63.546000 Cu 0.00427966 0.0768143 0.5 492 63.546 0.00459136 -3.51434 63.546000 Cu 0.203829 0.0623892 6.1896e-17 498 63.546 0.0114221 -3.52383 63.546000 Cu 0.15553 0.0835002 8.56928e-17 495 63.546 0.00094492 -3.51765 63.546000 Cu 0.13694 0.0673021 0.5 496 63.546 0.00182181 -3.51673 63.546000 Cu 0.222078 0.0786806 0.5 501 63.546 0.00266703 -3.51855 63.546000 Cu 0.288862 0.0739079 1.02158e-17 499 63.546 0.00567653 -3.52234 63.546000 Cu 0.35539 0.0692807 0.5 505 63.546 0.00859797 -3.51613 63.546000 Cu 0.306371 0.0903428 0.5 532 63.546 0.00229611 -3.52007 63.546000 Cu 0.372472 0.0858335 9.66298e-17 534 63.546 0.000763487 -3.51722 63.546000 Cu 0.420732 0.0647744 8.89379e-18 503 63.546 0.0060039 -3.51275 63.546000 Cu 0.438373 0.0813623 0.5 536 63.546 0.00361324 -3.51256 63.546000 Cu 0.50428 0.0768143 1 538 63.546 0.00459136 -3.51434 63.546000 Cu 0.588987 0.0883561 2.40373e-19 449 63.546 0.000569827 -3.51674 63.546000 Cu 0.570432 0.0721547 0.5 450 63.546 0.00334588 -3.51431 63.546000 Cu 0.703829 0.0623892 0.5 453 63.546 0.0114221 -3.52383 63.546000 Cu 0.63694 0.0673021 2.99264e-17 451 63.546 0.00182181 -3.51673 63.546000 Cu 0.722078 0.0786806 1.80279e-18 452 63.546 0.00266703 -3.51855 63.546000 Cu 0.65553 0.0835002 0.5 454 63.546 0.00094492 -3.51765 63.546000 Cu 0.85539 0.0692807 5.39637e-17 456 63.546 0.00859797 -3.51613 63.546000 Cu 0.788862 0.0739079 0.5 458 63.546 0.00567653 -3.52234 63.546000 Cu 0.806371 0.0903428 1.55882e-16 486 63.546 0.00229611 -3.52007 63.546000 Cu 0.872472 0.0858335 0.5 488 63.546 0.000763487 -3.51722 63.546000 Cu 0.920732 0.0647744 0.5 462 63.546 0.0060039 -3.51275 63.546000 Cu 0.938373 0.0813623 7.55972e-17 490 63.546 0.00361324 -3.51256 63.546000 Cu 0.0225255 0.0931032 3.96615e-17 491 63.546 0.00136599 -3.51666 63.546000 Cu 0.040806 0.109358 0.5 524 63.546 0.000228302 -3.51733 63.546000 Cu 0.107303 0.104586 2.84842e-17 526 63.546 0.000260245 -3.51767 63.546000 Cu 0.125461 0.120872 0.5 529 63.546 0.000376177 -3.51784 63.546000 Cu 0.191794 0.116134 3.96615e-17 527 63.546 0.000695132 -3.51779 63.546000 Cu 0.173755 0.0997916 0.5 528 63.546 0.000858559 -3.51783 63.546000 Cu 0.240145 0.0950245 1 530 63.546 0.0017319 -3.51809 63.546000 Cu 0.32406 0.106832 1.51435e-16 531 63.546 0.000307382 -3.51752 63.546000 Cu 0.257999 0.111443 0.5 533 63.546 0.000654287 -3.51791 63.546000 Cu 0.456252 0.0977522 6.00932e-19 535 63.546 0.00202532 -3.51587 63.546000 Cu 0.390106 0.102298 0.5 537 63.546 0.000902293 -3.51691 63.546000 Cu 0.408062 0.118693 3.60559e-19 565 63.546 0.000894566 -3.5169 63.546000 Cu 0.474363 0.114061 0.5 567 63.546 0.000761713 -3.51712 63.546000 Cu 0.522525 0.0931032 0.5 539 63.546 0.00136599 -3.51666 63.546000 Cu 0.607303 0.104586 0.5 480 63.546 0.000260245 -3.51767 63.546000 Cu 0.540806 0.109358 6.61025e-17 569 63.546 0.000228302 -3.51733 63.546000 Cu 0.625461 0.120872 3.95413e-17 479 63.546 0.000376177 -3.51784 63.546000 Cu 0.673755 0.0997916 1.68261e-17 482 63.546 0.000858559 -3.51783 63.546000 Cu 0.740145 0.0950245 0.5 484 63.546 0.0017319 -3.51809 63.546000 Cu 0.691794 0.116134 0.5 485 63.546 0.000695132 -3.51779 63.546000 Cu 0.757999 0.111443 3.77385e-17 483 63.546 0.000654287 -3.51791 63.546000 Cu 0.82406 0.106832 0.5 489 63.546 0.000307382 -3.51752 63.546000 Cu 0.890106 0.102298 2.2595e-17 487 63.546 0.000902293 -3.51691 63.546000 Cu 0.956252 0.0977522 0.5 493 63.546 0.00202532 -3.51587 63.546000 Cu 0.908062 0.118693 0.5 520 63.546 0.000894566 -3.5169 63.546000 Cu 0.974363 0.114061 3.37724e-17 522 63.546 0.000761713 -3.51712 63.546000 Cu 0.0590191 0.125618 3.95413e-17 523 63.546 7.6374e-05 -3.5177 63.546000 Cu 0.0108244 0.146636 1 553 63.546 4.92519e-05 -3.5179 63.546000 Cu 0.0771888 0.141915 0.5 555 63.546 0.000214474 -3.51804 63.546000 Cu 0.143536 0.137206 3.90606e-17 557 63.546 0.000314638 -3.51803 63.546000 Cu 0.227758 0.148921 2.15134e-17 558 63.546 7.36045e-05 -3.51779 63.546000 Cu 0.20976 0.132516 0.5 559 63.546 0.000335383 -3.51773 63.546000 Cu 0.341927 0.123279 0.5 563 63.546 0.00028945 -3.51684 63.546000 Cu 0.275855 0.127878 4.72332e-17 561 63.546 0.000115045 -3.51733 63.546000 Cu 0.359967 0.139677 3.96615e-17 562 63.546 0.000451557 -3.51721 63.546000 Cu 0.29385 0.144294 0.5 564 63.546 0.000119676 -3.5173 63.546000 Cu 0.49255 0.130344 1 566 63.546 0.000188445 -3.5175 63.546000 Cu 0.426197 0.135029 0.5 568 63.546 0.000446984 -3.51722 63.546000 Cu 0.444486 0.151347 6.20161e-17 596 63.546 6.92289e-05 -3.5177 63.546000 Cu 0.559019 0.125618 0.5 481 63.546 7.6374e-05 -3.5177 63.546000 Cu 0.577189 0.141915 2.15134e-17 510 63.546 0.000214474 -3.51804 63.546000 Cu 0.510824 0.146636 0.5 598 63.546 4.92519e-05 -3.5179 63.546000 Cu 0.643536 0.137206 0.5 512 63.546 0.000314638 -3.51803 63.546000 Cu 0.70976 0.132516 9.25435e-17 514 63.546 0.000335383 -3.51773 63.546000 Cu 0.727758 0.148921 0.5 517 63.546 7.36045e-05 -3.51779 63.546000 Cu 0.841927 0.123279 3.66568e-17 518 63.546 0.00028945 -3.51684 63.546000 Cu 0.79385 0.144294 3.95413e-17 515 63.546 0.000119676 -3.5173 63.546000 Cu 0.775855 0.127878 0.5 516 63.546 0.000115045 -3.51733 63.546000 Cu 0.859967 0.139677 0.5 521 63.546 0.000451557 -3.51721 63.546000 Cu 0.926197 0.135029 1.2259e-17 519 63.546 0.000446984 -3.51722 63.546000 Cu 0.99255 0.130344 0.5 525 63.546 0.000188445 -3.5175 63.546000 Cu 0.944486 0.151347 0.5 551 63.546 6.92289e-05 -3.5177 63.546000 Cu 0.0953621 0.158258 7.9323e-18 554 63.546 0.000155277 -3.51806 63.546000 Cu 0.0290918 0.162957 0.5 556 63.546 8.41559e-05 -3.518 63.546000 Cu 0.0472981 0.179301 8.88177e-17 584 63.546 9.22296e-05 -3.51782 63.546000 Cu 0.113528 0.174627 0.5 586 63.546 7.60094e-05 -3.51784 63.546000 Cu 0.161576 0.153578 0.5 560 63.546 0.000126231 -3.51809 63.546000 Cu 0.179691 0.169969 1 588 63.546 1.25432e-05 -3.5179 63.546000 Cu 0.245846 0.165322 0.5 590 63.546 2.78593e-05 -3.51766 63.546000 Cu 0.263999 0.181705 1.0949e-16 589 63.546 6.40867e-05 -3.51751 63.546000 Cu 0.311994 0.160687 9.61491e-18 592 63.546 0.000181951 -3.51743 63.546000 Cu 0.3302 0.177045 0.5 595 63.546 0.000115522 -3.51742 63.546000 Cu 0.378207 0.156033 0.5 594 63.546 0.000219236 -3.51752 63.546000 Cu 0.396484 0.172362 6.89869e-17 593 63.546 3.84981e-05 -3.51762 63.546000 Cu 0.462793 0.167664 0.5 599 63.546 1.81914e-05 -3.51775 63.546000 Cu 0.595362 0.158258 0.5 513 63.546 0.000155277 -3.51806 63.546000 Cu 0.613528 0.174627 1.61771e-16 541 63.546 7.60094e-05 -3.51784 63.546000 Cu 0.529092 0.162957 5.15599e-17 597 63.546 8.41559e-05 -3.518 63.546000 Cu 0.547298 0.179301 0.5 629 63.546 9.22296e-05 -3.51782 63.546000 Cu 0.661576 0.153578 1.07206e-16 511 63.546 0.000126231 -3.51809 63.546000 Cu 0.679691 0.169969 0.5 543 63.546 1.25432e-05 -3.5179 63.546000 Cu 0.745846 0.165322 3.00466e-17 545 63.546 2.78593e-05 -3.51766 63.546000 Cu 0.8302 0.177045 3.28109e-17 546 63.546 0.000115522 -3.51742 63.546000 Cu 0.811994 0.160687 0.5 547 63.546 0.000181951 -3.51743 63.546000 Cu 0.763999 0.181705 0.5 548 63.546 6.40867e-05 -3.51751 63.546000 Cu 0.878207 0.156033 3.95413e-17 549 63.546 0.000219236 -3.51752 63.546000 Cu 0.962793 0.167664 6.49006e-18 550 63.546 1.81914e-05 -3.51775 63.546000 Cu 0.896484 0.172362 0.5 552 63.546 3.84981e-05 -3.51762 63.546000 Cu 0.0654582 0.195665 0.5 587 63.546 7.54447e-05 -3.51774 63.546000 Cu 0.0835382 0.212044 3.06475e-17 616 63.546 1.27073e-05 -3.51767 63.546000 Cu 0.197816 0.186358 0.5 591 63.546 1.72862e-05 -3.51771 63.546000 Cu 0.131651 0.191009 3.96615e-17 585 63.546 1.72175e-05 -3.51773 63.546000 Cu 0.149719 0.207391 0.5 618 63.546 2.28586e-05 -3.51759 63.546000 Cu 0.215924 0.202732 1 620 63.546 4.54021e-05 -3.51753 63.546000 Cu 0.282158 0.198066 0.5 622 63.546 5.55919e-05 -3.51748 63.546000 Cu 0.348424 0.193385 7.89624e-17 624 63.546 2.55377e-05 -3.51757 63.546000 Cu 0.366628 0.209722 0.5 627 63.546 7.28001e-06 -3.51761 63.546000 Cu 0.481029 0.183991 4.44689e-17 628 63.546 4.96804e-05 -3.51781 63.546000 Cu 0.432926 0.205029 8.68947e-17 625 63.546 2.94637e-05 -3.5177 63.546000 Cu 0.414711 0.18869 0.5 626 63.546 4.63196e-06 -3.51779 63.546000 Cu 0.499222 0.200339 0.5 630 63.546 9.68238e-05 -3.51781 63.546000 Cu 0.565458 0.195665 2.18739e-17 540 63.546 7.54447e-05 -3.51774 63.546000 Cu 0.583538 0.212044 0.5 571 63.546 1.27073e-05 -3.51767 63.546000 Cu 0.697816 0.186358 2.3196e-17 542 63.546 1.72862e-05 -3.51771 63.546000 Cu 0.631651 0.191009 0.5 544 63.546 1.72175e-05 -3.51773 63.546000 Cu 0.649719 0.207391 1.29441e-16 572 63.546 2.28586e-05 -3.51759 63.546000 Cu 0.715924 0.202732 0.5 574 63.546 4.54021e-05 -3.51753 63.546000 Cu 0.782158 0.198066 1 576 63.546 5.55919e-05 -3.51748 63.546000 Cu 0.866628 0.209722 1.04562e-17 577 63.546 7.28001e-06 -3.51761 63.546000 Cu 0.848424 0.193385 0.5 578 63.546 2.55377e-05 -3.51757 63.546000 Cu 0.981029 0.183991 0.5 582 63.546 4.96804e-05 -3.51781 63.546000 Cu 0.914711 0.18869 1 580 63.546 4.63196e-06 -3.51779 63.546000 Cu 0.999222 0.200339 3.95413e-17 581 63.546 9.68238e-05 -3.51781 63.546000 Cu 0.932926 0.205029 0.5 583 63.546 2.94637e-05 -3.5177 63.546000 Cu 0.0173239 0.216705 0.5 614 63.546 4.9799e-05 -3.51771 63.546000 Cu 0.0353486 0.233084 4.07432e-17 613 63.546 1.16906e-05 -3.51766 63.546000 Cu 0.101579 0.228422 0.5 619 63.546 2.01295e-05 -3.51753 63.546000 Cu 0.167797 0.223758 3.96615e-17 617 63.546 3.52268e-05 -3.51745 63.546000 Cu 0.234056 0.219088 0.5 623 63.546 2.03249e-05 -3.51745 63.546000 Cu 0.185911 0.240112 0.5 649 63.546 1.29693e-05 -3.51747 63.546000 Cu 0.300317 0.214411 1.41219e-16 621 63.546 2.11409e-05 -3.5175 63.546000 Cu 0.252187 0.235436 1 651 63.546 7.04007e-06 -3.51754 63.546000 Cu 0.318481 0.230752 0.5 653 63.546 2.07258e-06 -3.51759 63.546000 Cu 0.384783 0.226061 5.54059e-17 655 63.546 3.04253e-05 -3.51763 63.546000 Cu 0.469144 0.237746 8.94186e-17 656 63.546 1.7674e-05 -3.51774 63.546000 Cu 0.451073 0.221376 0.5 657 63.546 7.71097e-05 -3.51762 63.546000 Cu 0.402898 0.242417 0.5 658 63.546 3.18567e-05 -3.51775 63.546000 Cu 0.517324 0.216705 2.43978e-17 659 63.546 4.9799e-05 -3.51771 63.546000 Cu 0.601579 0.228422 6.86264e-17 570 63.546 2.01295e-05 -3.51753 63.546000 Cu 0.535349 0.233084 0.5 660 63.546 1.16906e-05 -3.51766 63.546000 Cu 0.734056 0.219088 3.95413e-17 573 63.546 2.03249e-05 -3.51745 63.546000 Cu 0.667797 0.223758 0.5 575 63.546 3.52268e-05 -3.51745 63.546000 Cu 0.685911 0.240112 1.49031e-17 604 63.546 1.29693e-05 -3.51747 63.546000 Cu 0.800317 0.214411 0.5 579 63.546 2.11409e-05 -3.5175 63.546000 Cu 0.752187 0.235436 0.5 606 63.546 7.04007e-06 -3.51754 63.546000 Cu 0.818481 0.230752 5.02379e-17 608 63.546 2.07258e-06 -3.51759 63.546000 Cu 0.902898 0.242417 1 609 63.546 3.18567e-05 -3.51775 63.546000 Cu 0.884783 0.226061 0.5 610 63.546 3.04253e-05 -3.51763 63.546000 Cu 0.951073 0.221376 1 612 63.546 7.71097e-05 -3.51762 63.546000 Cu 0.969144 0.237746 0.5 615 63.546 1.7674e-05 -3.51774 63.546000 Cu 0.119665 0.244786 0 647 63.546 1.89238e-05 -3.51748 63.546000 Cu 0.053436 0.249457 0.5 645 63.546 2.3429e-05 -3.51753 63.546000 Cu 0.0715795 0.265817 1 644 63.546 8.59889e-06 -3.5177 63.546000 Cu 0.00533143 0.270487 0.5 646 63.546 6.98531e-06 -3.5176 63.546000 Cu 0.204059 0.256463 1 648 63.546 8.07594e-06 -3.51767 63.546000 Cu 0.137809 0.261142 0.5 650 63.546 7.73041e-06 -3.51774 63.546000 Cu 0.336632 0.247097 3.96615e-17 652 63.546 1.71499e-05 -3.51774 63.546000 Cu 0.270322 0.251783 0.5 654 63.546 1.27908e-05 -3.51769 63.546000 Cu 0.288505 0.268131 8.13661e-17 683 63.546 7.57389e-06 -3.51771 63.546000 Cu 0.354765 0.263452 0.5 685 63.546 2.2292e-05 -3.51771 63.546000 Cu 0.421003 0.258783 1.58646e-17 687 63.546 7.56327e-06 -3.51761 63.546000 Cu 0.487224 0.254122 0.5 689 63.546 7.85829e-06 -3.51756 63.546000 Cu 0.619665 0.244786 0.5 602 63.546 1.89238e-05 -3.51748 63.546000 Cu 0.553436 0.249457 1.0985e-16 600 63.546 2.3429e-05 -3.51753 63.546000 Cu 0.571579 0.265817 0.5 603 63.546 8.59889e-06 -3.5177 63.546000 Cu 0.505331 0.270487 9.25435e-17 688 63.546 6.98531e-06 -3.5176 63.546000 Cu 0.637809 0.261142 4.9036e-17 601 63.546 7.73041e-06 -3.51774 63.546000 Cu 0.704059 0.256463 0.5 607 63.546 8.07594e-06 -3.51767 63.546000 Cu 0.836632 0.247097 0.5 611 63.546 1.71499e-05 -3.51774 63.546000 Cu 0.770322 0.251783 4.39882e-17 605 63.546 1.27908e-05 -3.51769 63.546000 Cu 0.788505 0.268131 0.5 637 63.546 7.57389e-06 -3.51771 63.546000 Cu 0.854765 0.263452 3.47338e-17 639 63.546 2.2292e-05 -3.51771 63.546000 Cu 0.921003 0.258783 0.5 641 63.546 7.56327e-06 -3.51761 63.546000 Cu 0.987224 0.254122 1.91096e-17 643 63.546 7.85829e-06 -3.51756 63.546000 Cu 0.0234447 0.28686 3.95413e-17 675 63.546 1.46084e-05 -3.51783 63.546000 Cu 0.10782 0.29854 2.15134e-16 676 63.546 6.56232e-05 -3.51771 63.546000 Cu 0.0896988 0.282184 0.5 677 63.546 2.46877e-05 -3.51796 63.546000 Cu 0.155975 0.277501 3.95413e-17 679 63.546 1.73096e-05 -3.51789 63.546000 Cu 0.222246 0.272815 0.5 681 63.546 1.92673e-06 -3.51773 63.546000 Cu 0.240426 0.289162 5.52857e-18 680 63.546 1.71528e-05 -3.51748 63.546000 Cu 0.174147 0.293844 0.5 682 63.546 1.3356e-05 -3.51757 63.546000 Cu 0.372896 0.279814 3.95413e-17 684 63.546 1.79871e-05 -3.5176 63.546000 Cu 0.306685 0.284486 0.5 686 63.546 3.16558e-05 -3.51759 63.546000 Cu 0.32481 0.300847 3.40127e-17 714 63.546 2.69838e-05 -3.51749 63.546000 Cu 0.439118 0.27515 0.5 690 63.546 5.58798e-06 -3.51757 63.546000 Cu 0.391016 0.296189 0.5 716 63.546 6.80309e-06 -3.51759 63.546000 Cu 0.45722 0.291527 3.96615e-17 718 63.546 2.97408e-06 -3.51769 63.546000 Cu 0.589699 0.282184 9.49472e-18 631 63.546 2.46877e-05 -3.51796 63.546000 Cu 0.60782 0.29854 0.5 634 63.546 6.56232e-05 -3.51771 63.546000 Cu 0.523445 0.28686 0.5 720 63.546 1.46084e-05 -3.51783 63.546000 Cu 0.655975 0.277501 0.5 633 63.546 1.73096e-05 -3.51789 63.546000 Cu 0.722246 0.272815 1 635 63.546 1.92673e-06 -3.51773 63.546000 Cu 0.674147 0.293844 1 632 63.546 1.3356e-05 -3.51757 63.546000 Cu 0.740426 0.289162 0.5 638 63.546 1.71528e-05 -3.51748 63.546000 Cu 0.872896 0.279814 0.5 642 63.546 1.79871e-05 -3.5176 63.546000 Cu 0.806685 0.284486 3.00466e-18 636 63.546 3.16558e-05 -3.51759 63.546000 Cu 0.82481 0.300847 0.5 669 63.546 2.69838e-05 -3.51749 63.546000 Cu 0.939118 0.27515 3.95413e-17 640 63.546 5.58798e-06 -3.51757 63.546000 Cu 0.891016 0.296189 3.95413e-17 671 63.546 6.80309e-06 -3.51759 63.546000 Cu 0.95722 0.291527 0.5 673 63.546 2.97408e-06 -3.51769 63.546000 Cu 0.0415446 0.303229 0.5 678 63.546 8.13737e-05 -3.51764 63.546000 Cu 0.0597073 0.319575 3.17292e-17 706 63.546 6.45504e-05 -3.51775 63.546000 Cu 0.192318 0.310173 0 710 63.546 6.26014e-05 -3.5175 63.546000 Cu 0.144266 0.331196 6.36987e-18 707 63.546 5.91078e-05 -3.51786 63.546000 Cu 0.126007 0.314869 0.5 708 63.546 1.88241e-05 -3.51769 63.546000 Cu 0.210507 0.326514 0.5 713 63.546 9.86703e-05 -3.51756 63.546000 Cu 0.258583 0.305505 0.5 712 63.546 4.34979e-05 -3.51737 63.546000 Cu 0.276733 0.321858 5.84105e-17 711 63.546 5.97639e-05 -3.51747 63.546000 Cu 0.342917 0.317215 0.5 717 63.546 1.38401e-05 -3.5175 63.546000 Cu 0.475309 0.307906 0.5 721 63.546 4.84785e-05 -3.51773 63.546000 Cu 0.409108 0.312569 0 715 63.546 1.63023e-05 -3.51767 63.546000 Cu 0.427208 0.328945 0.5 748 63.546 7.55664e-05 -3.51787 63.546000 Cu 0.493454 0.324271 1 750 63.546 8.74316e-05 -3.5179 63.546000 Cu 0.541545 0.303229 3.96615e-17 719 63.546 8.13737e-05 -3.51764 63.546000 Cu 0.559707 0.319575 0.5 662 63.546 6.45504e-05 -3.51775 63.546000 Cu 0.692318 0.310173 0.5 665 63.546 6.26014e-05 -3.5175 63.546000 Cu 0.626007 0.314869 3.89404e-17 663 63.546 1.88241e-05 -3.51769 63.546000 Cu 0.710507 0.326514 1.4819e-16 664 63.546 9.86703e-05 -3.51756 63.546000 Cu 0.644266 0.331196 0.5 666 63.546 5.91078e-05 -3.51786 63.546000 Cu 0.758583 0.305505 4.68727e-17 667 63.546 4.34979e-05 -3.51737 63.546000 Cu 0.842917 0.317215 1 668 63.546 1.38401e-05 -3.5175 63.546000 Cu 0.776733 0.321858 0.5 670 63.546 5.97639e-05 -3.51747 63.546000 Cu 0.975309 0.307906 5.4805e-17 672 63.546 4.84785e-05 -3.51773 63.546000 Cu 0.909108 0.312569 0.5 674 63.546 1.63023e-05 -3.51767 63.546000 Cu 0.927208 0.328945 6.95879e-17 702 63.546 7.55664e-05 -3.51787 63.546000 Cu 0.993454 0.324271 0.5 704 63.546 8.74316e-05 -3.5179 63.546000 Cu 0.0116374 0.340616 3.96615e-17 703 63.546 9.49235e-05 -3.518 63.546000 Cu 0.077952 0.335908 0.5 709 63.546 2.76514e-05 -3.51795 63.546000 Cu 0.0297935 0.356936 0.5 736 63.546 6.34523e-05 -3.51814 63.546000 Cu 0.0961915 0.352219 1 738 63.546 4.81393e-05 -3.51781 63.546000 Cu 0.228747 0.342866 0 742 63.546 0.000146963 -3.51737 63.546000 Cu 0.162524 0.347527 0.5 740 63.546 0.000169056 -3.51758 63.546000 Cu 0.246953 0.35924 0.5 745 63.546 0.000183037 -3.51713 63.546000 Cu 0.294892 0.338232 0.5 744 63.546 4.02039e-05 -3.51743 63.546000 Cu 0.361021 0.333593 3.04071e-17 746 63.546 1.92345e-05 -3.51757 63.546000 Cu 0.313041 0.354622 2.2595e-17 743 63.546 4.08991e-05 -3.51721 63.546000 Cu 0.445317 0.345315 0 747 63.546 0.000195777 -3.51801 63.546000 Cu 0.379132 0.349982 0.5 749 63.546 8.01139e-05 -3.51751 63.546000 Cu 0.463425 0.361669 0.5 779 63.546 0.000299476 -3.51807 63.546000 Cu 0.577952 0.335908 4.7113e-17 661 63.546 2.76514e-05 -3.51795 63.546000 Cu 0.511637 0.340616 0.5 751 63.546 9.49235e-05 -3.518 63.546000 Cu 0.596192 0.352219 0.5 692 63.546 4.81393e-05 -3.51781 63.546000 Cu 0.529794 0.356936 5.21609e-17 781 63.546 6.34523e-05 -3.51814 63.546000 Cu 0.728747 0.342866 0.5 696 63.546 0.000146963 -3.51737 63.546000 Cu 0.662524 0.347527 1.86649e-16 694 63.546 0.000169056 -3.51758 63.546000 Cu 0.746953 0.35924 3.96615e-17 695 63.546 0.000183037 -3.51713 63.546000 Cu 0.794892 0.338232 1 698 63.546 4.02039e-05 -3.51743 63.546000 Cu 0.861021 0.333593 0.5 700 63.546 1.92345e-05 -3.51757 63.546000 Cu 0.813041 0.354622 0.5 701 63.546 4.08991e-05 -3.51721 63.546000 Cu 0.879132 0.349982 8.14863e-17 699 63.546 8.01139e-05 -3.51751 63.546000 Cu 0.945317 0.345315 0.5 705 63.546 0.000195777 -3.51801 63.546000 Cu 0.963425 0.361669 1.21869e-16 734 63.546 0.000299476 -3.51807 63.546000 Cu 0.114441 0.368519 0.5 741 63.546 0.000272905 -3.51783 63.546000 Cu 0.0479978 0.373239 0 735 63.546 7.3077e-05 -3.51804 63.546000 Cu 0.0662857 0.389512 0.5 767 63.546 0.00030004 -3.51759 63.546000 Cu 0.180749 0.36386 1 739 63.546 0.000333667 -3.51728 63.546000 Cu 0.132688 0.384823 1 769 63.546 0.000738466 -3.51742 63.546000 Cu 0.198947 0.380215 0.5 771 63.546 0.000539508 -3.51707 63.546000 Cu 0.331093 0.371028 0.5 775 63.546 0.000109779 -3.51733 63.546000 Cu 0.265059 0.375639 1 773 63.546 0.00017189 -3.51682 63.546000 Cu 0.349101 0.387455 3.95413e-17 774 63.546 0.000595393 -3.5179 63.546000 Cu 0.283047 0.392069 0.5 776 63.546 0.000319193 -3.51758 63.546000 Cu 0.397216 0.366372 9.23031e-17 777 63.546 0.000292947 -3.51771 63.546000 Cu 0.481592 0.377993 1.46627e-16 778 63.546 0.000254653 -3.51805 63.546000 Cu 0.415247 0.382755 0.5 780 63.546 0.000825473 -3.51794 63.546000 Cu 0.614441 0.368519 3.40127e-17 691 63.546 0.000272905 -3.51783 63.546000 Cu 0.547998 0.373239 0.5 693 63.546 7.3077e-05 -3.51804 63.546000 Cu 0.566286 0.389512 6.82658e-17 722 63.546 0.00030004 -3.51759 63.546000 Cu 0.680749 0.36386 0.5 697 63.546 0.000333667 -3.51728 63.546000 Cu 0.632688 0.384823 0.5 724 63.546 0.000738466 -3.51742 63.546000 Cu 0.698947 0.380215 1 726 63.546 0.000539508 -3.51707 63.546000 Cu 0.831093 0.371028 1.55521e-16 730 63.546 0.000109779 -3.51733 63.546000 Cu 0.783047 0.392069 3.96615e-17 727 63.546 0.000319193 -3.51758 63.546000 Cu 0.765059 0.375639 0.5 728 63.546 0.00017189 -3.51682 63.546000 Cu 0.849101 0.387455 0.5 733 63.546 0.000595393 -3.5179 63.546000 Cu 0.897216 0.366372 0.5 732 63.546 0.000292947 -3.51771 63.546000 Cu 0.915247 0.382755 3.95413e-17 731 63.546 0.000825473 -3.51794 63.546000 Cu 0.981592 0.377993 0.5 737 63.546 0.000254653 -3.51805 63.546000 Cu 0.0846217 0.405774 1 766 63.546 0.00132599 -3.51695 63.546000 Cu 0.0182293 0.410526 0.5 768 63.546 0.000561405 -3.5169 63.546000 Cu 0.102987 0.422065 0.5 798 63.546 0.00434889 -3.51468 63.546000 Cu 0.217013 0.396608 1 770 63.546 0.000648233 -3.51676 63.546000 Cu 0.150874 0.40114 0.5 772 63.546 0.0015934 -3.51591 63.546000 Cu 0.168896 0.417517 1 800 63.546 0.00351349 -3.51282 63.546000 Cu 0.234832 0.413056 0.5 802 63.546 0.000826314 -3.51714 63.546000 Cu 0.367108 0.403869 0.5 806 63.546 0.00166432 -3.5185 63.546000 Cu 0.300873 0.408552 1 804 63.546 0.00220447 -3.52029 63.546000 Cu 0.433429 0.399095 3.80991e-17 808 63.546 0.000808643 -3.51788 63.546000 Cu 0.499821 0.394278 0.5 810 63.546 0.000248182 -3.51783 63.546000 Cu 0.385277 0.420219 1 805 63.546 0.00302429 -3.51902 63.546000 Cu 0.451797 0.415381 0.5 811 63.546 0.000663339 -3.51774 63.546000 Cu 0.584622 0.405774 0.5 725 63.546 0.00132599 -3.51695 63.546000 Cu 0.602987 0.422065 1.20667e-16 753 63.546 0.00434889 -3.51468 63.546000 Cu 0.518229 0.410526 4.86755e-17 809 63.546 0.000561405 -3.5169 63.546000 Cu 0.650874 0.40114 6.77851e-17 723 63.546 0.0015934 -3.51591 63.546000 Cu 0.717013 0.396608 0.5 729 63.546 0.000648233 -3.51676 63.546000 Cu 0.668896 0.417517 0.5 755 63.546 0.00351349 -3.51282 63.546000 Cu 0.734832 0.413056 8.78562e-17 757 63.546 0.000826314 -3.51714 63.546000 Cu 0.867108 0.403869 1.23912e-16 761 63.546 0.00166432 -3.5185 63.546000 Cu 0.800873 0.408552 0.5 759 63.546 0.00220447 -3.52029 63.546000 Cu 0.999821 0.394278 3.96615e-17 765 63.546 0.000248182 -3.51783 63.546000 Cu 0.933429 0.399095 0.5 763 63.546 0.000808643 -3.51788 63.546000 Cu 0.951797 0.415381 1.21028e-16 762 63.546 0.000663339 -3.51774 63.546000 Cu 0.885277 0.420219 0.5 764 63.546 0.00302429 -3.51902 63.546000 Cu 0.0368936 0.426745 0 796 63.546 0.00251371 -3.51455 63.546000 Cu 0.0558523 0.443033 0.5 799 63.546 0.00892735 -3.50936 63.546000 Cu 0.121385 0.438413 1 797 63.546 0.0202865 -3.5069 63.546000 Cu 0.186717 0.43409 0.5 803 63.546 0.00619659 -3.51264 63.546000 Cu 0.204103 0.451053 1 828 63.546 0.0430886 -3.52417 63.546000 Cu 0.252065 0.429601 1 801 63.546 0.00774662 -3.51636 63.546000 Cu 0.318536 0.424988 0.5 807 63.546 0.00599072 -3.52264 63.546000 Cu 0.269127 0.446158 0.5 830 63.546 0.0276071 -3.50938 63.546000 Cu 0.335958 0.441177 3.24503e-17 832 63.546 0.0110971 -3.51263 63.546000 Cu 0.470453 0.431587 1 836 63.546 0.00195339 -3.51666 63.546000 Cu 0.403619 0.436493 0.5 834 63.546 0.0110842 -3.52366 63.546000 Cu 0.421645 0.452577 2.8364e-17 833 63.546 0.0182853 -3.52836 63.546000 Cu 0.489724 0.447692 0.5 838 63.546 0.0310034 -3.51819 63.546000 Cu 0.536894 0.426745 0.5 837 63.546 0.00251371 -3.51455 63.546000 Cu 0.555852 0.443033 2.55997e-17 752 63.546 0.00892735 -3.50936 63.546000 Cu 0.621385 0.438413 0.5 756 63.546 0.0202865 -3.5069 63.546000 Cu 0.686717 0.43409 1.21749e-16 754 63.546 0.00619659 -3.51264 63.546000 Cu 0.704103 0.451053 0.5 786 63.546 0.0430886 -3.52417 63.546000 Cu 0.818536 0.424988 3.95413e-17 758 63.546 0.00599072 -3.52264 63.546000 Cu 0.752065 0.429601 0.5 760 63.546 0.00774662 -3.51636 63.546000 Cu 0.769127 0.446158 1 788 63.546 0.0276071 -3.50938 63.546000 Cu 0.835958 0.441177 0.5 790 63.546 0.0110971 -3.51263 63.546000 Cu 0.970453 0.431587 0.5 794 63.546 0.00195339 -3.51666 63.546000 Cu 0.903619 0.436493 3.96615e-17 792 63.546 0.0110842 -3.52366 63.546000 Cu 0.989724 0.447692 0 793 63.546 0.0310034 -3.51819 63.546000 Cu 0.921645 0.452577 0.5 795 63.546 0.0182853 -3.52836 63.546000 Cu 0.00924895 0.46388 0.5 822 63.546 0.150358 -3.5352 63.546000 Cu 0.0757382 0.459475 1 824 63.546 0.102488 -3.49968 63.546000 Cu 0.0234667 0.480003 7.9323e-18 821 63.546 2.32799 -3.42962 63.546000 Cu 0.0962367 0.476453 0.5 827 63.546 0.858724 -3.46262 63.546000 Cu 0.139564 0.455098 0.5 826 63.546 0.0732108 -3.51344 63.546000 Cu 0.220988 0.467785 0.5 831 63.546 0.392214 -3.48033 63.546000 Cu 0.158635 0.473261 3.1609e-17 825 63.546 0.480564 -3.41248 63.546000 Cu 0.242248 0.48316 4.80745e-18 842 63.546 6.42743 -3.23321 63.546000 Cu 0.288248 0.462634 3.95413e-17 829 63.546 0.0318172 -3.52296 63.546000 Cu 0.352927 0.45719 0.5 835 63.546 0.111813 -3.49076 63.546000 Cu 0.307167 0.479661 0.5 844 63.546 1.87146 -3.42526 63.546000 Cu 0.372854 0.473818 7.95633e-17 845 63.546 0.292992 -3.45086 63.546000 Cu 0.437503 0.468139 0.5 847 63.546 0.492687 -3.46125 63.546000 Cu 0.45669 0.483112 1.21749e-16 846 63.546 7.21467 -3.21946 63.546000 Cu 0.575738 0.459475 0.5 783 63.546 0.102488 -3.49968 63.546000 Cu 0.509249 0.46388 3.95413e-17 849 63.546 0.150358 -3.5352 63.546000 Cu 0.596237 0.476453 1.17542e-16 782 63.546 0.858724 -3.46262 63.546000 Cu 0.523467 0.480003 0.5 850 63.546 2.32799 -3.42962 63.546000 Cu 0.639564 0.455098 6.8386e-17 784 63.546 0.0732108 -3.51344 63.546000 Cu 0.720988 0.467785 0 785 63.546 0.392214 -3.48033 63.546000 Cu 0.658635 0.473261 0.5 787 63.546 0.480564 -3.41248 63.546000 Cu 0.742248 0.48316 0.5 815 63.546 6.42743 -3.23321 63.546000 Cu 0.852927 0.45719 6.87466e-17 789 63.546 0.111813 -3.49076 63.546000 Cu 0.788248 0.462634 0.5 791 63.546 0.0318172 -3.52296 63.546000 Cu 0.807167 0.479661 1 816 63.546 1.87146 -3.42526 63.546000 Cu 0.872854 0.473818 0.5 818 63.546 0.292992 -3.45086 63.546000 Cu 0.937503 0.468139 1 820 63.546 0.492687 -3.46125 63.546000 Cu 0.95669 0.483112 0.5 823 63.546 7.21467 -3.21946 63.546000 Cu 0.108559 0.494233 1.79078e-17 840 63.546 4.55832 -3.49283 63.546000 Cu 0.0392592 0.493997 0.5 839 63.546 8.30549 -3.17437 63.546000 Cu 0.0186327 0.507489 1 10 63.546 2.91562 -3.4476 63.546000 Cu 0.0923459 0.511882 0.5 12 63.546 0.924898 -3.43445 63.546000 Cu 0.178108 0.494079 0.5 841 63.546 8.84487 -3.45476 63.546000 Cu 0.237325 0.504641 0 1 63.546 6.95051 -3.22197 63.546000 Cu 0.328762 0.493893 3.95413e-17 843 63.546 10.5836 -3.25841 63.546000 Cu 0.367141 0.514408 7.0309e-17 2 63.546 0.683682 -3.4194 63.546000 Cu 0.302447 0.507685 0.5 3 63.546 2.67208 -3.43637 63.546000 Cu 0.395443 0.493491 0.5 848 63.546 8.58609 -3.52927 63.546000 Cu 0.450865 0.504387 1 24 63.546 9.43531 -3.22173 63.546000 Cu 0.608559 0.494233 0.5 813 63.546 4.55832 -3.49283 63.546000 Cu 0.539259 0.493997 3.95413e-17 812 63.546 8.30549 -3.17437 63.546000 Cu 0.518633 0.507489 0.5 26 63.546 2.91562 -3.4476 63.546000 Cu 0.592346 0.511882 1.09249e-16 27 63.546 0.924898 -3.43445 63.546000 Cu 0.678108 0.494079 3.96615e-17 814 63.546 8.84487 -3.45476 63.546000 Cu 0.737325 0.504641 0.5 6 63.546 6.95051 -3.22197 63.546000 Cu 0.828762 0.493893 0.5 819 63.546 10.5836 -3.25841 63.546000 Cu 0.802447 0.507685 6.00932e-17 5 63.546 2.67208 -3.43637 63.546000 Cu 0.867141 0.514408 0.5 9 63.546 0.683682 -3.4194 63.546000 Cu 0.895443 0.493491 3.60559e-19 817 63.546 8.58609 -3.52927 63.546000 Cu 0.950865 0.504387 0.5 8 63.546 9.43531 -3.22173 63.546000 Cu 0.0691906 0.528539 1.33527e-16 11 63.546 0.0602861 -3.4977 63.546000 Cu 0.00322354 0.523751 0.5 13 63.546 0.152547 -3.5369 63.546000 Cu 0.0482272 0.544842 0.5 41 63.546 0.00249816 -3.51197 63.546000 Cu 0.154183 0.515617 1 14 63.546 0.442187 -3.40616 63.546000 Cu 0.21641 0.520216 0.5 16 63.546 0.356126 -3.49268 63.546000 Cu 0.133681 0.533156 0.5 17 63.546 0.0701589 -3.51962 63.546000 Cu 0.198445 0.537278 4.80745e-19 15 63.546 0.0155334 -3.52041 63.546000 Cu 0.282486 0.525222 1 18 63.546 0.0559029 -3.51942 63.546000 Cu 0.346639 0.530793 0.5 20 63.546 0.155731 -3.50392 63.546000 Cu 0.262608 0.541969 0.5 21 63.546 0.0290981 -3.5078 63.546000 Cu 0.432455 0.519502 0.5 4 63.546 0.523105 -3.46691 63.546000 Cu 0.415265 0.535274 3.95413e-17 22 63.546 0.0195408 -3.52928 63.546000 Cu 0.482409 0.540092 0.5 56 63.546 0.0181211 -3.51607 63.546000 Cu 0.503224 0.523751 2.40373e-19 25 63.546 0.152547 -3.5369 63.546000 Cu 0.569191 0.528539 0.5 30 63.546 0.0602861 -3.4977 63.546000 Cu 0.548227 0.544842 1 57 63.546 0.00249816 -3.51197 63.546000 Cu 0.654183 0.515617 0.5 29 63.546 0.442187 -3.40616 63.546000 Cu 0.71641 0.520216 1.40858e-16 31 63.546 0.356126 -3.49268 63.546000 Cu 0.633681 0.533156 1.3533e-16 28 63.546 0.0701589 -3.51962 63.546000 Cu 0.698445 0.537278 0.5 34 63.546 0.0155334 -3.52041 63.546000 Cu 0.782486 0.525222 0.5 33 63.546 0.0559029 -3.51942 63.546000 Cu 0.846639 0.530793 2.16335e-18 35 63.546 0.155731 -3.50392 63.546000 Cu 0.762608 0.541969 9.43463e-17 32 63.546 0.0290981 -3.5078 63.546000 Cu 0.932455 0.519502 8.88177e-17 7 63.546 0.523105 -3.46691 63.546000 Cu 0.915265 0.535274 0.5 37 63.546 0.0195408 -3.52928 63.546000 Cu 0.982409 0.540092 4.65121e-17 39 63.546 0.0181211 -3.51607 63.546000 Cu 0.028198 0.561147 3.96615e-17 40 63.546 0.00048971 -3.5164 63.546000 Cu 0.113895 0.549598 1 43 63.546 0.0108697 -3.50996 63.546000 Cu 0.0941215 0.565901 0.5 46 63.546 0.00142017 -3.51677 63.546000 Cu 0.179292 0.554118 0.5 45 63.546 0.00811812 -3.51071 63.546000 Cu 0.244568 0.5586 9.02599e-17 47 63.546 0.00316862 -3.51545 63.546000 Cu 0.159994 0.570561 1.33166e-16 44 63.546 0.00262764 -3.51396 63.546000 Cu 0.225822 0.575102 0.5 50 63.546 0.00144036 -3.51669 63.546000 Cu 0.328971 0.54677 1 19 63.546 0.0117064 -3.51954 63.546000 Cu 0.310456 0.563112 0.5 49 63.546 0.00504498 -3.52411 63.546000 Cu 0.395952 0.551487 0.5 23 63.546 0.0106775 -3.52271 63.546000 Cu 0.462204 0.556325 1 55 63.546 0.000844763 -3.51581 63.546000 Cu 0.376444 0.567838 3.95413e-17 51 63.546 0.00233239 -3.51944 63.546000 Cu 0.442403 0.572623 0.5 53 63.546 0.000788089 -3.51805 63.546000 Cu 0.613895 0.549598 0.5 59 63.546 0.0108697 -3.50996 63.546000 Cu 0.528198 0.561147 0.5 60 63.546 0.00048971 -3.5164 63.546000 Cu 0.594121 0.565901 1 58 63.546 0.00142017 -3.51677 63.546000 Cu 0.679292 0.554118 3.87e-17 61 63.546 0.00811812 -3.51071 63.546000 Cu 0.744568 0.5586 0.5 63 63.546 0.00316862 -3.51545 63.546000 Cu 0.725822 0.575102 3.95413e-17 62 63.546 0.00144036 -3.51669 63.546000 Cu 0.659994 0.570561 0.5 64 63.546 0.00262764 -3.51396 63.546000 Cu 0.828971 0.54677 0.5 38 63.546 0.0117064 -3.51954 63.546000 Cu 0.810456 0.563112 5.20407e-17 65 63.546 0.00504498 -3.52411 63.546000 Cu 0.895952 0.551487 1 36 63.546 0.0106775 -3.52271 63.546000 Cu 0.962204 0.556325 0.5 42 63.546 0.000844763 -3.51581 63.546000 Cu 0.876444 0.567838 0.5 67 63.546 0.00233239 -3.51944 63.546000 Cu 0.942403 0.572623 8.28084e-17 69 63.546 0.000788089 -3.51805 63.546000 Cu 0.00845048 0.577428 0.5 71 63.546 0.000225649 -3.5174 63.546000 Cu 0.0745068 0.582182 1.68261e-18 73 63.546 0.000139846 -3.51755 63.546000 Cu 0.120962 0.603206 5.57665e-17 74 63.546 0.00012849 -3.51791 63.546000 Cu 0.0549467 0.59848 0.5 76 63.546 5.27721e-05 -3.5181 63.546000 Cu 0.140551 0.586891 0.5 75 63.546 0.000709498 -3.51717 63.546000 Cu 0.206477 0.591525 4.1945e-17 77 63.546 0.000906988 -3.51695 63.546000 Cu 0.291483 0.579639 1 48 63.546 0.000611173 -3.51882 63.546000 Cu 0.357147 0.584263 0.5 54 63.546 0.000886231 -3.51869 63.546000 Cu 0.272228 0.596118 0.5 79 63.546 0.000325812 -3.51685 63.546000 Cu 0.337913 0.600731 1 81 63.546 0.00012219 -3.51787 63.546000 Cu 0.422963 0.588977 8.47314e-17 52 63.546 0.000767412 -3.51844 63.546000 Cu 0.488899 0.593731 0.5 88 63.546 0.000342991 -3.51827 63.546000 Cu 0.403649 0.60539 0.5 83 63.546 0.000259518 -3.51835 63.546000 Cu 0.50845 0.577428 3.96615e-17 85 63.546 0.000225649 -3.5174 63.546000 Cu 0.574507 0.582182 0.5 87 63.546 0.000139846 -3.51755 63.546000 Cu 0.554947 0.59848 1.95663e-16 86 63.546 5.27721e-05 -3.5181 63.546000 Cu 0.620962 0.603206 0.5 92 63.546 0.00012849 -3.51791 63.546000 Cu 0.640551 0.586891 3.95413e-17 89 63.546 0.000709498 -3.51717 63.546000 Cu 0.706477 0.591525 0.5 91 63.546 0.000906988 -3.51695 63.546000 Cu 0.857147 0.584263 4.12239e-17 66 63.546 0.000886231 -3.51869 63.546000 Cu 0.791483 0.579639 0.5 68 63.546 0.000611173 -3.51882 63.546000 Cu 0.772228 0.596118 1.08047e-16 93 63.546 0.000325812 -3.51685 63.546000 Cu 0.837913 0.600731 0.5 95 63.546 0.00012219 -3.51787 63.546000 Cu 0.988899 0.593731 6.93475e-17 70 63.546 0.000342991 -3.51827 63.546000 Cu 0.922963 0.588977 0.5 72 63.546 0.000767412 -3.51844 63.546000 Cu 0.903649 0.60539 5.70885e-17 97 63.546 0.000259518 -3.51835 63.546000 Cu 0.0354076 0.614808 1.32926e-16 101 63.546 0.00014477 -3.51826 63.546000 Cu 0.101367 0.619522 0.5 103 63.546 7.32071e-05 -3.518 63.546000 Cu 0.0818994 0.635865 1 102 63.546 0.00010358 -3.51804 63.546000 Cu 0.0159726 0.631169 0.5 104 63.546 0.000133337 -3.51824 63.546000 Cu 0.186954 0.607884 0.5 80 63.546 0.000311431 -3.51741 63.546000 Cu 0.167371 0.624231 2.03115e-17 105 63.546 8.36261e-05 -3.51778 63.546000 Cu 0.233298 0.628909 0.5 107 63.546 0.000111175 -3.51728 63.546000 Cu 0.252816 0.612537 1 78 63.546 0.000327826 -3.51699 63.546000 Cu 0.318569 0.617171 0.5 84 63.546 9.32578e-05 -3.51733 63.546000 Cu 0.299138 0.633576 1.06966e-17 109 63.546 0.000100178 -3.51734 63.546000 Cu 0.38429 0.621817 3.96615e-17 82 63.546 3.94416e-05 -3.51793 63.546000 Cu 0.469456 0.610091 1 115 63.546 0.000305894 -3.51864 63.546000 Cu 0.450077 0.626485 0.5 118 63.546 0.000130838 -3.51835 63.546000 Cu 0.535408 0.614808 0.5 117 63.546 0.00014477 -3.51826 63.546000 Cu 0.601367 0.619522 1 119 63.546 7.32071e-05 -3.518 63.546000 Cu 0.515973 0.631169 1 116 63.546 0.000133337 -3.51824 63.546000 Cu 0.581899 0.635865 0.5 122 63.546 0.00010358 -3.51804 63.546000 Cu 0.686954 0.607884 5.4805e-17 90 63.546 0.000311431 -3.51741 63.546000 Cu 0.667371 0.624231 0.5 121 63.546 8.36261e-05 -3.51778 63.546000 Cu 0.733298 0.628909 3.95413e-17 123 63.546 0.000111175 -3.51728 63.546000 Cu 0.752816 0.612537 0.5 96 63.546 0.000327826 -3.51699 63.546000 Cu 0.818569 0.617171 1.804e-16 94 63.546 9.32578e-05 -3.51733 63.546000 Cu 0.799138 0.633576 0.5 125 63.546 0.000100178 -3.51734 63.546000 Cu 0.969456 0.610091 0.5 99 63.546 0.000305894 -3.51864 63.546000 Cu 0.88429 0.621817 0.5 100 63.546 3.94416e-05 -3.51793 63.546000 Cu 0.950077 0.626485 1.76674e-17 98 63.546 0.000130838 -3.51835 63.546000 Cu 0.0624984 0.652237 0.5 133 63.546 0.000107467 -3.51799 63.546000 Cu 0.213797 0.645272 1 106 63.546 3.63461e-05 -3.51765 63.546000 Cu 0.147867 0.640569 0.5 108 63.546 1.7801e-05 -3.51791 63.546000 Cu 0.128383 0.656927 1.20186e-19 135 63.546 0.000103634 -3.51807 63.546000 Cu 0.194341 0.661631 0.5 137 63.546 1.49181e-05 -3.51787 63.546000 Cu 0.345603 0.654624 1.26676e-16 110 63.546 5.10915e-05 -3.51764 63.546000 Cu 0.364953 0.638236 0.5 111 63.546 5.76619e-05 -3.51768 63.546000 Cu 0.2797 0.649957 0.5 112 63.546 5.14267e-05 -3.51751 63.546000 Cu 0.260261 0.666322 3.95413e-17 139 63.546 2.20054e-05 -3.51754 63.546000 Cu 0.43076 0.642893 3.72578e-17 113 63.546 2.12899e-05 -3.51806 63.546000 Cu 0.496608 0.647565 0.5 147 63.546 4.88348e-05 -3.51822 63.546000 Cu 0.411483 0.659295 0.5 114 63.546 4.54832e-05 -3.51798 63.546000 Cu 0.477344 0.663969 3.95413e-17 146 63.546 1.75645e-05 -3.51807 63.546000 Cu 0.562498 0.652237 3.60559e-19 148 63.546 0.000107467 -3.51799 63.546000 Cu 0.647867 0.640569 0 120 63.546 1.7801e-05 -3.51791 63.546000 Cu 0.713797 0.645272 0.5 126 63.546 3.63461e-05 -3.51765 63.546000 Cu 0.628383 0.656927 0.5 150 63.546 0.000103634 -3.51807 63.546000 Cu 0.694341 0.661631 2.40373e-19 152 63.546 1.49181e-05 -3.51787 63.546000 Cu 0.7797 0.649957 9.85528e-18 124 63.546 5.14267e-05 -3.51751 63.546000 Cu 0.864953 0.638236 6.93475e-17 127 63.546 5.76619e-05 -3.51768 63.546000 Cu 0.845603 0.654624 0.5 130 63.546 5.10915e-05 -3.51764 63.546000 Cu 0.760261 0.666322 0.5 154 63.546 2.20054e-05 -3.51754 63.546000 Cu 0.93076 0.642893 0.5 129 63.546 2.12899e-05 -3.51806 63.546000 Cu 0.996608 0.647565 0 131 63.546 4.88348e-05 -3.51822 63.546000 Cu 0.911483 0.659295 1 128 63.546 4.54832e-05 -3.51798 63.546000 Cu 0.977344 0.663969 0.5 134 63.546 1.75645e-05 -3.51807 63.546000 Cu 0.0431614 0.668635 1 132 63.546 3.06851e-05 -3.51801 63.546000 Cu 0.109018 0.673306 0.5 138 63.546 0.000126653 -3.51815 63.546000 Cu 0.0239151 0.685039 0.5 162 63.546 4.99438e-05 -3.51795 63.546000 Cu 0.0897869 0.689706 3.95413e-17 164 63.546 4.18222e-06 -3.51812 63.546000 Cu 0.174938 0.677993 3.96615e-17 136 63.546 7.6212e-05 -3.518 63.546000 Cu 0.240859 0.68268 0.5 142 63.546 4.24268e-05 -3.5177 63.546000 Cu 0.155668 0.694376 0.5 166 63.546 2.64332e-05 -3.5181 63.546000 Cu 0.306794 0.68736 1 140 63.546 2.83267e-05 -3.51773 63.546000 Cu 0.326196 0.670995 0.5 141 63.546 1.00229e-05 -3.51774 63.546000 Cu 0.372748 0.692042 0.5 145 63.546 1.61467e-05 -3.51773 63.546000 Cu 0.392137 0.675677 2.28354e-17 143 63.546 3.20229e-05 -3.51786 63.546000 Cu 0.458038 0.680364 0.5 176 63.546 7.32143e-05 -3.51792 63.546000 Cu 0.438683 0.696732 3.60559e-18 144 63.546 1.82305e-05 -3.51772 63.546000 Cu 0.609018 0.673306 1 149 63.546 0.000126653 -3.51815 63.546000 Cu 0.543161 0.668635 0.5 151 63.546 3.06851e-05 -3.51801 63.546000 Cu 0.523915 0.685039 3.70174e-17 177 63.546 4.99438e-05 -3.51795 63.546000 Cu 0.589787 0.689706 0.5 179 63.546 4.18222e-06 -3.51812 63.546000 Cu 0.740859 0.68268 1 153 63.546 4.24268e-05 -3.5177 63.546000 Cu 0.674938 0.677993 0.5 155 63.546 7.6212e-05 -3.518 63.546000 Cu 0.655668 0.694376 0 181 63.546 2.64332e-05 -3.5181 63.546000 Cu 0.826196 0.670995 1 156 63.546 1.00229e-05 -3.51774 63.546000 Cu 0.806794 0.68736 0.5 159 63.546 2.83267e-05 -3.51773 63.546000 Cu 0.872748 0.692042 1 157 63.546 1.61467e-05 -3.51773 63.546000 Cu 0.892137 0.675677 0.5 158 63.546 3.20229e-05 -3.51786 63.546000 Cu 0.958038 0.680364 1.50233e-17 160 63.546 7.32143e-05 -3.51792 63.546000 Cu 0.938683 0.696732 0.5 163 63.546 1.82305e-05 -3.51772 63.546000 Cu 0.00463405 0.701422 2.63208e-17 161 63.546 4.75343e-05 -3.51777 63.546000 Cu 0.0705605 0.706099 0.5 167 63.546 3.8481e-05 -3.51786 63.546000 Cu 0.0512987 0.722474 2.6441e-18 193 63.546 1.73701e-05 -3.51772 63.546000 Cu 0.117235 0.727155 0.5 195 63.546 3.21156e-05 -3.51775 63.546000 Cu 0.136472 0.71077 3.95413e-17 165 63.546 1.45503e-05 -3.518 63.546000 Cu 0.221553 0.699051 6.49006e-17 168 63.546 5.56604e-05 -3.51791 63.546000 Cu 0.202354 0.71544 0.5 171 63.546 1.31923e-06 -3.51803 63.546000 Cu 0.287482 0.703728 0.5 170 63.546 3.74741e-05 -3.51776 63.546000 Cu 0.353433 0.708405 1.17422e-16 172 63.546 2.21074e-05 -3.51771 63.546000 Cu 0.26825 0.720108 0 169 63.546 1.74644e-05 -3.518 63.546000 Cu 0.334175 0.724777 0.5 175 63.546 3.67007e-05 -3.51788 63.546000 Cu 0.419385 0.713092 0.5 174 63.546 8.10977e-06 -3.51773 63.546000 Cu 0.48533 0.717786 0 206 63.546 6.73039e-06 -3.51777 63.546000 Cu 0.570561 0.706099 1 178 63.546 3.8481e-05 -3.51786 63.546000 Cu 0.504634 0.701422 0.5 180 63.546 4.75343e-05 -3.51777 63.546000 Cu 0.551299 0.722474 0.5 208 63.546 1.73701e-05 -3.51772 63.546000 Cu 0.617235 0.727155 1 210 63.546 3.21156e-05 -3.51775 63.546000 Cu 0.702354 0.71544 1.49632e-16 182 63.546 1.31923e-06 -3.51803 63.546000 Cu 0.721553 0.699051 0.5 183 63.546 5.56604e-05 -3.51791 63.546000 Cu 0.636472 0.71077 0.5 184 63.546 1.45503e-05 -3.518 63.546000 Cu 0.787482 0.703728 4.05028e-17 185 63.546 3.74741e-05 -3.51776 63.546000 Cu 0.853433 0.708405 0.5 187 63.546 2.21074e-05 -3.51771 63.546000 Cu 0.834175 0.724777 1 186 63.546 3.67007e-05 -3.51788 63.546000 Cu 0.76825 0.720108 0.5 188 63.546 1.74644e-05 -3.518 63.546000 Cu 0.919385 0.713092 0 189 63.546 8.10977e-06 -3.51773 63.546000 Cu 0.98533 0.717786 0.5 191 63.546 6.73039e-06 -3.51777 63.546000 Cu 0.097935 0.743524 1 194 63.546 3.71154e-06 -3.51767 63.546000 Cu 0.0320146 0.738841 0.5 196 63.546 1.2177e-05 -3.51784 63.546000 Cu 0.012701 0.755214 1.12735e-16 222 63.546 8.99804e-06 -3.51793 63.546000 Cu 0.183139 0.731833 0 197 63.546 3.74363e-05 -3.51798 63.546000 Cu 0.249028 0.736505 0.5 199 63.546 1.71528e-05 -3.51812 63.546000 Cu 0.163845 0.748208 0.5 200 63.546 1.03919e-05 -3.51782 63.546000 Cu 0.22977 0.752892 3.60559e-19 198 63.546 5.23392e-05 -3.5179 63.546000 Cu 0.31493 0.741168 8.08854e-17 201 63.546 4.52515e-06 -3.51803 63.546000 Cu 0.295676 0.757561 0.5 204 63.546 2.38182e-05 -3.51784 63.546000 Cu 0.400112 0.729457 1.4182e-16 173 63.546 2.85011e-05 -3.5179 63.546000 Cu 0.380834 0.745835 0.5 203 63.546 3.84416e-05 -3.51804 63.546000 Cu 0.466062 0.734149 0.5 209 63.546 5.88884e-06 -3.51799 63.546000 Cu 0.446769 0.750523 3.95413e-17 236 63.546 8.47668e-06 -3.51816 63.546000 Cu 0.532015 0.738841 0 207 63.546 1.2177e-05 -3.51784 63.546000 Cu 0.597935 0.743524 0.5 213 63.546 3.71154e-06 -3.51767 63.546000 Cu 0.512701 0.755214 0.5 238 63.546 8.99804e-06 -3.51793 63.546000 Cu 0.663845 0.748208 3.60559e-19 211 63.546 1.03919e-05 -3.51782 63.546000 Cu 0.683139 0.731833 0.5 212 63.546 3.74363e-05 -3.51798 63.546000 Cu 0.749028 0.736505 4.91562e-17 214 63.546 1.71528e-05 -3.51812 63.546000 Cu 0.72977 0.752892 0.5 217 63.546 5.23392e-05 -3.5179 63.546000 Cu 0.81493 0.741168 0.5 216 63.546 4.52515e-06 -3.51803 63.546000 Cu 0.795676 0.757561 1.20186e-19 215 63.546 2.38182e-05 -3.51784 63.546000 Cu 0.966062 0.734149 5.64876e-18 190 63.546 5.88884e-06 -3.51799 63.546000 Cu 0.900112 0.729457 0.5 192 63.546 2.85011e-05 -3.5179 63.546000 Cu 0.880834 0.745835 1 218 63.546 3.84416e-05 -3.51804 63.546000 Cu 0.946769 0.750523 0.5 220 63.546 8.47668e-06 -3.51816 63.546000 Cu 0.0592903 0.776264 1.98307e-17 223 63.546 4.70468e-06 -3.51779 63.546000 Cu 0.0786072 0.759892 0.5 224 63.546 2.16066e-06 -3.51772 63.546000 Cu 0.144521 0.764571 2.40373e-19 226 63.546 5.78242e-06 -3.51779 63.546000 Cu 0.210452 0.769258 0.5 228 63.546 3.98331e-06 -3.5178 63.546000 Cu 0.125206 0.78094 0.5 229 63.546 1.52845e-05 -3.51787 63.546000 Cu 0.191124 0.785624 3.96615e-17 227 63.546 7.25026e-06 -3.51791 63.546000 Cu 0.361568 0.762224 3.95413e-17 202 63.546 8.17269e-06 -3.51796 63.546000 Cu 0.276377 0.773939 0 230 63.546 1.85704e-05 -3.5177 63.546000 Cu 0.342283 0.77861 0.5 232 63.546 7.87765e-06 -3.51782 63.546000 Cu 0.427466 0.766902 0.5 205 63.546 9.5179e-06 -3.5181 63.546000 Cu 0.493384 0.771587 3.96615e-17 237 63.546 4.34164e-06 -3.51795 63.546000 Cu 0.408187 0.783285 2.40373e-19 234 63.546 2.4308e-06 -3.51805 63.546000 Cu 0.578607 0.759892 3.96615e-17 239 63.546 2.16066e-06 -3.51772 63.546000 Cu 0.55929 0.776264 0.5 242 63.546 4.70468e-06 -3.51779 63.546000 Cu 0.625206 0.78094 0 240 63.546 1.52845e-05 -3.51787 63.546000 Cu 0.644521 0.764571 0.5 241 63.546 5.78242e-06 -3.51779 63.546000 Cu 0.710452 0.769258 1 243 63.546 3.98331e-06 -3.5178 63.546000 Cu 0.691124 0.785624 0.5 246 63.546 7.25026e-06 -3.51791 63.546000 Cu 0.861568 0.762224 0.5 221 63.546 8.17269e-06 -3.51796 63.546000 Cu 0.776377 0.773939 0.5 245 63.546 1.85704e-05 -3.5177 63.546000 Cu 0.842283 0.77861 1 247 63.546 7.87765e-06 -3.51782 63.546000 Cu 0.927466 0.766902 3.96615e-17 219 63.546 9.5179e-06 -3.5181 63.546000 Cu 0.993384 0.771587 0.5 225 63.546 4.34164e-06 -3.51795 63.546000 Cu 0.908187 0.783285 0.5 249 63.546 2.4308e-06 -3.51805 63.546000 Cu 0.0206998 0.809031 3.96615e-17 252 63.546 1.75353e-05 -3.51796 63.546000 Cu 0.0399947 0.792645 0.5 253 63.546 1.93919e-06 -3.51795 63.546000 Cu 0.105901 0.797321 3.96615e-17 255 63.546 6.69132e-06 -3.51797 63.546000 Cu 0.086597 0.813711 0.5 258 63.546 1.15559e-05 -3.51795 63.546000 Cu 0.171822 0.802003 0.5 257 63.546 9.03308e-06 -3.51792 63.546000 Cu 0.237713 0.806682 6.92273e-17 259 63.546 6.47726e-06 -3.51771 63.546000 Cu 0.32296 0.794987 1.38214e-17 231 63.546 2.41313e-06 -3.51774 63.546000 Cu 0.257046 0.79031 0.5 233 63.546 2.92778e-06 -3.51775 63.546000 Cu 0.303624 0.811356 0.5 261 63.546 6.00798e-06 -3.51763 63.546000 Cu 0.369547 0.816032 3.95413e-17 263 63.546 2.15807e-05 -3.51759 63.546000 Cu 0.388888 0.799666 0.5 235 63.546 1.31542e-05 -3.51788 63.546000 Cu 0.454795 0.804349 1 267 63.546 1.78443e-05 -3.51793 63.546000 Cu 0.474089 0.787966 0.5 268 63.546 7.14021e-07 -3.51808 63.546000 Cu 0.539995 0.792645 3.60559e-19 269 63.546 1.93919e-06 -3.51795 63.546000 Cu 0.605901 0.797321 0.5 271 63.546 6.69132e-06 -3.51797 63.546000 Cu 0.5207 0.809031 0.5 272 63.546 1.75353e-05 -3.51796 63.546000 Cu 0.586597 0.813711 1 270 63.546 1.15559e-05 -3.51795 63.546000 Cu 0.671822 0.802003 1 273 63.546 9.03308e-06 -3.51792 63.546000 Cu 0.737713 0.806682 0.5 275 63.546 6.47726e-06 -3.51771 63.546000 Cu 0.757046 0.79031 0 244 63.546 2.92778e-06 -3.51775 63.546000 Cu 0.82296 0.794987 0.5 250 63.546 2.41313e-06 -3.51774 63.546000 Cu 0.803624 0.811356 4.49497e-17 277 63.546 6.00798e-06 -3.51763 63.546000 Cu 0.869547 0.816032 0.5 279 63.546 2.15807e-05 -3.51759 63.546000 Cu 0.888888 0.799666 1.14177e-17 248 63.546 1.31542e-05 -3.51788 63.546000 Cu 0.974089 0.787966 6.17758e-17 251 63.546 7.14021e-07 -3.51808 63.546000 Cu 0.954795 0.804349 0.5 254 63.546 1.78443e-05 -3.51793 63.546000 Cu 0.0013487 0.825409 0.5 283 63.546 3.25391e-05 -3.51795 63.546000 Cu 0.0672437 0.830096 0 285 63.546 3.43204e-05 -3.51786 63.546000 Cu 0.0478142 0.846472 0.5 288 63.546 4.98712e-05 -3.51801 63.546000 Cu 0.152491 0.818386 3.95413e-17 256 63.546 1.25673e-05 -3.51784 63.546000 Cu 0.218372 0.823058 0.5 262 63.546 1.86846e-05 -3.51769 63.546000 Cu 0.133112 0.834771 0.5 287 63.546 2.18817e-05 -3.51782 63.546000 Cu 0.198979 0.839444 1 289 63.546 4.98324e-05 -3.51778 63.546000 Cu 0.28426 0.827726 3.38925e-17 260 63.546 4.61103e-05 -3.51766 63.546000 Cu 0.350145 0.832396 0.5 266 63.546 6.86525e-05 -3.5176 63.546000 Cu 0.264798 0.844113 0.5 291 63.546 3.04617e-05 -3.51767 63.546000 Cu 0.416005 0.83708 3.95413e-17 264 63.546 2.4775e-05 -3.51781 63.546000 Cu 0.435451 0.820717 0.5 265 63.546 2.70466e-05 -3.51773 63.546000 Cu 0.481912 0.841779 0.5 300 63.546 2.07009e-05 -3.51797 63.546000 Cu 0.501349 0.825409 1 297 63.546 3.25391e-05 -3.51795 63.546000 Cu 0.567244 0.830096 0.5 299 63.546 3.43204e-05 -3.51786 63.546000 Cu 0.547814 0.846472 3.95413e-17 298 63.546 4.98712e-05 -3.51801 63.546000 Cu 0.718372 0.823058 9.06205e-17 274 63.546 1.86846e-05 -3.51769 63.546000 Cu 0.652491 0.818386 0.5 276 63.546 1.25673e-05 -3.51784 63.546000 Cu 0.633112 0.834771 1.1634e-16 301 63.546 2.18817e-05 -3.51782 63.546000 Cu 0.698979 0.839444 0.5 303 63.546 4.98324e-05 -3.51778 63.546000 Cu 0.850145 0.832396 1 278 63.546 6.86525e-05 -3.5176 63.546000 Cu 0.78426 0.827726 0.5 280 63.546 4.61103e-05 -3.51766 63.546000 Cu 0.764798 0.844113 3.68972e-17 305 63.546 3.04617e-05 -3.51767 63.546000 Cu 0.935451 0.820717 1.20186e-19 281 63.546 2.70466e-05 -3.51773 63.546000 Cu 0.981912 0.841779 1.20186e-19 282 63.546 2.07009e-05 -3.51797 63.546000 Cu 0.916005 0.83708 0.5 284 63.546 2.4775e-05 -3.51781 63.546000 Cu 0.113686 0.851162 1 286 63.546 6.3751e-05 -3.51803 63.546000 Cu 0.0282994 0.862848 0 313 63.546 8.31205e-05 -3.51817 63.546000 Cu 0.094156 0.867557 0.5 315 63.546 9.60154e-05 -3.51822 63.546000 Cu 0.245269 0.860514 1.86289e-17 290 63.546 2.23101e-05 -3.51747 63.546000 Cu 0.179487 0.855844 0.5 292 63.546 1.76421e-05 -3.51787 63.546000 Cu 0.159974 0.872252 4.80745e-19 317 63.546 7.15295e-05 -3.51821 63.546000 Cu 0.225763 0.876927 0.5 319 63.546 0.000105782 -3.51775 63.546000 Cu 0.33064 0.848777 3.96615e-17 293 63.546 3.97894e-05 -3.5176 63.546000 Cu 0.311073 0.865169 0.5 296 63.546 6.57144e-05 -3.51708 63.546000 Cu 0.376902 0.86982 8.04046e-17 294 63.546 0.000173129 -3.5171 63.546000 Cu 0.396498 0.853449 0.5 295 63.546 5.81804e-05 -3.51761 63.546000 Cu 0.4624 0.85814 3.95413e-17 327 63.546 6.16073e-05 -3.51792 63.546000 Cu 0.442737 0.874503 0.5 330 63.546 0.00010634 -3.51767 63.546000 Cu 0.613686 0.851162 0.5 304 63.546 6.3751e-05 -3.51803 63.546000 Cu 0.528299 0.862848 0.5 329 63.546 8.31205e-05 -3.51817 63.546000 Cu 0.594156 0.867557 5.81702e-17 331 63.546 9.60154e-05 -3.51822 63.546000 Cu 0.679487 0.855844 4.98773e-17 302 63.546 1.76421e-05 -3.51787 63.546000 Cu 0.745269 0.860514 0.5 308 63.546 2.23101e-05 -3.51747 63.546000 Cu 0.659974 0.872252 0.5 333 63.546 7.15295e-05 -3.51821 63.546000 Cu 0.725763 0.876927 1.52997e-16 335 63.546 0.000105782 -3.51775 63.546000 Cu 0.811073 0.865169 2.23547e-17 306 63.546 6.57144e-05 -3.51708 63.546000 Cu 0.83064 0.848777 0.5 307 63.546 3.97894e-05 -3.5176 63.546000 Cu 0.896498 0.853449 7.06696e-17 309 63.546 5.81804e-05 -3.51761 63.546000 Cu 0.942737 0.874503 8.47314e-17 310 63.546 0.00010634 -3.51767 63.546000 Cu 0.9624 0.85814 0.5 311 63.546 6.16073e-05 -3.51792 63.546000 Cu 0.876902 0.86982 0.5 312 63.546 0.000173129 -3.5171 63.546000 Cu 0.0745448 0.88393 2.69217e-17 314 63.546 0.000155278 -3.51823 63.546000 Cu 0.00864021 0.87921 0.5 316 63.546 8.77376e-05 -3.51804 63.546000 Cu 0.0547979 0.900271 0.5 345 63.546 0.000130692 -3.51801 63.546000 Cu 0.120702 0.905026 1.20186e-19 347 63.546 0.000299276 -3.51811 63.546000 Cu 0.206205 0.893365 1.18984e-17 318 63.546 0.000399021 -3.51837 63.546000 Cu 0.14044 0.888654 0.5 320 63.546 0.000352178 -3.51853 63.546000 Cu 0.291457 0.881574 4.1945e-17 321 63.546 0.000158767 -3.51695 63.546000 Cu 0.337373 0.902645 5.16801e-17 322 63.546 0.000419415 -3.51671 63.546000 Cu 0.357143 0.886211 0.5 323 63.546 0.000259458 -3.51667 63.546000 Cu 0.271795 0.898031 0.5 324 63.546 0.000147268 -3.51774 63.546000 Cu 0.422913 0.890865 3.96615e-17 325 63.546 0.000267662 -3.51713 63.546000 Cu 0.488824 0.895548 0.5 359 63.546 0.000109629 -3.51791 63.546000 Cu 0.403063 0.907239 0.5 326 63.546 0.00101712 -3.51686 63.546000 Cu 0.50864 0.87921 3.95413e-17 328 63.546 8.77376e-05 -3.51804 63.546000 Cu 0.574545 0.88393 0.5 334 63.546 0.000155278 -3.51823 63.546000 Cu 0.554798 0.900271 9.05003e-17 360 63.546 0.000130692 -3.51801 63.546000 Cu 0.620702 0.905026 0.5 362 63.546 0.000299276 -3.51811 63.546000 Cu 0.64044 0.888654 3.37724e-17 332 63.546 0.000352178 -3.51853 63.546000 Cu 0.706205 0.893365 0.5 338 63.546 0.000399021 -3.51837 63.546000 Cu 0.771795 0.898031 2.16335e-17 336 63.546 0.000147268 -3.51774 63.546000 Cu 0.791457 0.881574 0.5 337 63.546 0.000158767 -3.51695 63.546000 Cu 0.857143 0.886211 1 339 63.546 0.000259458 -3.51667 63.546000 Cu 0.837373 0.902645 0.5 342 63.546 0.000419415 -3.51671 63.546000 Cu 0.922913 0.890865 0.5 341 63.546 0.000267662 -3.51713 63.546000 Cu 0.988824 0.895548 8.94186e-17 343 63.546 0.000109629 -3.51791 63.546000 Cu 0.903063 0.907239 1.25234e-16 340 63.546 0.00101712 -3.51686 63.546000 Cu 0.0349102 0.916584 3.96615e-17 344 63.546 0.000231075 -3.51757 63.546000 Cu 0.100803 0.921357 0.5 350 63.546 9.37119e-05 -3.51716 63.546000 Cu 0.0149952 0.932898 0.5 374 63.546 0.00115645 -3.5167 63.546000 Cu 0.0807744 0.937668 5.21609e-17 376 63.546 0.000221334 -3.5162 63.546000 Cu 0.166704 0.926164 4.80745e-19 348 63.546 0.000529157 -3.51782 63.546000 Cu 0.186517 0.909787 0.5 349 63.546 0.000630568 -3.51863 63.546000 Cu 0.232621 0.930953 0.5 354 63.546 0.00250805 -3.51941 63.546000 Cu 0.252226 0.914518 0 351 63.546 0.00109238 -3.51865 63.546000 Cu 0.298585 0.935685 1 352 63.546 0.00554347 -3.52399 63.546000 Cu 0.317798 0.919147 0.5 353 63.546 0.000883254 -3.51859 63.546000 Cu 0.383431 0.923677 2.13932e-17 355 63.546 0.00150953 -3.51647 63.546000 Cu 0.468945 0.911876 6.55015e-17 358 63.546 0.000662036 -3.5173 63.546000 Cu 0.449203 0.928217 0.5 388 63.546 0.00271938 -3.51393 63.546000 Cu 0.600803 0.921357 1 361 63.546 9.37119e-05 -3.51716 63.546000 Cu 0.53491 0.916584 0.5 363 63.546 0.000231075 -3.51757 63.546000 Cu 0.514995 0.932898 3.95413e-17 389 63.546 0.00115645 -3.5167 63.546000 Cu 0.580774 0.937668 0.5 391 63.546 0.000221334 -3.5162 63.546000 Cu 0.686517 0.909787 4.43488e-17 364 63.546 0.000630568 -3.51863 63.546000 Cu 0.732621 0.930953 1 365 63.546 0.00250805 -3.51941 63.546000 Cu 0.666704 0.926164 0.5 367 63.546 0.000529157 -3.51782 63.546000 Cu 0.752226 0.914518 0.5 366 63.546 0.00109238 -3.51865 63.546000 Cu 0.817798 0.919147 1.61891e-16 368 63.546 0.000883254 -3.51859 63.546000 Cu 0.798585 0.935685 0.5 371 63.546 0.00554347 -3.52399 63.546000 Cu 0.968945 0.911876 0.5 346 63.546 0.000662036 -3.5173 63.546000 Cu 0.883431 0.923677 0.5 370 63.546 0.00150953 -3.51647 63.546000 Cu 0.949203 0.928217 9.92739e-17 372 63.546 0.00271938 -3.51393 63.546000 Cu 0.060557 0.953997 0.5 379 63.546 0.00195894 -3.51234 63.546000 Cu 0.126313 0.958741 9.25435e-18 377 63.546 0.0179009 -3.51587 63.546000 Cu 0.146699 0.942472 0.5 378 63.546 0.000806616 -3.51536 63.546000 Cu 0.212865 0.947306 4.80745e-19 380 63.546 0.0107193 -3.52248 63.546000 Cu 0.193368 0.963543 0.5 383 63.546 0.0202782 -3.52899 63.546000 Cu 0.36441 0.940188 0.5 357 63.546 0.0033706 -3.51522 63.546000 Cu 0.27984 0.952039 0.5 382 63.546 0.0120233 -3.52035 63.546000 Cu 0.34618 0.956834 6.61025e-17 384 63.546 0.0298205 -3.5077 63.546000 Cu 0.262025 0.96802 0 381 63.546 0.15911 -3.50534 63.546000 Cu 0.429655 0.944664 3.95413e-17 356 63.546 0.00899219 -3.51041 63.546000 Cu 0.410258 0.961529 0.5 386 63.546 0.015609 -3.51921 63.546000 Cu 0.474938 0.96567 9.3505e-17 414 63.546 0.0703729 -3.51938 63.546000 Cu 0.494963 0.949218 0.5 392 63.546 0.0102655 -3.5099 63.546000 Cu 0.560557 0.953997 1.11653e-16 390 63.546 0.00195894 -3.51234 63.546000 Cu 0.646699 0.942472 1 393 63.546 0.000806616 -3.51536 63.546000 Cu 0.693368 0.963543 3.96615e-17 394 63.546 0.0202782 -3.52899 63.546000 Cu 0.712865 0.947306 0.5 395 63.546 0.0107193 -3.52248 63.546000 Cu 0.626313 0.958741 0.5 396 63.546 0.0179009 -3.51587 63.546000 Cu 0.86441 0.940188 3.00466e-18 369 63.546 0.0033706 -3.51522 63.546000 Cu 0.77984 0.952039 6.85062e-17 397 63.546 0.0120233 -3.52035 63.546000 Cu 0.84618 0.956834 0.5 399 63.546 0.0298205 -3.5077 63.546000 Cu 0.762025 0.96802 0.5 400 63.546 0.15911 -3.50534 63.546000 Cu 0.994963 0.949218 3.96615e-17 373 63.546 0.0102655 -3.5099 63.546000 Cu 0.929655 0.944664 0.5 375 63.546 0.00899219 -3.51041 63.546000 Cu 0.910258 0.961529 2.99264e-17 401 63.546 0.015609 -3.51921 63.546000 Cu 0.974938 0.96567 0.5 403 63.546 0.0703729 -3.51938 63.546000 Cu 0.0394622 0.970318 3.96615e-17 405 63.546 0.0588309 -3.49757 63.546000 Cu 0.0899375 0.991418 0 406 63.546 2.99965 -3.4488 63.546000 Cu 0.105377 0.975127 0.5 407 63.546 0.156707 -3.53701 63.546000 Cu 0.0160284 0.986936 0.5 408 63.546 0.939549 -3.43229 63.546000 Cu 0.176029 0.979354 0 409 63.546 0.524867 -3.46785 63.546000 Cu 0.241496 0.984371 0.5 410 63.546 0.753693 -3.41794 63.546000 Cu 0.157786 0.994514 0.5 411 63.546 9.50968 -3.22401 63.546000 Cu 0.326204 0.973609 0.5 387 63.546 0.058353 -3.51842 63.546000 Cu 0.305967 0.991197 3.95413e-17 412 63.546 2.74753 -3.43607 63.546000 Cu 0.371009 0.994225 0.5 413 63.546 6.952 -3.22095 63.546000 Cu 0.392104 0.97863 3.95413e-17 385 63.546 0.351282 -3.4934 63.546000 Cu 0.454179 0.98321 0.5 417 63.546 0.4361 -3.40607 63.546000 Cu 0.516028 0.986936 1 415 63.546 0.939549 -3.43229 63.546000 Cu 0.539462 0.970318 0.5 416 63.546 0.0588309 -3.49757 63.546000 Cu 0.605377 0.975127 6.49006e-18 418 63.546 0.156707 -3.53701 63.546000 Cu 0.589937 0.991418 0.5 421 63.546 2.99965 -3.4488 63.546000 Cu 0.657786 0.994514 2.04317e-18 419 63.546 9.50968 -3.22401 63.546000 Cu 0.676029 0.979354 0.5 420 63.546 0.524867 -3.46785 63.546000 Cu 0.741496 0.984371 1.0336e-17 422 63.546 0.753693 -3.41794 63.546000 Cu 0.826204 0.973609 1 398 63.546 0.058353 -3.51842 63.546000 Cu 0.805967 0.991197 0.5 423 63.546 2.74753 -3.43607 63.546000 Cu 0.871009 0.994225 6.3218e-17 424 63.546 6.952 -3.22095 63.546000 Cu 0.954179 0.98321 9.61491e-17 402 63.546 0.4361 -3.40607 63.546000 Cu 0.892104 0.97863 0.5 404 63.546 0.351282 -3.4934