Number of particles = 1036 A = 1 Angstrom (basic length-scale) H0(1,1) = 28.9697 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 115.871 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.595 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 0.00335961 0.00569265 6.34779e-16 528 63.546 0.0707746 -3.50847 63.546000 Cu 0.0650543 0.00569127 0.5 531 63.546 0.0670046 -3.51081 63.546000 Cu 0.00548341 0.0213858 0.5 543 63.546 0.0866297 -3.50681 63.546000 Cu 0.0670311 0.0210888 1 545 63.546 0.112403 -3.50159 63.546000 Cu 0.125797 0.00567597 2.045e-15 530 63.546 0.397621 -3.48591 63.546000 Cu 0.185475 0.00566973 0.5 532 63.546 5.88993 -3.18385 63.546000 Cu 0.128969 0.0206338 0.5 547 63.546 0.292497 -3.46721 63.546000 Cu 0.195001 0.0188607 2.74468e-15 549 63.546 4.26999 -3.40182 63.546000 Cu 0.26742 0.0300884 5.323e-16 550 63.546 0.542831 -3.43142 63.546000 Cu 0.256978 0.0161649 0.5 551 63.546 8.47817 -3.25289 63.546000 Cu 0.313139 0.00821344 1 553 63.546 5.90397 -3.34738 63.546000 Cu 0.329125 0.0259464 0.5 556 63.546 0.639004 -3.42052 63.546000 Cu 0.385081 0.0227725 3.96284e-17 554 63.546 0.29986 -3.45116 63.546000 Cu 0.376327 0.00574319 0.5 555 63.546 1.82935 -3.44241 63.546000 Cu 0.440749 0.00572086 1 557 63.546 0.242498 -3.49556 63.546000 Cu 0.444339 0.0218368 0.5 560 63.546 0.165373 -3.49445 63.546000 Cu 0.505483 0.0213858 1 558 63.546 0.0866297 -3.50681 63.546000 Cu 0.50336 0.00569265 0.5 559 63.546 0.0707746 -3.50847 63.546000 Cu 0.565054 0.00569127 2.96097e-16 561 63.546 0.0670046 -3.51081 63.546000 Cu 0.567031 0.0210888 0.5 564 63.546 0.112403 -3.50159 63.546000 Cu 0.685475 0.00566973 8.36124e-15 523 63.546 5.88993 -3.18385 63.546000 Cu 0.695001 0.0188607 0.5 525 63.546 4.26999 -3.40182 63.546000 Cu 0.628969 0.0206338 8.39797e-16 562 63.546 0.292497 -3.46721 63.546000 Cu 0.625797 0.00567597 0.5 563 63.546 0.397621 -3.48591 63.546000 Cu 0.756978 0.0161649 4.68665e-17 524 63.546 8.47817 -3.25289 63.546000 Cu 0.813139 0.00821344 0.5 527 63.546 5.90397 -3.34738 63.546000 Cu 0.76742 0.0300884 0.5 535 63.546 0.542831 -3.43142 63.546000 Cu 0.829125 0.0259464 1.25309e-15 537 63.546 0.639004 -3.42052 63.546000 Cu 0.876327 0.00574319 3.79999e-17 526 63.546 1.82935 -3.44241 63.546000 Cu 0.940749 0.00572086 0.5 529 63.546 0.242498 -3.49556 63.546000 Cu 0.885081 0.0227725 0.5 539 63.546 0.29986 -3.45116 63.546000 Cu 0.944339 0.0218368 2.38374e-16 541 63.546 0.165373 -3.49445 63.546000 Cu 0.0114115 0.0372205 6.6928e-16 542 63.546 0.0871894 -3.50086 63.546000 Cu 0.0730419 0.0363135 0.5 548 63.546 0.111079 -3.49437 63.546000 Cu 0.0199872 0.0529274 0.5 575 63.546 0.0498238 -3.50194 63.546000 Cu 0.0818585 0.0512954 1.34218e-15 577 63.546 0.0388257 -3.50553 63.546000 Cu 0.137176 0.0349185 3.92545e-16 546 63.546 0.053515 -3.4953 63.546000 Cu 0.201559 0.0329495 0.5 552 63.546 0.0381623 -3.48605 63.546000 Cu 0.145363 0.049479 0.5 579 63.546 0.0180353 -3.50329 63.546000 Cu 0.210043 0.047262 4.68665e-17 581 63.546 0.0215899 -3.50276 63.546000 Cu 0.280361 0.0599487 1 582 63.546 0.0298862 -3.51249 63.546000 Cu 0.274106 0.0447082 0.5 583 63.546 0.0989356 -3.50314 63.546000 Cu 0.336056 0.0421877 1 585 63.546 0.167996 -3.48366 63.546000 Cu 0.34169 0.0580198 0.5 588 63.546 0.0239335 -3.50561 63.546000 Cu 0.401499 0.0562461 4.68665e-17 586 63.546 0.0253293 -3.49724 63.546000 Cu 0.394203 0.0399545 0.5 587 63.546 0.0444129 -3.47336 63.546000 Cu 0.451778 0.0382392 9.51384e-16 589 63.546 0.0604495 -3.49119 63.546000 Cu 0.46033 0.0545139 0.5 592 63.546 0.023843 -3.49728 63.546000 Cu 0.519987 0.0529274 3.6498e-16 590 63.546 0.0498238 -3.50194 63.546000 Cu 0.511411 0.0372205 0.5 591 63.546 0.0871894 -3.50086 63.546000 Cu 0.573042 0.0363135 4.1058e-16 593 63.546 0.111079 -3.49437 63.546000 Cu 0.581858 0.0512954 0.5 596 63.546 0.0388257 -3.50553 63.546000 Cu 0.701559 0.0329495 8.60969e-16 533 63.546 0.0381623 -3.48605 63.546000 Cu 0.710043 0.047262 0.5 536 63.546 0.0215899 -3.50276 63.546000 Cu 0.645363 0.049479 1 594 63.546 0.0180353 -3.50329 63.546000 Cu 0.637176 0.0349185 0.5 595 63.546 0.053515 -3.4953 63.546000 Cu 0.774106 0.0447082 1 534 63.546 0.0989356 -3.50314 63.546000 Cu 0.836056 0.0421877 0.5 540 63.546 0.167996 -3.48366 63.546000 Cu 0.780361 0.0599487 0.5 567 63.546 0.0298862 -3.51249 63.546000 Cu 0.84169 0.0580198 7.15966e-17 569 63.546 0.0239335 -3.50561 63.546000 Cu 0.894203 0.0399545 1 538 63.546 0.0444129 -3.47336 63.546000 Cu 0.951778 0.0382392 0.5 544 63.546 0.0604495 -3.49119 63.546000 Cu 0.901499 0.0562461 0.5 571 63.546 0.0253293 -3.49724 63.546000 Cu 0.96033 0.0545139 1.42409e-15 573 63.546 0.023843 -3.49728 63.546000 Cu 0.0294315 0.0683774 8.94023e-16 574 63.546 0.0132148 -3.50759 63.546000 Cu 0.0911932 0.0663695 0.5 580 63.546 0.00967002 -3.51011 63.546000 Cu 0.0385348 0.0836828 0.5 607 63.546 0.00290206 -3.50977 63.546000 Cu 0.100356 0.0815407 1 609 63.546 0.00202821 -3.51192 63.546000 Cu 0.154142 0.0642706 1 578 63.546 0.0103852 -3.51095 63.546000 Cu 0.217539 0.0620865 0.5 584 63.546 0.021859 -3.51232 63.546000 Cu 0.162556 0.0793853 0.5 611 63.546 0.00780848 -3.51345 63.546000 Cu 0.224846 0.077315 8.31051e-16 613 63.546 0.0119105 -3.51393 63.546000 Cu 0.286705 0.0754166 0.5 615 63.546 0.00683176 -3.51249 63.546000 Cu 0.347882 0.0736884 3.49478e-16 617 63.546 0.00283304 -3.50953 63.546000 Cu 0.354684 0.0892451 0.5 620 63.546 0.00206105 -3.51035 63.546000 Cu 0.415829 0.0875277 4.9231e-16 618 63.546 0.00569599 -3.50931 63.546000 Cu 0.408455 0.0720263 0.5 619 63.546 0.0113475 -3.50642 63.546000 Cu 0.468773 0.0702776 1 621 63.546 0.0172304 -3.50455 63.546000 Cu 0.477086 0.0856914 0.5 624 63.546 0.00661098 -3.50863 63.546000 Cu 0.538535 0.0836828 5.32722e-16 622 63.546 0.00290206 -3.50977 63.546000 Cu 0.529431 0.0683774 0.5 623 63.546 0.0132148 -3.50759 63.546000 Cu 0.591193 0.0663695 1 625 63.546 0.00967002 -3.51011 63.546000 Cu 0.600356 0.0815407 0.5 628 63.546 0.00202821 -3.51192 63.546000 Cu 0.717539 0.0620865 1 565 63.546 0.021859 -3.51232 63.546000 Cu 0.724846 0.077315 0.5 568 63.546 0.0119105 -3.51393 63.546000 Cu 0.662556 0.0793853 1 626 63.546 0.00780848 -3.51345 63.546000 Cu 0.654142 0.0642706 0.5 627 63.546 0.0103852 -3.51095 63.546000 Cu 0.786705 0.0754166 5.63665e-16 566 63.546 0.00683176 -3.51249 63.546000 Cu 0.847882 0.0736884 0.5 572 63.546 0.00283304 -3.50953 63.546000 Cu 0.854684 0.0892451 5.12395e-16 601 63.546 0.00206105 -3.51035 63.546000 Cu 0.908455 0.0720263 1.36076e-16 570 63.546 0.0113475 -3.50642 63.546000 Cu 0.968773 0.0702776 0.5 576 63.546 0.0172304 -3.50455 63.546000 Cu 0.915829 0.0875277 0.5 603 63.546 0.00569599 -3.50931 63.546000 Cu 0.977086 0.0856914 1 605 63.546 0.00661098 -3.50863 63.546000 Cu 0.04707 0.0989323 2.51101e-16 606 63.546 0.000733719 -3.51113 63.546000 Cu 0.108888 0.0968212 0.5 612 63.546 0.00195931 -3.51212 63.546000 Cu 0.0551837 0.114228 0.5 641 63.546 0.000647235 -3.51192 63.546000 Cu 0.116921 0.112187 4.68665e-17 643 63.546 0.00168698 -3.512 63.546000 Cu 0.17061 0.0947289 4.33922e-16 610 63.546 0.00423101 -3.51281 63.546000 Cu 0.232185 0.0927617 0.5 616 63.546 0.00387929 -3.51265 63.546000 Cu 0.178396 0.110189 0.5 645 63.546 0.00154539 -3.51189 63.546000 Cu 0.239672 0.108285 8.7641e-17 647 63.546 0.000631376 -3.51148 63.546000 Cu 0.293542 0.0909537 1 614 63.546 0.00111741 -3.51155 63.546000 Cu 0.300827 0.10648 0.5 649 63.546 0.000914256 -3.51094 63.546000 Cu 0.36211 0.104707 3.4604e-16 651 63.546 0.00210191 -3.51066 63.546000 Cu 0.369937 0.120103 0.5 654 63.546 0.00105681 -3.51104 63.546000 Cu 0.431567 0.118207 9.17486e-16 652 63.546 0.000549096 -3.51125 63.546000 Cu 0.423584 0.102893 0.5 653 63.546 0.00234064 -3.51054 63.546000 Cu 0.485272 0.100972 9.52289e-16 655 63.546 0.00126718 -3.51059 63.546000 Cu 0.493364 0.11625 0.5 658 63.546 0.000200886 -3.51155 63.546000 Cu 0.555184 0.114228 5.25906e-16 656 63.546 0.000647235 -3.51192 63.546000 Cu 0.54707 0.0989323 0.5 657 63.546 0.000733719 -3.51113 63.546000 Cu 0.608888 0.0968212 1 659 63.546 0.00195931 -3.51212 63.546000 Cu 0.616921 0.112187 0.5 662 63.546 0.00168698 -3.512 63.546000 Cu 0.732185 0.0927617 2.31618e-16 597 63.546 0.00387929 -3.51265 63.546000 Cu 0.739672 0.108285 0.5 600 63.546 0.000631376 -3.51148 63.546000 Cu 0.678396 0.110189 1 660 63.546 0.00154539 -3.51189 63.546000 Cu 0.67061 0.0947289 0.5 661 63.546 0.00423101 -3.51281 63.546000 Cu 0.793542 0.0909537 0.5 599 63.546 0.00111741 -3.51155 63.546000 Cu 0.800827 0.10648 1 598 63.546 0.000914256 -3.51094 63.546000 Cu 0.86211 0.104707 0.5 604 63.546 0.00210191 -3.51066 63.546000 Cu 0.869937 0.120103 1 635 63.546 0.00105681 -3.51104 63.546000 Cu 0.923584 0.102893 1 602 63.546 0.00234064 -3.51054 63.546000 Cu 0.985272 0.100972 0.5 608 63.546 0.00126718 -3.51059 63.546000 Cu 0.931567 0.118207 0.5 637 63.546 0.000549096 -3.51125 63.546000 Cu 0.993364 0.11625 7.67115e-16 639 63.546 0.000200886 -3.51155 63.546000 Cu 0.0630604 0.12958 3.4604e-16 640 63.546 0.000606034 -3.51194 63.546000 Cu 0.00133872 0.131564 0.5 642 63.546 0.000238753 -3.51186 63.546000 Cu 0.00919629 0.146934 0 673 63.546 0.000220316 -3.51194 63.546000 Cu 0.0708054 0.144977 0.5 675 63.546 0.000359448 -3.51189 63.546000 Cu 0.124646 0.127604 0.5 646 63.546 0.000789036 -3.51178 63.546000 Cu 0.186037 0.125679 1 644 63.546 0.000311111 -3.51143 63.546000 Cu 0.132286 0.143055 2.41269e-19 677 63.546 0.000124974 -3.51164 63.546000 Cu 0.193684 0.14116 0.5 679 63.546 8.91071e-05 -3.51132 63.546000 Cu 0.247285 0.12381 0.5 650 63.546 0.000212622 -3.51108 63.546000 Cu 0.308529 0.12196 4.68665e-17 648 63.546 0.000822501 -3.51097 63.546000 Cu 0.255042 0.139281 1 681 63.546 0.000260362 -3.51106 63.546000 Cu 0.316455 0.137399 0.5 683 63.546 0.000386915 -3.51116 63.546000 Cu 0.377955 0.135484 7.83944e-16 685 63.546 0.000271228 -3.51146 63.546000 Cu 0.447582 0.148903 1 686 63.546 7.07932e-05 -3.51182 63.546000 Cu 0.439602 0.133537 0.5 687 63.546 0.000128278 -3.51173 63.546000 Cu 0.385958 0.150865 0.5 688 63.546 5.79204e-05 -3.51157 63.546000 Cu 0.501339 0.131564 6.16684e-16 689 63.546 0.000238753 -3.51186 63.546000 Cu 0.570805 0.144977 1.89396e-16 690 63.546 0.000359448 -3.51189 63.546000 Cu 0.56306 0.12958 0.5 691 63.546 0.000606034 -3.51194 63.546000 Cu 0.509196 0.146934 0.5 692 63.546 0.000220316 -3.51194 63.546000 Cu 0.624646 0.127604 8.96918e-16 693 63.546 0.000789036 -3.51178 63.546000 Cu 0.693684 0.14116 1 629 63.546 8.91071e-05 -3.51132 63.546000 Cu 0.686037 0.125679 0.5 630 63.546 0.000311111 -3.51143 63.546000 Cu 0.632286 0.143055 0.5 694 63.546 0.000124974 -3.51164 63.546000 Cu 0.747285 0.12381 2.72875e-16 631 63.546 0.000212622 -3.51108 63.546000 Cu 0.808529 0.12196 0.5 633 63.546 0.000822501 -3.51097 63.546000 Cu 0.816455 0.137399 8.27855e-16 632 63.546 0.000386915 -3.51116 63.546000 Cu 0.755042 0.139281 0.5 634 63.546 0.000260362 -3.51106 63.546000 Cu 0.939602 0.133537 1.6153e-16 636 63.546 0.000128278 -3.51173 63.546000 Cu 0.877955 0.135484 0.5 638 63.546 0.000271228 -3.51146 63.546000 Cu 0.885958 0.150865 1 669 63.546 5.79204e-05 -3.51157 63.546000 Cu 0.947582 0.148903 0.5 671 63.546 7.07932e-05 -3.51182 63.546000 Cu 0.0785176 0.160414 1 674 63.546 6.11605e-05 -3.5117 63.546000 Cu 0.0170258 0.162344 0.5 676 63.546 0.000134902 -3.51181 63.546000 Cu 0.0247938 0.177777 1 705 63.546 1.66042e-05 -3.51171 63.546000 Cu 0.0862799 0.175854 0.5 707 63.546 1.3693e-05 -3.51149 63.546000 Cu 0.201434 0.156608 7.25014e-17 678 63.546 7.01718e-05 -3.5113 63.546000 Cu 0.139974 0.158506 0.5 680 63.546 2.32543e-05 -3.5115 63.546000 Cu 0.147724 0.17394 9.5241e-17 709 63.546 4.42015e-05 -3.51136 63.546000 Cu 0.209229 0.172031 0.5 711 63.546 3.00526e-05 -3.51132 63.546000 Cu 0.324391 0.152801 1 682 63.546 0.000119229 -3.51131 63.546000 Cu 0.262884 0.154712 0.5 684 63.546 0.00013781 -3.51121 63.546000 Cu 0.27073 0.17012 1.21117e-16 713 63.546 6.13533e-05 -3.51135 63.546000 Cu 0.332294 0.168191 0.5 715 63.546 2.40741e-05 -3.51149 63.546000 Cu 0.393866 0.166249 1 717 63.546 2.07887e-05 -3.51163 63.546000 Cu 0.46329 0.179707 3.91459e-17 718 63.546 6.8254e-05 -3.51178 63.546000 Cu 0.455474 0.164296 0.5 719 63.546 9.35355e-05 -3.5118 63.546000 Cu 0.401715 0.181645 0.5 720 63.546 3.79365e-05 -3.51171 63.546000 Cu 0.517026 0.162344 2.51825e-16 721 63.546 0.000134902 -3.51181 63.546000 Cu 0.58628 0.175854 1 722 63.546 1.3693e-05 -3.51149 63.546000 Cu 0.578518 0.160414 0.5 723 63.546 6.11605e-05 -3.5117 63.546000 Cu 0.524794 0.177777 0.5 724 63.546 1.66042e-05 -3.51171 63.546000 Cu 0.709229 0.172031 1 663 63.546 3.00526e-05 -3.51132 63.546000 Cu 0.701434 0.156608 0.5 664 63.546 7.01718e-05 -3.5113 63.546000 Cu 0.639974 0.158506 1 725 63.546 2.32543e-05 -3.5115 63.546000 Cu 0.647724 0.17394 0.5 726 63.546 4.42015e-05 -3.51136 63.546000 Cu 0.762884 0.154712 1 665 63.546 0.00013781 -3.51121 63.546000 Cu 0.832294 0.168191 1 666 63.546 2.40741e-05 -3.51149 63.546000 Cu 0.824391 0.152801 0.5 667 63.546 0.000119229 -3.51131 63.546000 Cu 0.77073 0.17012 0.5 668 63.546 6.13533e-05 -3.51135 63.546000 Cu 0.955474 0.164296 1 670 63.546 9.35355e-05 -3.5118 63.546000 Cu 0.893866 0.166249 0.5 672 63.546 2.07887e-05 -3.51163 63.546000 Cu 0.901715 0.181645 1 701 63.546 3.79365e-05 -3.51171 63.546000 Cu 0.96329 0.179707 0.5 703 63.546 6.8254e-05 -3.51178 63.546000 Cu 0.0940955 0.191283 4.52922e-16 706 63.546 1.98675e-05 -3.51144 63.546000 Cu 0.0325708 0.193203 0.5 708 63.546 2.03314e-05 -3.51153 63.546000 Cu 0.0403677 0.208613 1 737 63.546 1.91482e-05 -3.51145 63.546000 Cu 0.101892 0.206704 0.5 739 63.546 1.36957e-05 -3.51145 63.546000 Cu 0.21704 0.187446 4.68665e-17 710 63.546 2.82734e-05 -3.51143 63.546000 Cu 0.15556 0.189366 0.5 712 63.546 6.66948e-06 -3.51142 63.546000 Cu 0.163413 0.204791 1.81977e-16 741 63.546 4.03153e-05 -3.51153 63.546000 Cu 0.224899 0.202864 0.5 743 63.546 1.34319e-05 -3.51159 63.546000 Cu 0.340142 0.183585 1.02473e-15 714 63.546 1.59434e-05 -3.51156 63.546000 Cu 0.27856 0.185518 0.5 716 63.546 2.5466e-05 -3.51149 63.546000 Cu 0.286403 0.200925 1 745 63.546 1.16415e-05 -3.51165 63.546000 Cu 0.347924 0.198985 0.5 747 63.546 2.50969e-05 -3.51161 63.546000 Cu 0.409473 0.197052 4.68665e-17 749 63.546 7.01968e-06 -3.51163 63.546000 Cu 0.478788 0.210531 9.05603e-16 750 63.546 2.86406e-05 -3.51148 63.546000 Cu 0.471027 0.195125 0.5 751 63.546 9.83168e-06 -3.51158 63.546000 Cu 0.532571 0.193203 4.58411e-17 753 63.546 2.03314e-05 -3.51153 63.546000 Cu 0.601892 0.206704 1.11346e-16 754 63.546 1.36957e-05 -3.51145 63.546000 Cu 0.594095 0.191283 0.5 755 63.546 1.98675e-05 -3.51144 63.546000 Cu 0.540368 0.208613 0.5 756 63.546 1.91482e-05 -3.51145 63.546000 Cu 0.724899 0.202864 5.71024e-16 695 63.546 1.34319e-05 -3.51159 63.546000 Cu 0.71704 0.187446 0.5 696 63.546 2.82734e-05 -3.51143 63.546000 Cu 0.65556 0.189366 1.12033e-15 757 63.546 6.66948e-06 -3.51142 63.546000 Cu 0.663413 0.204791 0.5 758 63.546 4.03153e-05 -3.51153 63.546000 Cu 0.77856 0.185518 9.90952e-16 697 63.546 2.5466e-05 -3.51149 63.546000 Cu 0.847924 0.198985 1 698 63.546 2.50969e-05 -3.51161 63.546000 Cu 0.840142 0.183585 0.5 699 63.546 1.59434e-05 -3.51156 63.546000 Cu 0.786403 0.200925 0.5 700 63.546 1.16415e-05 -3.51165 63.546000 Cu 0.971027 0.195125 2.46577e-16 702 63.546 9.83168e-06 -3.51158 63.546000 Cu 0.909473 0.197052 0.5 704 63.546 7.01968e-06 -3.51163 63.546000 Cu 0.978788 0.210531 0.5 735 63.546 2.86406e-05 -3.51148 63.546000 Cu 0.10965 0.222121 1 738 63.546 4.46032e-06 -3.51156 63.546000 Cu 0.0481295 0.224029 0.5 740 63.546 1.63687e-05 -3.51156 63.546000 Cu 0.0558858 0.239453 5.80976e-16 771 63.546 1.52954e-05 -3.51168 63.546000 Cu 0.117387 0.237538 0.5 773 63.546 2.91628e-05 -3.5117 63.546000 Cu 0.232719 0.218281 1 742 63.546 3.33278e-05 -3.5117 63.546000 Cu 0.171197 0.220207 0.5 744 63.546 2.9496e-05 -3.5116 63.546000 Cu 0.178927 0.235617 1 775 63.546 3.1426e-05 -3.51164 63.546000 Cu 0.240491 0.233689 0.5 777 63.546 4.21759e-05 -3.51161 63.546000 Cu 0.355722 0.214398 1 746 63.546 2.67934e-05 -3.51166 63.546000 Cu 0.294244 0.216342 0.5 748 63.546 1.41025e-05 -3.51173 63.546000 Cu 0.30206 0.231752 1 779 63.546 4.6514e-05 -3.51153 63.546000 Cu 0.3636 0.22981 0.5 781 63.546 1.94027e-05 -3.51148 63.546000 Cu 0.417243 0.21246 0.5 752 63.546 4.33264e-05 -3.51155 63.546000 Cu 0.425118 0.22787 1.09983e-15 783 63.546 2.29899e-05 -3.51146 63.546000 Cu 0.494429 0.241367 1 784 63.546 8.88457e-06 -3.51162 63.546000 Cu 0.486608 0.225943 0.5 785 63.546 4.20198e-05 -3.51153 63.546000 Cu 0.54813 0.224029 2.51282e-16 787 63.546 1.63687e-05 -3.51156 63.546000 Cu 0.617387 0.237538 1 788 63.546 2.91628e-05 -3.5117 63.546000 Cu 0.60965 0.222121 0.5 789 63.546 4.46032e-06 -3.51156 63.546000 Cu 0.555886 0.239453 0.5 790 63.546 1.52954e-05 -3.51168 63.546000 Cu 0.740491 0.233689 1 727 63.546 4.21759e-05 -3.51161 63.546000 Cu 0.732719 0.218281 0.5 728 63.546 3.33278e-05 -3.5117 63.546000 Cu 0.671197 0.220207 1 791 63.546 2.9496e-05 -3.5116 63.546000 Cu 0.678927 0.235617 0.5 792 63.546 3.1426e-05 -3.51164 63.546000 Cu 0.794244 0.216342 2.88618e-16 729 63.546 1.41025e-05 -3.51173 63.546000 Cu 0.8636 0.22981 1.0465e-16 730 63.546 1.94027e-05 -3.51148 63.546000 Cu 0.855722 0.214398 0.5 731 63.546 2.67934e-05 -3.51166 63.546000 Cu 0.80206 0.231752 0.5 732 63.546 4.6514e-05 -3.51153 63.546000 Cu 0.917243 0.21246 1 733 63.546 4.33264e-05 -3.51155 63.546000 Cu 0.986608 0.225943 2.38133e-16 734 63.546 4.20198e-05 -3.51153 63.546000 Cu 0.925118 0.22787 0.5 736 63.546 2.29899e-05 -3.51146 63.546000 Cu 0.994429 0.241367 0.5 769 63.546 8.88457e-06 -3.51162 63.546000 Cu 0.00221063 0.256795 1 768 63.546 4.60803e-05 -3.51161 63.546000 Cu 0.0636722 0.254878 0.5 774 63.546 5.42758e-05 -3.51158 63.546000 Cu 0.0099384 0.272204 0.5 803 63.546 6.02396e-05 -3.51146 63.546000 Cu 0.0714502 0.270278 1 805 63.546 4.62544e-05 -3.51139 63.546000 Cu 0.125158 0.25295 1 772 63.546 5.94524e-05 -3.51154 63.546000 Cu 0.186683 0.251015 0.5 778 63.546 4.7477e-05 -3.51148 63.546000 Cu 0.13297 0.268341 0.5 807 63.546 1.21174e-05 -3.51141 63.546000 Cu 0.194506 0.266399 1.87949e-16 809 63.546 1.54631e-05 -3.5115 63.546000 Cu 0.24827 0.249077 1 776 63.546 2.5323e-06 -3.51145 63.546000 Cu 0.371458 0.245206 1.87828e-16 780 63.546 0.000107202 -3.51149 63.546000 Cu 0.309875 0.247138 0.5 782 63.546 2.81591e-05 -3.51145 63.546000 Cu 0.256067 0.26446 0.5 811 63.546 4.91278e-05 -3.51164 63.546000 Cu 0.317634 0.262532 2.5466e-16 813 63.546 5.30688e-05 -3.51177 63.546000 Cu 0.432966 0.243283 0.5 786 63.546 6.87692e-05 -3.51153 63.546000 Cu 0.379198 0.260615 0.5 815 63.546 3.7788e-05 -3.51178 63.546000 Cu 0.44072 0.258706 1 817 63.546 3.01271e-05 -3.5117 63.546000 Cu 0.509938 0.272204 5.37186e-16 818 63.546 6.02396e-05 -3.51146 63.546000 Cu 0.502211 0.256795 0.5 819 63.546 4.60803e-05 -3.51161 63.546000 Cu 0.563672 0.254878 1 821 63.546 5.42758e-05 -3.51158 63.546000 Cu 0.57145 0.270278 0.5 824 63.546 4.62544e-05 -3.51139 63.546000 Cu 0.686683 0.251015 1 759 63.546 4.7477e-05 -3.51148 63.546000 Cu 0.694506 0.266399 0.5 762 63.546 1.54631e-05 -3.5115 63.546000 Cu 0.63297 0.268341 1 822 63.546 1.21174e-05 -3.51141 63.546000 Cu 0.625158 0.25295 0.5 823 63.546 5.94524e-05 -3.51154 63.546000 Cu 0.74827 0.249077 0.5 761 63.546 2.5323e-06 -3.51145 63.546000 Cu 0.756067 0.26446 4.78919e-16 760 63.546 4.91278e-05 -3.51164 63.546000 Cu 0.809875 0.247138 1 763 63.546 2.81591e-05 -3.51145 63.546000 Cu 0.871458 0.245206 0.5 765 63.546 0.000107202 -3.51149 63.546000 Cu 0.817634 0.262532 0.5 766 63.546 5.30688e-05 -3.51177 63.546000 Cu 0.932966 0.243283 3.22516e-16 767 63.546 6.87692e-05 -3.51153 63.546000 Cu 0.879198 0.260615 1.44038e-16 764 63.546 3.7788e-05 -3.51178 63.546000 Cu 0.94072 0.258706 0.5 770 63.546 3.01271e-05 -3.5117 63.546000 Cu 0.0176242 0.287591 1 802 63.546 2.32975e-05 -3.51142 63.546000 Cu 0.0791846 0.285663 0.5 808 63.546 4.26934e-05 -3.51147 63.546000 Cu 0.0252522 0.302972 0.5 835 63.546 1.52645e-05 -3.51155 63.546000 Cu 0.0868127 0.301047 1 837 63.546 1.58383e-05 -3.51161 63.546000 Cu 0.140734 0.283728 1 806 63.546 5.35824e-05 -3.51157 63.546000 Cu 0.202271 0.281792 0.5 812 63.546 4.48025e-05 -3.51167 63.546000 Cu 0.148378 0.299119 0.5 839 63.546 2.12607e-05 -3.51166 63.546000 Cu 0.209928 0.29719 3.51529e-16 841 63.546 1.79058e-05 -3.51167 63.546000 Cu 0.263802 0.279862 1 810 63.546 2.67885e-05 -3.51173 63.546000 Cu 0.325336 0.277943 0.5 816 63.546 1.38918e-05 -3.51175 63.546000 Cu 0.271465 0.295263 0.5 843 63.546 1.1189e-05 -3.51159 63.546000 Cu 0.332992 0.293343 3.84342e-16 845 63.546 8.22785e-06 -3.51151 63.546000 Cu 0.386876 0.27603 1 814 63.546 1.70134e-05 -3.5117 63.546000 Cu 0.448415 0.274119 0.5 820 63.546 3.76623e-05 -3.51159 63.546000 Cu 0.394525 0.291428 0.5 847 63.546 1.20315e-05 -3.51146 63.546000 Cu 0.456067 0.289513 1 849 63.546 1.75136e-05 -3.51143 63.546000 Cu 0.525252 0.302972 1.94523e-16 850 63.546 1.52645e-05 -3.51155 63.546000 Cu 0.517624 0.287591 0.5 851 63.546 2.32975e-05 -3.51142 63.546000 Cu 0.579185 0.285663 3.04059e-16 853 63.546 4.26934e-05 -3.51147 63.546000 Cu 0.586813 0.301047 0.5 856 63.546 1.58383e-05 -3.51161 63.546000 Cu 0.702271 0.281792 1 793 63.546 4.48025e-05 -3.51167 63.546000 Cu 0.709928 0.29719 0.5 796 63.546 1.79058e-05 -3.51167 63.546000 Cu 0.648378 0.299119 1 854 63.546 2.12607e-05 -3.51166 63.546000 Cu 0.640734 0.283728 0.5 855 63.546 5.35824e-05 -3.51157 63.546000 Cu 0.771465 0.295263 4.58411e-17 794 63.546 1.1189e-05 -3.51159 63.546000 Cu 0.763802 0.279862 0.5 795 63.546 2.67885e-05 -3.51173 63.546000 Cu 0.825336 0.277943 1 797 63.546 1.38918e-05 -3.51175 63.546000 Cu 0.832992 0.293343 0.5 800 63.546 8.22785e-06 -3.51151 63.546000 Cu 0.894525 0.291428 2.50317e-16 798 63.546 1.20315e-05 -3.51146 63.546000 Cu 0.886876 0.27603 0.5 799 63.546 1.70134e-05 -3.5117 63.546000 Cu 0.948415 0.274119 1 801 63.546 3.76623e-05 -3.51159 63.546000 Cu 0.956067 0.289513 0.5 804 63.546 1.75136e-05 -3.51143 63.546000 Cu 0.0328112 0.318361 2.53333e-18 834 63.546 4.10261e-06 -3.51169 63.546000 Cu 0.0943784 0.316436 0.5 840 63.546 4.12204e-06 -3.51172 63.546000 Cu 0.101921 0.331822 1 869 63.546 2.74095e-05 -3.51174 63.546000 Cu 0.155952 0.314509 4.73973e-16 838 63.546 5.85255e-06 -3.51174 63.546000 Cu 0.217532 0.312581 0.5 844 63.546 1.56048e-05 -3.51171 63.546000 Cu 0.163506 0.329893 0.5 871 63.546 3.26053e-05 -3.51167 63.546000 Cu 0.225097 0.327961 1 873 63.546 2.2055e-05 -3.51157 63.546000 Cu 0.279086 0.310655 1.32517e-16 842 63.546 1.51358e-05 -3.51163 63.546000 Cu 0.340612 0.308733 0.5 848 63.546 3.18579e-06 -3.51154 63.546000 Cu 0.286667 0.326036 0.5 875 63.546 1.80804e-05 -3.51142 63.546000 Cu 0.348224 0.324117 3.01285e-16 877 63.546 2.8369e-05 -3.51137 63.546000 Cu 0.402138 0.306814 4.77351e-16 846 63.546 1.91924e-06 -3.5115 63.546000 Cu 0.46369 0.304894 0.5 852 63.546 6.61115e-06 -3.51152 63.546000 Cu 0.409747 0.322199 0.5 879 63.546 2.1168e-05 -3.51146 63.546000 Cu 0.47127 0.320282 4.71621e-16 881 63.546 1.04395e-05 -3.5116 63.546000 Cu 0.532811 0.318361 0.5 883 63.546 4.10261e-06 -3.51169 63.546000 Cu 0.594378 0.316436 1 885 63.546 4.12204e-06 -3.51172 63.546000 Cu 0.601921 0.331822 0.5 888 63.546 2.74095e-05 -3.51174 63.546000 Cu 0.717532 0.312581 4.68665e-17 825 63.546 1.56048e-05 -3.51171 63.546000 Cu 0.725097 0.327961 0.5 828 63.546 2.2055e-05 -3.51157 63.546000 Cu 0.663506 0.329893 1 886 63.546 3.26053e-05 -3.51167 63.546000 Cu 0.655952 0.314509 0.5 887 63.546 5.85255e-06 -3.51174 63.546000 Cu 0.786667 0.326036 0 826 63.546 1.80804e-05 -3.51142 63.546000 Cu 0.779086 0.310655 0.5 827 63.546 1.51358e-05 -3.51163 63.546000 Cu 0.840612 0.308733 1 829 63.546 3.18579e-06 -3.51154 63.546000 Cu 0.848224 0.324117 0.5 832 63.546 2.8369e-05 -3.51137 63.546000 Cu 0.909747 0.322199 1 830 63.546 2.1168e-05 -3.51146 63.546000 Cu 0.902138 0.306814 0.5 831 63.546 1.91924e-06 -3.5115 63.546000 Cu 0.96369 0.304894 2.65275e-16 833 63.546 6.61115e-06 -3.51152 63.546000 Cu 0.97127 0.320282 0.5 836 63.546 1.04395e-05 -3.5116 63.546000 Cu 0.0403364 0.33375 0.5 867 63.546 1.69763e-05 -3.51172 63.546000 Cu 0.0478243 0.349134 1 866 63.546 9.3553e-05 -3.51174 63.546000 Cu 0.109431 0.347193 0.5 872 63.546 7.29334e-05 -3.51167 63.546000 Cu 0.117037 0.36254 4.68665e-17 903 63.546 3.87678e-05 -3.51176 63.546000 Cu 0.171072 0.345252 5.01538e-16 870 63.546 1.6216e-05 -3.51149 63.546000 Cu 0.232682 0.34332 0.5 876 63.546 1.67797e-05 -3.51133 63.546000 Cu 0.178683 0.360598 0.5 905 63.546 5.28477e-05 -3.51153 63.546000 Cu 0.240278 0.358673 3.64256e-16 907 63.546 0.000148798 -3.51132 63.546000 Cu 0.294251 0.341396 1 874 63.546 5.70135e-05 -3.51126 63.546000 Cu 0.355777 0.339487 0.5 880 63.546 5.49437e-05 -3.51125 63.546000 Cu 0.301801 0.356772 0.5 909 63.546 0.000124818 -3.51129 63.546000 Cu 0.363272 0.354876 1 911 63.546 4.28078e-05 -3.51138 63.546000 Cu 0.417281 0.337584 4.63237e-17 878 63.546 2.18636e-05 -3.51139 63.546000 Cu 0.478794 0.335672 0.5 884 63.546 1.49833e-05 -3.51157 63.546000 Cu 0.424741 0.352976 0.5 913 63.546 2.13643e-05 -3.51149 63.546000 Cu 0.486256 0.351062 1 915 63.546 5.43073e-05 -3.51167 63.546000 Cu 0.540336 0.33375 1 882 63.546 1.69763e-05 -3.51172 63.546000 Cu 0.547824 0.349134 0.5 917 63.546 9.3553e-05 -3.51174 63.546000 Cu 0.609431 0.347193 6.45455e-16 919 63.546 7.29334e-05 -3.51167 63.546000 Cu 0.617037 0.36254 0.5 922 63.546 3.87678e-05 -3.51176 63.546000 Cu 0.732682 0.34332 1 857 63.546 1.67797e-05 -3.51133 63.546000 Cu 0.740278 0.358673 0.5 860 63.546 0.000148798 -3.51132 63.546000 Cu 0.678683 0.360598 1 920 63.546 5.28477e-05 -3.51153 63.546000 Cu 0.671072 0.345252 0.5 921 63.546 1.6216e-05 -3.51149 63.546000 Cu 0.801801 0.356772 1 858 63.546 0.000124818 -3.51129 63.546000 Cu 0.794251 0.341396 0.5 859 63.546 5.70135e-05 -3.51126 63.546000 Cu 0.855777 0.339487 8.18566e-16 861 63.546 5.49437e-05 -3.51125 63.546000 Cu 0.863272 0.354876 0.5 864 63.546 4.28078e-05 -3.51138 63.546000 Cu 0.924741 0.352976 1 862 63.546 2.13643e-05 -3.51149 63.546000 Cu 0.917281 0.337584 0.5 863 63.546 2.18636e-05 -3.51139 63.546000 Cu 0.978794 0.335672 3.09247e-16 865 63.546 1.49833e-05 -3.51157 63.546000 Cu 0.986256 0.351062 0.5 868 63.546 5.43073e-05 -3.51167 63.546000 Cu 0.055336 0.364493 0.5 901 63.546 0.000133709 -3.51182 63.546000 Cu 0.0629133 0.379824 1 900 63.546 0.000151212 -3.51185 63.546000 Cu 0.00117755 0.381802 0.5 902 63.546 0.000371605 -3.5118 63.546000 Cu 0.124673 0.377868 0.5 906 63.546 0.000111458 -3.5117 63.546000 Cu 0.18637 0.37594 6.57458e-18 904 63.546 0.000321861 -3.51141 63.546000 Cu 0.1324 0.393165 1.05302e-15 937 63.546 0.000666792 -3.51132 63.546000 Cu 0.194063 0.391288 0.5 939 63.546 0.00110132 -3.51113 63.546000 Cu 0.2479 0.374048 0.5 910 63.546 0.000342191 -3.51113 63.546000 Cu 0.309304 0.372172 2.12618e-16 908 63.546 0.000153524 -3.51112 63.546000 Cu 0.370714 0.370288 0.5 914 63.546 6.6036e-05 -3.51133 63.546000 Cu 0.255495 0.389455 1 941 63.546 0.000635021 -3.51109 63.546000 Cu 0.316797 0.387612 0.5 943 63.546 0.000188902 -3.51125 63.546000 Cu 0.43216 0.368378 8.4595e-16 912 63.546 0.000138534 -3.51154 63.546000 Cu 0.493692 0.366445 0.5 918 63.546 0.000230429 -3.5117 63.546000 Cu 0.378089 0.385723 1.45666e-16 945 63.546 0.000339185 -3.5115 63.546000 Cu 0.439547 0.383781 0.5 947 63.546 0.000563119 -3.51171 63.546000 Cu 0.555336 0.364493 1 916 63.546 0.000133709 -3.51182 63.546000 Cu 0.501178 0.381802 7.31648e-17 949 63.546 0.000371605 -3.5118 63.546000 Cu 0.562913 0.379824 0.5 951 63.546 0.000151212 -3.51185 63.546000 Cu 0.624673 0.377868 1 953 63.546 0.000111458 -3.5117 63.546000 Cu 0.694063 0.391288 2.12498e-16 889 63.546 0.00110132 -3.51113 63.546000 Cu 0.68637 0.37594 0.5 890 63.546 0.000321861 -3.51141 63.546000 Cu 0.6324 0.393165 0.5 954 63.546 0.000666792 -3.51132 63.546000 Cu 0.7479 0.374048 2.3391e-16 891 63.546 0.000342191 -3.51113 63.546000 Cu 0.816797 0.387612 1 892 63.546 0.000188902 -3.51125 63.546000 Cu 0.809304 0.372172 0.5 893 63.546 0.000153524 -3.51112 63.546000 Cu 0.755495 0.389455 0.5 894 63.546 0.000635021 -3.51109 63.546000 Cu 0.870714 0.370288 9.13988e-16 895 63.546 6.6036e-05 -3.51133 63.546000 Cu 0.939547 0.383781 1 896 63.546 0.000563119 -3.51171 63.546000 Cu 0.93216 0.368378 0.5 897 63.546 0.000138534 -3.51154 63.546000 Cu 0.878089 0.385723 0.5 898 63.546 0.000339185 -3.5115 63.546000 Cu 0.993692 0.366445 1 899 63.546 0.000230429 -3.5117 63.546000 Cu 0.00874232 0.397131 1 933 63.546 0.000791531 -3.51173 63.546000 Cu 0.0784301 0.410372 1.77152e-16 934 63.546 0.00167846 -3.51054 63.546000 Cu 0.0705727 0.395118 0.5 935 63.546 0.000277213 -3.51148 63.546000 Cu 0.0166193 0.412408 0.5 936 63.546 0.000794119 -3.51098 63.546000 Cu 0.201586 0.406674 5.2277e-16 938 63.546 0.00172539 -3.51094 63.546000 Cu 0.140095 0.408471 0.5 940 63.546 0.00239469 -3.51061 63.546000 Cu 0.147573 0.423826 9.7714e-18 969 63.546 0.00550731 -3.50924 63.546000 Cu 0.208728 0.422126 0.5 971 63.546 0.00143489 -3.51053 63.546000 Cu 0.324163 0.403102 2.26371e-16 942 63.546 0.000754215 -3.51165 63.546000 Cu 0.262903 0.404914 0.5 944 63.546 0.000576584 -3.51128 63.546000 Cu 0.26999 0.420409 1.02437e-15 973 63.546 0.00126067 -3.51176 63.546000 Cu 0.331434 0.418588 0.5 975 63.546 0.00352519 -3.5126 63.546000 Cu 0.447036 0.39917 8.35394e-17 946 63.546 0.00127678 -3.51198 63.546000 Cu 0.385502 0.401183 0.5 948 63.546 0.00140419 -3.51196 63.546000 Cu 0.393073 0.416611 1 977 63.546 0.0035893 -3.51267 63.546000 Cu 0.454817 0.414522 0.5 979 63.546 0.00182288 -3.51189 63.546000 Cu 0.570573 0.395118 2.64491e-16 950 63.546 0.000277213 -3.51148 63.546000 Cu 0.508742 0.397131 0.5 952 63.546 0.000791531 -3.51173 63.546000 Cu 0.516619 0.412408 1 981 63.546 0.000794119 -3.51098 63.546000 Cu 0.57843 0.410372 0.5 983 63.546 0.00167846 -3.51054 63.546000 Cu 0.708728 0.422126 1 923 63.546 0.00143489 -3.51053 63.546000 Cu 0.701586 0.406674 0.5 924 63.546 0.00172539 -3.51094 63.546000 Cu 0.640095 0.408471 1 985 63.546 0.00239469 -3.51061 63.546000 Cu 0.647573 0.423826 0.5 986 63.546 0.00550731 -3.50924 63.546000 Cu 0.762903 0.404914 1 925 63.546 0.000576584 -3.51128 63.546000 Cu 0.831434 0.418588 8.46854e-17 926 63.546 0.00352519 -3.5126 63.546000 Cu 0.824163 0.403102 0.5 927 63.546 0.000754215 -3.51165 63.546000 Cu 0.76999 0.420409 0.5 928 63.546 0.00126067 -3.51176 63.546000 Cu 0.885502 0.401183 1.26359e-15 929 63.546 0.00140419 -3.51196 63.546000 Cu 0.954817 0.414522 1.12045e-15 930 63.546 0.00182288 -3.51189 63.546000 Cu 0.947036 0.39917 0.5 931 63.546 0.00127678 -3.51198 63.546000 Cu 0.893073 0.416611 0.5 932 63.546 0.0035893 -3.51267 63.546000 Cu 0.0249295 0.427653 1.07908e-16 965 63.546 0.00314117 -3.50979 63.546000 Cu 0.0943622 0.441077 1 966 63.546 0.0173125 -3.50466 63.546000 Cu 0.0863509 0.425653 0.5 967 63.546 0.00704837 -3.50866 63.546000 Cu 0.0337544 0.442965 0.5 968 63.546 0.0139407 -3.50787 63.546000 Cu 0.215313 0.437653 2.12377e-16 970 63.546 0.00330402 -3.50956 63.546000 Cu 0.154657 0.439335 0.5 972 63.546 0.0108125 -3.50641 63.546000 Cu 0.221246 0.453313 0.5 1003 63.546 0.0256995 -3.50515 63.546000 Cu 0.338589 0.434009 4.28916e-16 974 63.546 0.0108578 -3.51362 63.546000 Cu 0.276618 0.43592 0.5 976 63.546 0.00680551 -3.51237 63.546000 Cu 0.282734 0.451367 5.25363e-16 1005 63.546 0.0294208 -3.5119 63.546000 Cu 0.345672 0.449226 0.5 1007 63.546 0.0206288 -3.5118 63.546000 Cu 0.46312 0.429782 8.54937e-16 978 63.546 0.00181256 -3.51188 63.546000 Cu 0.400901 0.43194 0.5 980 63.546 0.00728115 -3.51325 63.546000 Cu 0.409105 0.447051 3.29694e-16 1009 63.546 0.00997439 -3.51111 63.546000 Cu 0.472047 0.444959 0.5 1011 63.546 0.0100478 -3.51052 63.546000 Cu 0.586351 0.425653 1 982 63.546 0.00704837 -3.50866 63.546000 Cu 0.524929 0.427653 0.5 984 63.546 0.00314117 -3.50979 63.546000 Cu 0.533754 0.442965 1 1013 63.546 0.0139407 -3.50787 63.546000 Cu 0.594362 0.441077 0.5 1015 63.546 0.0173125 -3.50466 63.546000 Cu 0.721246 0.453313 1 955 63.546 0.0256995 -3.50515 63.546000 Cu 0.715313 0.437653 0.5 956 63.546 0.00330402 -3.50956 63.546000 Cu 0.654657 0.439335 1 1017 63.546 0.0108125 -3.50641 63.546000 Cu 0.776618 0.43592 1 957 63.546 0.00680551 -3.51237 63.546000 Cu 0.845672 0.449226 1 958 63.546 0.0206288 -3.5118 63.546000 Cu 0.838589 0.434009 0.5 959 63.546 0.0108578 -3.51362 63.546000 Cu 0.782734 0.451367 0.5 960 63.546 0.0294208 -3.5119 63.546000 Cu 0.900901 0.43194 1 961 63.546 0.00728115 -3.51325 63.546000 Cu 0.972047 0.444959 4.91525e-16 962 63.546 0.0100478 -3.51052 63.546000 Cu 0.96312 0.429782 0.5 963 63.546 0.00181256 -3.51188 63.546000 Cu 0.909105 0.447051 0.5 964 63.546 0.00997439 -3.51111 63.546000 Cu 0.0429434 0.458448 6.07998e-17 997 63.546 0.0489012 -3.50276 63.546000 Cu 0.110902 0.473175 4.84046e-16 998 63.546 0.0632275 -3.49161 63.546000 Cu 0.102552 0.456873 0.5 999 63.546 0.0223665 -3.49748 63.546000 Cu 0.0512554 0.474188 0.5 1000 63.546 0.0831922 -3.50168 63.546000 Cu 0.16137 0.455112 4.29218e-16 1001 63.546 0.0268067 -3.4969 63.546000 Cu 0.22671 0.469149 1.56801e-15 1002 63.546 0.173948 -3.4815 63.546000 Cu 0.168476 0.47141 0.5 1004 63.546 0.0479126 -3.47184 63.546000 Cu 0.352994 0.464045 1 1006 63.546 0.0207029 -3.50205 63.546000 Cu 0.288779 0.466596 0.5 1008 63.546 0.0980812 -3.50083 63.546000 Cu 0.295302 0.481207 1 1031 63.546 0.558866 -3.42833 63.546000 Cu 0.36114 0.478358 0.5 1033 63.546 0.0390334 -3.48528 63.546000 Cu 0.489737 0.475076 0.5 522 63.546 0.112762 -3.49583 63.546000 Cu 0.481162 0.460048 1.37855e-15 1010 63.546 0.040792 -3.50637 63.546000 Cu 0.417709 0.461864 0.5 1012 63.546 0.0193365 -3.50408 63.546000 Cu 0.425691 0.476434 1 1035 63.546 0.0566172 -3.49556 63.546000 Cu 0.610902 0.473175 0.5 10 63.546 0.0632275 -3.49161 63.546000 Cu 0.551255 0.474188 1 23 63.546 0.0831922 -3.50168 63.546000 Cu 0.602552 0.456873 1 1014 63.546 0.0223665 -3.49748 63.546000 Cu 0.542943 0.458448 0.5 1016 63.546 0.0489012 -3.50276 63.546000 Cu 0.66137 0.455112 0.5 1018 63.546 0.0268067 -3.4969 63.546000 Cu 0.668476 0.47141 1.13276e-16 7 63.546 0.0479126 -3.47184 63.546000 Cu 0.72671 0.469149 0.5 988 63.546 0.173948 -3.4815 63.546000 Cu 0.788779 0.466596 1 989 63.546 0.0980812 -3.50083 63.546000 Cu 0.86114 0.478358 1.29381e-15 990 63.546 0.0390334 -3.48528 63.546000 Cu 0.852994 0.464045 0.5 991 63.546 0.0207029 -3.50205 63.546000 Cu 0.795302 0.481207 0.5 992 63.546 0.558866 -3.42833 63.546000 Cu 0.917709 0.461864 1 993 63.546 0.0193365 -3.50408 63.546000 Cu 0.989737 0.475076 1.48779e-15 994 63.546 0.112762 -3.49583 63.546000 Cu 0.981162 0.460048 0.5 995 63.546 0.040792 -3.50637 63.546000 Cu 0.925691 0.476434 0.5 996 63.546 0.0566172 -3.49556 63.546000 Cu 0.121479 0.505739 3.25472e-16 5 63.546 0.260287 -3.49399 63.546000 Cu 0.0588614 0.505757 0.5 6 63.546 0.0795167 -3.5081 63.546000 Cu 0.0569593 0.490045 1 1025 63.546 0.0870761 -3.50745 63.546000 Cu 0.118192 0.489588 0.5 1026 63.546 0.172078 -3.49426 63.546000 Cu 0.177463 0.48866 8.14283e-17 1027 63.546 0.318993 -3.44867 63.546000 Cu 0.233386 0.48539 0.5 1029 63.546 0.660015 -3.41526 63.546000 Cu 0.185994 0.505731 0.5 1030 63.546 1.91084 -3.43747 63.546000 Cu 0.249279 0.50323 1 1028 63.546 5.95448 -3.34269 63.546000 Cu 0.367593 0.492436 1.04162e-15 1032 63.546 4.20938 -3.40086 63.546000 Cu 0.305389 0.49516 0.5 1034 63.546 8.48465 -3.25152 63.546000 Cu 0.376501 0.505682 0.5 12 63.546 5.89254 -3.18605 63.546000 Cu 0.436242 0.505715 1 13 63.546 0.397722 -3.48614 63.546000 Cu 0.497062 0.505744 0.5 15 63.546 0.0708138 -3.5109 63.546000 Cu 0.43352 0.49074 0.5 515 63.546 0.292791 -3.47032 63.546000 Cu 0.495446 0.490334 1 1036 63.546 0.111785 -3.50264 63.546000 Cu 0.556959 0.490045 0.5 8 63.546 0.0870761 -3.50745 63.546000 Cu 0.558861 0.505757 1 17 63.546 0.0795167 -3.5081 63.546000 Cu 0.621479 0.505739 0.5 19 63.546 0.260287 -3.49399 63.546000 Cu 0.618192 0.489588 1.72869e-16 21 63.546 0.172078 -3.49426 63.546000 Cu 0.677463 0.48866 0.5 2 63.546 0.318993 -3.44867 63.546000 Cu 0.733386 0.48539 8.13318e-16 987 63.546 0.660015 -3.41526 63.546000 Cu 0.685994 0.505731 2.90488e-16 1019 63.546 1.91084 -3.43747 63.546000 Cu 0.749279 0.50323 0.5 1020 63.546 5.95448 -3.34269 63.546000 Cu 0.805389 0.49516 1 1021 63.546 8.48465 -3.25152 63.546000 Cu 0.867593 0.492436 0.5 1022 63.546 4.20938 -3.40086 63.546000 Cu 0.876501 0.505682 1 1 63.546 5.89254 -3.18605 63.546000 Cu 0.997062 0.505744 1.85053e-16 3 63.546 0.0708138 -3.5109 63.546000 Cu 0.936242 0.505715 0.5 4 63.546 0.397722 -3.48614 63.546000 Cu 0.93352 0.49074 1 1023 63.546 0.292791 -3.47032 63.546000 Cu 0.995446 0.490334 0.5 1024 63.546 0.111785 -3.50264 63.546000 Cu 0.0565912 0.52145 1 33 63.546 0.0948557 -3.50577 63.546000 Cu 0.11006 0.538317 1 34 63.546 0.0764803 -3.48787 63.546000 Cu 0.118022 0.521918 0.5 35 63.546 0.199258 -3.49077 63.546000 Cu 0.0503202 0.53728 0.5 36 63.546 0.091909 -3.49994 63.546000 Cu 0.177355 0.522757 6.88884e-16 37 63.546 0.631645 -3.40554 63.546000 Cu 0.225822 0.542465 1 38 63.546 0.165826 -3.48138 63.546000 Cu 0.232671 0.52648 0.5 39 63.546 1.89561 -3.326 63.546000 Cu 0.167333 0.540231 0.5 40 63.546 0.0792068 -3.46629 63.546000 Cu 0.302045 0.515521 0.5 9 63.546 9.9495 -3.25925 63.546000 Cu 0.365716 0.518683 4.68665e-17 11 63.546 4.5565 -3.3851 63.546000 Cu 0.294342 0.530104 1 41 63.546 1.45834 -3.40306 63.546000 Cu 0.359215 0.532721 0.5 44 63.546 0.0241967 -3.4912 63.546000 Cu 0.287789 0.544912 0.5 42 63.546 0.0588013 -3.50231 63.546000 Cu 0.494891 0.521127 1 14 63.546 0.126512 -3.49977 63.546000 Cu 0.432746 0.520643 0.5 16 63.546 0.346381 -3.45925 63.546000 Cu 0.42395 0.534813 1 45 63.546 0.0448097 -3.49419 63.546000 Cu 0.488522 0.536325 0.5 47 63.546 0.117254 -3.49197 63.546000 Cu 0.618022 0.521918 4.00145e-16 18 63.546 0.199258 -3.49077 63.546000 Cu 0.556591 0.52145 0.5 20 63.546 0.0948557 -3.50577 63.546000 Cu 0.55032 0.53728 1.11364e-15 49 63.546 0.091909 -3.49994 63.546000 Cu 0.61006 0.538317 0.5 51 63.546 0.0764803 -3.48787 63.546000 Cu 0.732671 0.52648 1 22 63.546 1.89561 -3.326 63.546000 Cu 0.677355 0.522757 0.5 24 63.546 0.631645 -3.40554 63.546000 Cu 0.667333 0.540231 3.3464e-16 53 63.546 0.0792068 -3.46629 63.546000 Cu 0.725822 0.542465 0.5 55 63.546 0.165826 -3.48138 63.546000 Cu 0.802045 0.515521 1 25 63.546 9.9495 -3.25925 63.546000 Cu 0.859215 0.532721 1 26 63.546 0.0241967 -3.4912 63.546000 Cu 0.865716 0.518683 0.5 27 63.546 4.5565 -3.3851 63.546000 Cu 0.794342 0.530104 0.5 28 63.546 1.45834 -3.40306 63.546000 Cu 0.787789 0.544912 1 57 63.546 0.0588013 -3.50231 63.546000 Cu 0.932746 0.520643 1 29 63.546 0.346381 -3.45925 63.546000 Cu 0.988522 0.536325 1 30 63.546 0.117254 -3.49197 63.546000 Cu 0.994891 0.521127 0.5 31 63.546 0.126512 -3.49977 63.546000 Cu 0.92395 0.534813 0.5 32 63.546 0.0448097 -3.49419 63.546000 Cu 0.0413463 0.552976 1 65 63.546 0.0468006 -3.50179 63.546000 Cu 0.0925673 0.570366 3.94897e-16 66 63.546 0.0161611 -3.50486 63.546000 Cu 0.101082 0.554641 0.5 67 63.546 0.0263553 -3.49682 63.546000 Cu 0.0317439 0.568417 0.5 68 63.546 0.00898479 -3.50804 63.546000 Cu 0.160056 0.556434 1 69 63.546 0.0297432 -3.49819 63.546000 Cu 0.213869 0.573851 1 70 63.546 0.00252903 -3.51016 63.546000 Cu 0.220108 0.558234 0.5 71 63.546 0.0198804 -3.50701 63.546000 Cu 0.15308 0.572152 0.5 72 63.546 0.0107387 -3.50696 63.546000 Cu 0.351577 0.547263 1 43 63.546 0.015481 -3.50712 63.546000 Cu 0.281592 0.560149 1 73 63.546 0.0194172 -3.51242 63.546000 Cu 0.344318 0.562211 0.5 76 63.546 0.0149849 -3.51264 63.546000 Cu 0.275178 0.575601 0.5 74 63.546 0.00449122 -3.5127 63.546000 Cu 0.479375 0.551274 1 46 63.546 0.0329242 -3.50658 63.546000 Cu 0.415829 0.549399 0.5 48 63.546 0.0139395 -3.50704 63.546000 Cu 0.407376 0.564315 1 77 63.546 0.00949198 -3.51228 63.546000 Cu 0.470058 0.566387 0.5 79 63.546 0.00696094 -3.51128 63.546000 Cu 0.601082 0.554641 4.10459e-16 50 63.546 0.0263553 -3.49682 63.546000 Cu 0.541346 0.552976 0.5 52 63.546 0.0468006 -3.50179 63.546000 Cu 0.531744 0.568417 1 81 63.546 0.00898479 -3.50804 63.546000 Cu 0.592567 0.570366 0.5 83 63.546 0.0161611 -3.50486 63.546000 Cu 0.720108 0.558234 1 54 63.546 0.0198804 -3.50701 63.546000 Cu 0.660056 0.556434 0.5 56 63.546 0.0297432 -3.49819 63.546000 Cu 0.65308 0.572152 3.04723e-16 85 63.546 0.0107387 -3.50696 63.546000 Cu 0.713869 0.573851 0.5 87 63.546 0.00252903 -3.51016 63.546000 Cu 0.844318 0.562211 1 58 63.546 0.0149849 -3.51264 63.546000 Cu 0.851577 0.547263 0.5 59 63.546 0.015481 -3.50712 63.546000 Cu 0.781592 0.560149 0.5 60 63.546 0.0194172 -3.51242 63.546000 Cu 0.775178 0.575601 1 89 63.546 0.00449122 -3.5127 63.546000 Cu 0.915829 0.549399 8.69172e-16 61 63.546 0.0139395 -3.50704 63.546000 Cu 0.970058 0.566387 1.24012e-16 62 63.546 0.00696094 -3.51128 63.546000 Cu 0.979375 0.551274 0.5 63 63.546 0.0329242 -3.50658 63.546000 Cu 0.907376 0.564315 0.5 64 63.546 0.00949198 -3.51228 63.546000 Cu 0.0227835 0.583724 1 97 63.546 0.00147994 -3.51003 63.546000 Cu 0.076108 0.60102 1.24435e-16 98 63.546 0.000546189 -3.5108 63.546000 Cu 0.0842676 0.585743 0.5 99 63.546 0.00438811 -3.50886 63.546000 Cu 0.0143802 0.59901 0.5 100 63.546 0.000593801 -3.51125 63.546000 Cu 0.145631 0.587607 1 101 63.546 0.0042841 -3.50943 63.546000 Cu 0.199319 0.60479 1 102 63.546 0.00148918 -3.51087 63.546000 Cu 0.206913 0.58936 0.5 103 63.546 0.00190792 -3.51056 63.546000 Cu 0.137781 0.602948 0.5 104 63.546 0.00124076 -3.5108 63.546000 Cu 0.337001 0.577486 1 75 63.546 0.00787926 -3.51363 63.546000 Cu 0.268181 0.591104 1 105 63.546 0.00120686 -3.51166 63.546000 Cu 0.329542 0.592939 0.5 108 63.546 0.00210758 -3.51249 63.546000 Cu 0.461072 0.58162 1 78 63.546 0.00158333 -3.51206 63.546000 Cu 0.399073 0.579516 0.5 80 63.546 0.00535148 -3.51334 63.546000 Cu 0.391046 0.594894 5.68912e-16 109 63.546 0.00231134 -3.51264 63.546000 Cu 0.45268 0.596944 0.5 111 63.546 0.00124796 -3.51205 63.546000 Cu 0.584268 0.585743 1.07467e-15 82 63.546 0.00438811 -3.50886 63.546000 Cu 0.522784 0.583724 0.5 84 63.546 0.00147994 -3.51003 63.546000 Cu 0.51438 0.59901 1 113 63.546 0.000593801 -3.51125 63.546000 Cu 0.576108 0.60102 0.5 115 63.546 0.000546189 -3.5108 63.546000 Cu 0.706913 0.58936 4.55999e-17 86 63.546 0.00190792 -3.51056 63.546000 Cu 0.645631 0.587607 0.5 88 63.546 0.0042841 -3.50943 63.546000 Cu 0.637781 0.602948 1 117 63.546 0.00124076 -3.5108 63.546000 Cu 0.699319 0.60479 0.5 119 63.546 0.00148918 -3.51087 63.546000 Cu 0.829542 0.592939 6.41776e-16 90 63.546 0.00210758 -3.51249 63.546000 Cu 0.837001 0.577486 0.5 91 63.546 0.00787926 -3.51363 63.546000 Cu 0.768181 0.591104 0.5 92 63.546 0.00120686 -3.51166 63.546000 Cu 0.899073 0.579516 6.03173e-20 93 63.546 0.00535148 -3.51334 63.546000 Cu 0.95268 0.596944 0 94 63.546 0.00124796 -3.51205 63.546000 Cu 0.961072 0.58162 0.5 95 63.546 0.00158333 -3.51206 63.546000 Cu 0.891046 0.594894 0.5 96 63.546 0.00231134 -3.51264 63.546000 Cu 0.00633302 0.614326 5.09198e-16 129 63.546 0.000418272 -3.51173 63.546000 Cu 0.060037 0.631653 1 130 63.546 0.000173253 -3.51195 63.546000 Cu 0.0680534 0.616317 0.5 131 63.546 9.63283e-05 -3.5117 63.546000 Cu 0.121714 0.633613 0.5 136 63.546 4.40506e-05 -3.51176 63.546000 Cu 0.129758 0.618269 1 133 63.546 0.000238747 -3.51155 63.546000 Cu 0.191362 0.620183 0.5 135 63.546 0.000582409 -3.51128 63.546000 Cu 0.183313 0.635554 1 134 63.546 0.000118249 -3.5114 63.546000 Cu 0.260632 0.606601 0.5 106 63.546 0.000539996 -3.51112 63.546000 Cu 0.321897 0.608443 2.95494e-16 107 63.546 0.000260472 -3.51159 63.546000 Cu 0.252798 0.622059 1 137 63.546 0.000443096 -3.51105 63.546000 Cu 0.314121 0.623925 0.5 140 63.546 0.000121247 -3.51123 63.546000 Cu 0.375482 0.625811 1.75041e-16 141 63.546 0.000114556 -3.51156 63.546000 Cu 0.444707 0.612323 1 110 63.546 0.000785376 -3.5119 63.546000 Cu 0.383213 0.610353 0.5 112 63.546 0.000649881 -3.5119 63.546000 Cu 0.436908 0.627738 0.5 143 63.546 0.000242296 -3.51184 63.546000 Cu 0.498431 0.62969 1 145 63.546 0.000282016 -3.51195 63.546000 Cu 0.568053 0.616317 4.34888e-16 114 63.546 9.63283e-05 -3.5117 63.546000 Cu 0.506333 0.614326 0.5 116 63.546 0.000418272 -3.51173 63.546000 Cu 0.560037 0.631653 0.5 147 63.546 0.000173253 -3.51195 63.546000 Cu 0.621714 0.633613 1 149 63.546 4.40506e-05 -3.51176 63.546000 Cu 0.691362 0.620183 1 118 63.546 0.000582409 -3.51128 63.546000 Cu 0.629758 0.618269 0.5 120 63.546 0.000238747 -3.51155 63.546000 Cu 0.683313 0.635554 0.5 151 63.546 0.000118249 -3.5114 63.546000 Cu 0.760632 0.606601 1 121 63.546 0.000539996 -3.51112 63.546000 Cu 0.814121 0.623925 1 122 63.546 0.000121247 -3.51123 63.546000 Cu 0.821897 0.608443 0.5 123 63.546 0.000260472 -3.51159 63.546000 Cu 0.752798 0.622059 0.5 124 63.546 0.000443096 -3.51105 63.546000 Cu 0.875482 0.625811 0.5 128 63.546 0.000114556 -3.51156 63.546000 Cu 0.883213 0.610353 1 125 63.546 0.000649881 -3.5119 63.546000 Cu 0.936908 0.627738 1 126 63.546 0.000242296 -3.51184 63.546000 Cu 0.944707 0.612323 0.5 127 63.546 0.000785376 -3.5119 63.546000 Cu 0.998431 0.62969 0.5 132 63.546 0.000282016 -3.51195 63.546000 Cu 0.0442082 0.662424 1.29622e-16 162 63.546 2.36731e-05 -3.51168 63.546000 Cu 0.0521123 0.64703 0.5 163 63.546 8.26145e-05 -3.51185 63.546000 Cu 0.113678 0.648975 1 165 63.546 6.67783e-05 -3.51172 63.546000 Cu 0.105752 0.664356 0.5 168 63.546 2.66411e-05 -3.51173 63.546000 Cu 0.244845 0.637469 0.5 139 63.546 0.000258372 -3.51114 63.546000 Cu 0.175272 0.650918 0.5 167 63.546 2.48003e-05 -3.51148 63.546000 Cu 0.236849 0.652845 6.5969e-16 169 63.546 4.35481e-05 -3.51128 63.546000 Cu 0.167315 0.666287 2.6624e-16 166 63.546 3.03018e-05 -3.51165 63.546000 Cu 0.306294 0.639361 5.41046e-16 138 63.546 0.000173439 -3.51119 63.546000 Cu 0.367709 0.641256 0.5 144 63.546 7.78791e-05 -3.5114 63.546000 Cu 0.298361 0.654761 0.5 171 63.546 6.08728e-05 -3.51118 63.546000 Cu 0.359826 0.656669 1 173 63.546 4.48802e-05 -3.51114 63.546000 Cu 0.429108 0.643166 7.22963e-16 142 63.546 4.98126e-05 -3.51158 63.546000 Cu 0.49058 0.645091 0.5 148 63.546 6.11063e-05 -3.5118 63.546000 Cu 0.421266 0.658574 0.5 175 63.546 1.38604e-05 -3.51127 63.546000 Cu 0.482725 0.660493 1 177 63.546 1.29234e-05 -3.51152 63.546000 Cu 0.552112 0.64703 1.21841e-17 146 63.546 8.26145e-05 -3.51185 63.546000 Cu 0.613678 0.648975 0.5 152 63.546 6.67783e-05 -3.51172 63.546000 Cu 0.544208 0.662424 0.5 179 63.546 2.36731e-05 -3.51168 63.546000 Cu 0.605752 0.664356 4.73551e-16 181 63.546 2.66411e-05 -3.51173 63.546000 Cu 0.675272 0.650918 1 150 63.546 2.48003e-05 -3.51148 63.546000 Cu 0.744845 0.637469 1 153 63.546 0.000258372 -3.51114 63.546000 Cu 0.736849 0.652845 0.5 156 63.546 4.35481e-05 -3.51128 63.546000 Cu 0.667315 0.666287 0.5 183 63.546 3.03018e-05 -3.51165 63.546000 Cu 0.798361 0.654761 7.56921e-16 154 63.546 6.08728e-05 -3.51118 63.546000 Cu 0.806294 0.639361 0.5 155 63.546 0.000173439 -3.51119 63.546000 Cu 0.867709 0.641256 8.96857e-16 157 63.546 7.78791e-05 -3.5114 63.546000 Cu 0.859826 0.656669 0.5 160 63.546 4.48802e-05 -3.51114 63.546000 Cu 0.921266 0.658574 3.16062e-17 158 63.546 1.38604e-05 -3.51127 63.546000 Cu 0.929108 0.643166 0.5 159 63.546 4.98126e-05 -3.51158 63.546000 Cu 0.99058 0.645091 1 161 63.546 6.11063e-05 -3.5118 63.546000 Cu 0.982725 0.660493 0.5 164 63.546 1.29234e-05 -3.51152 63.546000 Cu 0.0284743 0.693219 4.97437e-16 194 63.546 1.92065e-05 -3.51159 63.546000 Cu 0.0363268 0.677822 0.5 195 63.546 1.45985e-05 -3.51175 63.546000 Cu 0.0978718 0.679748 1 197 63.546 5.51847e-06 -3.51178 63.546000 Cu 0.0900187 0.695142 0.5 200 63.546 1.14364e-05 -3.51159 63.546000 Cu 0.228875 0.668219 0.5 172 63.546 1.86171e-05 -3.51156 63.546000 Cu 0.15942 0.681676 0.5 199 63.546 7.57195e-06 -3.51174 63.546000 Cu 0.220972 0.683605 2.49713e-17 201 63.546 5.43686e-06 -3.5117 63.546000 Cu 0.290413 0.670143 1 170 63.546 1.57352e-05 -3.5114 63.546000 Cu 0.351915 0.672057 0.5 176 63.546 1.97686e-05 -3.51131 63.546000 Cu 0.282507 0.685532 0.5 203 63.546 1.35434e-05 -3.51162 63.546000 Cu 0.343989 0.687457 1 205 63.546 3.5722e-06 -3.51154 63.546000 Cu 0.413373 0.673974 3.10815e-16 174 63.546 9.16449e-06 -3.5114 63.546000 Cu 0.474825 0.675897 0.5 180 63.546 1.23048e-05 -3.5116 63.546000 Cu 0.405446 0.689378 0.5 207 63.546 2.7859e-05 -3.51149 63.546000 Cu 0.466935 0.691298 7.74715e-16 209 63.546 4.54986e-05 -3.51154 63.546000 Cu 0.536327 0.677822 5.34411e-16 178 63.546 1.45985e-05 -3.51175 63.546000 Cu 0.597872 0.679748 0.5 184 63.546 5.51847e-06 -3.51178 63.546000 Cu 0.528474 0.693219 0.5 211 63.546 1.92065e-05 -3.51159 63.546000 Cu 0.590019 0.695142 1 213 63.546 1.14364e-05 -3.51159 63.546000 Cu 0.65942 0.681676 1 182 63.546 7.57195e-06 -3.51174 63.546000 Cu 0.728875 0.668219 1 185 63.546 1.86171e-05 -3.51156 63.546000 Cu 0.720972 0.683605 0.5 188 63.546 5.43686e-06 -3.5117 63.546000 Cu 0.782507 0.685532 2.49171e-16 186 63.546 1.35434e-05 -3.51162 63.546000 Cu 0.790413 0.670143 0.5 187 63.546 1.57352e-05 -3.5114 63.546000 Cu 0.851915 0.672057 1 189 63.546 1.97686e-05 -3.51131 63.546000 Cu 0.843989 0.687457 0.5 192 63.546 3.5722e-06 -3.51154 63.546000 Cu 0.905446 0.689378 4.52741e-16 190 63.546 2.7859e-05 -3.51149 63.546000 Cu 0.913373 0.673974 0.5 191 63.546 9.16449e-06 -3.5114 63.546000 Cu 0.974825 0.675897 1 193 63.546 1.23048e-05 -3.5116 63.546000 Cu 0.966935 0.691298 0.5 196 63.546 4.54986e-05 -3.51154 63.546000 Cu 0.0129105 0.723992 1.02901e-15 226 63.546 3.24779e-05 -3.51164 63.546000 Cu 0.0206616 0.708601 0.5 227 63.546 2.16423e-05 -3.51142 63.546000 Cu 0.0822117 0.710524 4.4683e-16 229 63.546 1.53217e-05 -3.51141 63.546000 Cu 0.0744017 0.725913 0.5 232 63.546 3.36976e-05 -3.51156 63.546000 Cu 0.15157 0.697068 1 198 63.546 6.98243e-06 -3.5116 63.546000 Cu 0.213093 0.698997 0.5 204 63.546 7.46596e-06 -3.51164 63.546000 Cu 0.143737 0.712456 0.5 231 63.546 7.6971e-06 -3.51147 63.546000 Cu 0.205223 0.714392 1 233 63.546 1.86405e-05 -3.51157 63.546000 Cu 0.27459 0.700929 1 202 63.546 1.00007e-05 -3.51164 63.546000 Cu 0.336072 0.702857 0.5 208 63.546 5.60539e-05 -3.51156 63.546000 Cu 0.266725 0.716327 0.5 235 63.546 8.19431e-05 -3.51166 63.546000 Cu 0.32826 0.718251 3.1184e-16 237 63.546 7.87291e-05 -3.51168 63.546000 Cu 0.397582 0.704773 1.02165e-15 206 63.546 5.76063e-05 -3.51149 63.546000 Cu 0.459109 0.706685 0.5 212 63.546 4.33916e-05 -3.51145 63.546000 Cu 0.389822 0.720167 0.5 239 63.546 2.62468e-05 -3.51169 63.546000 Cu 0.451381 0.722079 1.40781e-16 241 63.546 1.12252e-05 -3.51168 63.546000 Cu 0.520662 0.708601 2.10809e-16 210 63.546 2.16423e-05 -3.51142 63.546000 Cu 0.582212 0.710524 0.5 216 63.546 1.53217e-05 -3.51141 63.546000 Cu 0.51291 0.723992 0.5 243 63.546 3.24779e-05 -3.51164 63.546000 Cu 0.574402 0.725913 4.68665e-17 245 63.546 3.36976e-05 -3.51156 63.546000 Cu 0.643737 0.712456 7.50528e-16 214 63.546 7.6971e-06 -3.51147 63.546000 Cu 0.65157 0.697068 0.5 215 63.546 6.98243e-06 -3.5116 63.546000 Cu 0.713093 0.698997 3.33735e-16 217 63.546 7.46596e-06 -3.51164 63.546000 Cu 0.705223 0.714392 0.5 220 63.546 1.86405e-05 -3.51157 63.546000 Cu 0.766725 0.716327 1 218 63.546 8.19431e-05 -3.51166 63.546000 Cu 0.77459 0.700929 0.5 219 63.546 1.00007e-05 -3.51164 63.546000 Cu 0.836072 0.702857 3.07256e-16 221 63.546 5.60539e-05 -3.51156 63.546000 Cu 0.82826 0.718251 0.5 224 63.546 7.87291e-05 -3.51168 63.546000 Cu 0.889822 0.720167 1 222 63.546 2.62468e-05 -3.51169 63.546000 Cu 0.897582 0.704773 0.5 223 63.546 5.76063e-05 -3.51149 63.546000 Cu 0.959109 0.706685 1 225 63.546 4.33916e-05 -3.51145 63.546000 Cu 0.951381 0.722079 0.5 228 63.546 1.12252e-05 -3.51168 63.546000 Cu 0.0051614 0.739401 0.5 259 63.546 6.76045e-06 -3.5116 63.546000 Cu 0.066633 0.741319 5.69516e-16 261 63.546 4.29619e-05 -3.51156 63.546000 Cu 0.0589669 0.756721 0.5 264 63.546 1.39848e-05 -3.51159 63.546000 Cu 0.135883 0.727844 1 230 63.546 5.32753e-05 -3.5115 63.546000 Cu 0.197408 0.729779 0.5 236 63.546 6.28458e-05 -3.51147 63.546000 Cu 0.128132 0.743237 0.5 263 63.546 8.34258e-05 -3.51155 63.546000 Cu 0.189692 0.745158 1 265 63.546 4.6235e-05 -3.51154 63.546000 Cu 0.25898 0.731712 1 234 63.546 3.23893e-05 -3.51151 63.546000 Cu 0.320576 0.73364 0.5 240 63.546 2.21393e-05 -3.51157 63.546000 Cu 0.251281 0.747084 0.5 267 63.546 1.59323e-05 -3.5115 63.546000 Cu 0.312876 0.749015 1.0152e-15 270 63.546 1.28598e-05 -3.51146 63.546000 Cu 0.374432 0.750947 0.5 272 63.546 1.24241e-05 -3.51145 63.546000 Cu 0.382149 0.735563 1 238 63.546 3.1964e-05 -3.51163 63.546000 Cu 0.443682 0.737482 0.5 244 63.546 2.44242e-05 -3.51163 63.546000 Cu 0.435954 0.752877 4.78738e-16 273 63.546 1.57579e-05 -3.51146 63.546000 Cu 0.49745 0.754802 0.5 275 63.546 2.24787e-05 -3.5115 63.546000 Cu 0.505161 0.739401 7.2441e-16 242 63.546 6.76045e-06 -3.5116 63.546000 Cu 0.566633 0.741319 0.5 248 63.546 4.29619e-05 -3.51156 63.546000 Cu 0.558967 0.756721 1.14603e-16 277 63.546 1.39848e-05 -3.51159 63.546000 Cu 0.628132 0.743237 9.65076e-17 246 63.546 8.34258e-05 -3.51155 63.546000 Cu 0.635883 0.727844 0.5 247 63.546 5.32753e-05 -3.5115 63.546000 Cu 0.697408 0.729779 8.54394e-16 249 63.546 6.28458e-05 -3.51147 63.546000 Cu 0.689692 0.745158 0.5 252 63.546 4.6235e-05 -3.51154 63.546000 Cu 0.751281 0.747084 4.05935e-16 250 63.546 1.59323e-05 -3.5115 63.546000 Cu 0.75898 0.731712 0.5 251 63.546 3.23893e-05 -3.51151 63.546000 Cu 0.820576 0.73364 1.27873e-17 253 63.546 2.21393e-05 -3.51157 63.546000 Cu 0.874432 0.750947 1 254 63.546 1.24241e-05 -3.51145 63.546000 Cu 0.812876 0.749015 0.5 256 63.546 1.28598e-05 -3.51146 63.546000 Cu 0.882149 0.735563 0.5 255 63.546 3.1964e-05 -3.51163 63.546000 Cu 0.943682 0.737482 1.11364e-15 257 63.546 2.44242e-05 -3.51163 63.546000 Cu 0.99745 0.754802 1 258 63.546 2.24787e-05 -3.5115 63.546000 Cu 0.935954 0.752877 0.5 260 63.546 1.57579e-05 -3.51146 63.546000 Cu 0.1205 0.758635 3.90313e-16 262 63.546 8.87275e-06 -3.5117 63.546000 Cu 0.0513309 0.772124 1 293 63.546 2.81946e-05 -3.51165 63.546000 Cu 0.112886 0.774039 0.5 295 63.546 1.60406e-05 -3.51167 63.546000 Cu 0.0437249 0.787514 0.5 296 63.546 4.11463e-05 -3.51143 63.546000 Cu 0.243602 0.762468 3.57862e-16 266 63.546 4.11861e-05 -3.51166 63.546000 Cu 0.182054 0.760549 0.5 268 63.546 1.52213e-05 -3.51174 63.546000 Cu 0.174443 0.77595 6.77363e-16 297 63.546 6.86604e-06 -3.51166 63.546000 Cu 0.236001 0.777867 0.5 299 63.546 9.96421e-06 -3.51162 63.546000 Cu 0.305147 0.764394 0.5 269 63.546 6.06975e-05 -3.51155 63.546000 Cu 0.366688 0.766329 5.45147e-16 271 63.546 4.42788e-05 -3.51147 63.546000 Cu 0.297526 0.779792 1 301 63.546 1.4532e-05 -3.51164 63.546000 Cu 0.359054 0.781724 0.5 304 63.546 1.90371e-05 -3.51166 63.546000 Cu 0.489787 0.7702 9.95235e-17 274 63.546 2.12978e-05 -3.51157 63.546000 Cu 0.428235 0.768267 0.5 276 63.546 2.02609e-05 -3.5115 63.546000 Cu 0.420581 0.78366 1 305 63.546 5.23132e-05 -3.51164 63.546000 Cu 0.482149 0.785592 0.5 307 63.546 5.62961e-05 -3.51154 63.546000 Cu 0.612886 0.774039 2.6244e-16 278 63.546 1.60406e-05 -3.51167 63.546000 Cu 0.6205 0.758635 0.5 279 63.546 8.87275e-06 -3.5117 63.546000 Cu 0.551331 0.772124 0.5 280 63.546 2.81946e-05 -3.51165 63.546000 Cu 0.543725 0.787514 6.93166e-16 309 63.546 4.11463e-05 -3.51143 63.546000 Cu 0.682054 0.760549 3.28126e-17 281 63.546 1.52213e-05 -3.51174 63.546000 Cu 0.736001 0.777867 1.31612e-15 282 63.546 9.96421e-06 -3.51162 63.546000 Cu 0.743602 0.762468 0.5 283 63.546 4.11861e-05 -3.51166 63.546000 Cu 0.674443 0.77595 0.5 284 63.546 6.86604e-06 -3.51166 63.546000 Cu 0.805147 0.764394 1 285 63.546 6.06975e-05 -3.51155 63.546000 Cu 0.859054 0.781724 8.61572e-16 286 63.546 1.90371e-05 -3.51166 63.546000 Cu 0.866688 0.766329 0.5 287 63.546 4.42788e-05 -3.51147 63.546000 Cu 0.797526 0.779792 0.5 288 63.546 1.4532e-05 -3.51164 63.546000 Cu 0.928235 0.768267 3.98275e-16 289 63.546 2.02609e-05 -3.5115 63.546000 Cu 0.982149 0.785592 1 290 63.546 5.62961e-05 -3.51154 63.546000 Cu 0.989787 0.7702 0.5 291 63.546 2.12978e-05 -3.51157 63.546000 Cu 0.920581 0.78366 0.5 292 63.546 5.23132e-05 -3.51164 63.546000 Cu 0.105323 0.789431 1 294 63.546 7.4972e-06 -3.51141 63.546000 Cu 0.0362294 0.8029 1 325 63.546 2.21252e-05 -3.51153 63.546000 Cu 0.097783 0.804821 0.5 327 63.546 2.32595e-05 -3.51149 63.546000 Cu 0.228415 0.793269 4.46589e-16 298 63.546 6.7825e-06 -3.51159 63.546000 Cu 0.166878 0.791347 0.5 300 63.546 9.60504e-06 -3.51147 63.546000 Cu 0.159302 0.806744 1 329 63.546 5.29228e-06 -3.51149 63.546000 Cu 0.220808 0.808672 0.5 331 63.546 3.64138e-05 -3.51156 63.546000 Cu 0.289927 0.7952 0.5 302 63.546 9.46491e-06 -3.51168 63.546000 Cu 0.351463 0.797132 2.27999e-16 303 63.546 3.96561e-05 -3.51173 63.546000 Cu 0.282354 0.810602 4.97678e-16 333 63.546 7.52235e-05 -3.51159 63.546000 Cu 0.343939 0.812531 0.5 336 63.546 5.85184e-05 -3.51159 63.546000 Cu 0.47463 0.800981 2.05561e-16 306 63.546 1.07587e-05 -3.51161 63.546000 Cu 0.413028 0.79906 0.5 308 63.546 4.69799e-05 -3.51168 63.546000 Cu 0.405568 0.814455 4.74998e-16 337 63.546 7.30096e-06 -3.5116 63.546000 Cu 0.467163 0.816379 0.5 339 63.546 8.19646e-06 -3.51165 63.546000 Cu 0.597783 0.804821 9.56632e-16 310 63.546 2.32595e-05 -3.51149 63.546000 Cu 0.605323 0.789431 0.5 311 63.546 7.4972e-06 -3.51141 63.546000 Cu 0.536229 0.8029 0.5 312 63.546 2.21252e-05 -3.51153 63.546000 Cu 0.666878 0.791347 1.98625e-16 313 63.546 9.60504e-06 -3.51147 63.546000 Cu 0.720808 0.808672 1 314 63.546 3.64138e-05 -3.51156 63.546000 Cu 0.728415 0.793269 0.5 315 63.546 6.7825e-06 -3.51159 63.546000 Cu 0.659302 0.806744 0.5 316 63.546 5.29228e-06 -3.51149 63.546000 Cu 0.789927 0.7952 1 317 63.546 9.46491e-06 -3.51168 63.546000 Cu 0.843939 0.812531 1 318 63.546 5.85184e-05 -3.51159 63.546000 Cu 0.851463 0.797132 0.5 319 63.546 3.96561e-05 -3.51173 63.546000 Cu 0.782354 0.810602 0.5 320 63.546 7.52235e-05 -3.51159 63.546000 Cu 0.913028 0.79906 1 321 63.546 4.69799e-05 -3.51168 63.546000 Cu 0.967163 0.816379 1 322 63.546 8.19646e-06 -3.51165 63.546000 Cu 0.97463 0.800981 0.5 323 63.546 1.07587e-05 -3.51161 63.546000 Cu 0.905568 0.814455 0.5 324 63.546 7.30096e-06 -3.5116 63.546000 Cu 0.0902361 0.820225 1 326 63.546 1.69149e-05 -3.51145 63.546000 Cu 0.0287318 0.818302 0.5 328 63.546 1.38518e-05 -3.51159 63.546000 Cu 0.0212509 0.833708 1.46269e-16 357 63.546 1.79135e-05 -3.51153 63.546000 Cu 0.0827675 0.835632 0.5 359 63.546 2.02983e-05 -3.51143 63.546000 Cu 0.213276 0.824067 1 330 63.546 6.0398e-05 -3.5114 63.546000 Cu 0.151745 0.822146 0.5 332 63.546 3.53073e-05 -3.51136 63.546000 Cu 0.14427 0.837547 3.32047e-16 361 63.546 4.92542e-05 -3.51133 63.546000 Cu 0.205821 0.839455 0.5 363 63.546 5.37169e-05 -3.51136 63.546000 Cu 0.274888 0.825989 0.5 334 63.546 1.24279e-05 -3.51151 63.546000 Cu 0.336517 0.827916 9.97165e-16 335 63.546 1.02077e-05 -3.51151 63.546000 Cu 0.267422 0.841368 5.93341e-16 365 63.546 3.5493e-05 -3.51141 63.546000 Cu 0.329049 0.843292 0.5 368 63.546 2.9509e-05 -3.5114 63.546000 Cu 0.459707 0.831776 4.55878e-16 338 63.546 1.75046e-05 -3.51155 63.546000 Cu 0.398126 0.829844 0.5 340 63.546 1.42081e-05 -3.51154 63.546000 Cu 0.390655 0.845227 1 369 63.546 3.49353e-05 -3.51151 63.546000 Cu 0.452258 0.847171 0.5 371 63.546 5.71036e-05 -3.51169 63.546000 Cu 0.528732 0.818302 1.57796e-15 341 63.546 1.38518e-05 -3.51159 63.546000 Cu 0.582768 0.835632 1.11303e-15 342 63.546 2.02983e-05 -3.51143 63.546000 Cu 0.590236 0.820225 0.5 343 63.546 1.69149e-05 -3.51145 63.546000 Cu 0.521251 0.833708 0.5 344 63.546 1.79135e-05 -3.51153 63.546000 Cu 0.651745 0.822146 6.23077e-16 345 63.546 3.53073e-05 -3.51136 63.546000 Cu 0.705821 0.839455 1 346 63.546 5.37169e-05 -3.51136 63.546000 Cu 0.713276 0.824067 0.5 347 63.546 6.0398e-05 -3.5114 63.546000 Cu 0.64427 0.837547 0.5 348 63.546 4.92542e-05 -3.51133 63.546000 Cu 0.774888 0.825989 1.37499e-15 349 63.546 1.24279e-05 -3.51151 63.546000 Cu 0.829049 0.843292 5.4183e-16 350 63.546 2.9509e-05 -3.5114 63.546000 Cu 0.836517 0.827916 0.5 351 63.546 1.02077e-05 -3.51151 63.546000 Cu 0.767422 0.841368 0.5 352 63.546 3.5493e-05 -3.51141 63.546000 Cu 0.898126 0.829844 2.7752e-16 353 63.546 1.42081e-05 -3.51154 63.546000 Cu 0.952258 0.847171 1.83847e-16 354 63.546 5.71036e-05 -3.51169 63.546000 Cu 0.959707 0.831776 0.5 355 63.546 1.75046e-05 -3.51155 63.546000 Cu 0.890655 0.845227 0.5 356 63.546 3.49353e-05 -3.51151 63.546000 Cu 0.0753631 0.851054 1.22203e-16 358 63.546 7.05798e-05 -3.51165 63.546000 Cu 0.0138237 0.849119 0.5 360 63.546 6.57426e-05 -3.51176 63.546000 Cu 0.00637006 0.864519 1 389 63.546 0.000183179 -3.51183 63.546000 Cu 0.0680113 0.866467 0.5 391 63.546 0.000190467 -3.51175 63.546000 Cu 0.198406 0.854858 5.65354e-16 362 63.546 0.000100669 -3.51135 63.546000 Cu 0.136876 0.852962 0.5 364 63.546 4.69683e-05 -3.5115 63.546000 Cu 0.129604 0.868394 1 393 63.546 0.00015669 -3.51157 63.546000 Cu 0.19106 0.870291 0.5 395 63.546 8.78018e-05 -3.51131 63.546000 Cu 0.25994 0.856754 0.5 366 63.546 0.000164345 -3.51124 63.546000 Cu 0.321497 0.858666 9.886e-17 367 63.546 0.000135761 -3.51141 63.546000 Cu 0.25248 0.87217 9.126e-17 397 63.546 0.000279193 -3.51127 63.546000 Cu 0.313916 0.874065 0.5 400 63.546 0.000329708 -3.51136 63.546000 Cu 0.375452 0.875978 1 401 63.546 0.000254247 -3.51149 63.546000 Cu 0.444713 0.86256 4.87665e-16 370 63.546 8.27877e-05 -3.51176 63.546000 Cu 0.383111 0.860604 0.5 372 63.546 4.57137e-05 -3.51159 63.546000 Cu 0.437131 0.877915 0.5 403 63.546 0.000120073 -3.51161 63.546000 Cu 0.513824 0.849119 1.26365e-15 373 63.546 6.57426e-05 -3.51176 63.546000 Cu 0.568011 0.866467 3.09005e-16 374 63.546 0.000190467 -3.51175 63.546000 Cu 0.575363 0.851054 0.5 375 63.546 7.05798e-05 -3.51165 63.546000 Cu 0.50637 0.864519 0.5 376 63.546 0.000183179 -3.51183 63.546000 Cu 0.636876 0.852962 4.68665e-17 377 63.546 4.69683e-05 -3.5115 63.546000 Cu 0.69106 0.870291 1 378 63.546 8.78018e-05 -3.51131 63.546000 Cu 0.698406 0.854858 0.5 379 63.546 0.000100669 -3.51135 63.546000 Cu 0.629604 0.868394 0.5 380 63.546 0.00015669 -3.51157 63.546000 Cu 0.75994 0.856754 1 381 63.546 0.000164345 -3.51124 63.546000 Cu 0.813916 0.874065 1 382 63.546 0.000329708 -3.51136 63.546000 Cu 0.821497 0.858666 0.5 383 63.546 0.000135761 -3.51141 63.546000 Cu 0.75248 0.87217 0.5 384 63.546 0.000279193 -3.51127 63.546000 Cu 0.875452 0.875978 0.5 388 63.546 0.000254247 -3.51149 63.546000 Cu 0.883111 0.860604 6.03173e-20 385 63.546 4.57137e-05 -3.51159 63.546000 Cu 0.944713 0.86256 0.5 387 63.546 8.27877e-05 -3.51176 63.546000 Cu 0.937131 0.877915 2.09361e-16 386 63.546 0.000120073 -3.51161 63.546000 Cu 0.0606473 0.88186 4.68665e-17 390 63.546 0.000433722 -3.51183 63.546000 Cu 0.122292 0.883826 0.5 396 63.546 0.000563269 -3.51171 63.546000 Cu 0.0531867 0.897213 0.5 423 63.546 0.000663616 -3.51157 63.546000 Cu 0.114889 0.899245 1 425 63.546 0.00127634 -3.51165 63.546000 Cu 0.183746 0.885756 1 394 63.546 0.000262914 -3.5114 63.546000 Cu 0.245055 0.887642 0.5 399 63.546 0.000128572 -3.51123 63.546000 Cu 0.176402 0.901237 0.5 427 63.546 0.00114165 -3.51163 63.546000 Cu 0.237726 0.903142 2.32041e-16 429 63.546 0.000532009 -3.51146 63.546000 Cu 0.306373 0.889492 1 398 63.546 0.000651557 -3.51121 63.546000 Cu 0.367859 0.891348 0.5 404 63.546 0.000812489 -3.51134 63.546000 Cu 0.299025 0.904959 0.5 431 63.546 0.000596299 -3.51121 63.546000 Cu 0.360392 0.906739 6.88823e-16 433 63.546 0.00158732 -3.51103 63.546000 Cu 0.429534 0.893243 1 402 63.546 0.000422024 -3.51147 63.546000 Cu 0.498912 0.879882 8.96013e-16 405 63.546 0.000197147 -3.51172 63.546000 Cu 0.491338 0.895197 0.5 408 63.546 0.000177372 -3.51155 63.546000 Cu 0.421975 0.908564 0.5 435 63.546 0.0015334 -3.51081 63.546000 Cu 0.553187 0.897213 2.87713e-16 406 63.546 0.000663616 -3.51157 63.546000 Cu 0.560647 0.88186 0.5 407 63.546 0.000433722 -3.51183 63.546000 Cu 0.622292 0.883826 1.36739e-16 409 63.546 0.000563269 -3.51171 63.546000 Cu 0.614889 0.899245 0.5 412 63.546 0.00127634 -3.51165 63.546000 Cu 0.676402 0.901237 1.58634e-16 410 63.546 0.00114165 -3.51163 63.546000 Cu 0.683746 0.885756 0.5 411 63.546 0.000262914 -3.5114 63.546000 Cu 0.745055 0.887642 1.28657e-16 413 63.546 0.000128572 -3.51123 63.546000 Cu 0.737726 0.903142 0.5 416 63.546 0.000532009 -3.51146 63.546000 Cu 0.799025 0.904959 1 414 63.546 0.000596299 -3.51121 63.546000 Cu 0.806373 0.889492 0.5 415 63.546 0.000651557 -3.51121 63.546000 Cu 0.867859 0.891348 2.13523e-17 417 63.546 0.000812489 -3.51134 63.546000 Cu 0.860392 0.906739 0.5 420 63.546 0.00158732 -3.51103 63.546000 Cu 0.998912 0.879882 0.5 392 63.546 0.000197147 -3.51172 63.546000 Cu 0.929534 0.893243 0.5 419 63.546 0.000422024 -3.51147 63.546000 Cu 0.991338 0.895197 4.59075e-16 421 63.546 0.000177372 -3.51155 63.546000 Cu 0.921975 0.908564 1 418 63.546 0.0015334 -3.51081 63.546000 Cu 0.0454777 0.912512 1.54026e-15 422 63.546 0.000877327 -3.51114 63.546000 Cu 0.107236 0.914617 0.5 428 63.546 0.00157743 -3.5118 63.546000 Cu 0.0373604 0.927797 0.5 455 63.546 0.00198962 -3.51027 63.546000 Cu 0.0990642 0.929925 1 457 63.546 0.00192296 -3.51219 63.546000 Cu 0.168936 0.916693 1 426 63.546 0.00331228 -3.51258 63.546000 Cu 0.230532 0.918647 0.5 432 63.546 0.00294792 -3.51259 63.546000 Cu 0.161222 0.932057 0.5 459 63.546 0.00693189 -3.51336 63.546000 Cu 0.223477 0.934089 6.49858e-16 461 63.546 0.00976566 -3.51347 63.546000 Cu 0.291981 0.920457 1 430 63.546 0.00102638 -3.51176 63.546000 Cu 0.353263 0.922177 0.5 436 63.546 0.0018357 -3.51076 63.546000 Cu 0.285415 0.935963 0.5 463 63.546 0.00552488 -3.51241 63.546000 Cu 0.346736 0.937701 3.09307e-16 465 63.546 0.00264025 -3.50995 63.546000 Cu 0.41454 0.923909 1 434 63.546 0.00506485 -3.50954 63.546000 Cu 0.483676 0.910483 7.30563e-16 437 63.546 0.00107164 -3.51085 63.546000 Cu 0.475853 0.925765 0.5 440 63.546 0.00580298 -3.50903 63.546000 Cu 0.407496 0.939389 0.5 467 63.546 0.0107654 -3.50673 63.546000 Cu 0.53736 0.927797 1 438 63.546 0.00198962 -3.51027 63.546000 Cu 0.545478 0.912512 0.5 439 63.546 0.000877327 -3.51114 63.546000 Cu 0.607236 0.914617 2.10749e-16 441 63.546 0.00157743 -3.5118 63.546000 Cu 0.599064 0.929925 0.5 444 63.546 0.00192296 -3.51219 63.546000 Cu 0.661222 0.932057 1.78539e-16 442 63.546 0.00693189 -3.51336 63.546000 Cu 0.668936 0.916693 0.5 443 63.546 0.00331228 -3.51258 63.546000 Cu 0.730532 0.918647 1.11388e-15 445 63.546 0.00294792 -3.51259 63.546000 Cu 0.723477 0.934089 0.5 448 63.546 0.00976566 -3.51347 63.546000 Cu 0.785415 0.935963 1 446 63.546 0.00552488 -3.51241 63.546000 Cu 0.791981 0.920457 0.5 447 63.546 0.00102638 -3.51176 63.546000 Cu 0.853263 0.922177 1 449 63.546 0.0018357 -3.51076 63.546000 Cu 0.846736 0.937701 0.5 452 63.546 0.00264025 -3.50995 63.546000 Cu 0.983676 0.910483 0.5 424 63.546 0.00107164 -3.51085 63.546000 Cu 0.91454 0.923909 0.5 451 63.546 0.00506485 -3.50954 63.546000 Cu 0.975853 0.925765 6.18252e-16 453 63.546 0.00580298 -3.50903 63.546000 Cu 0.907496 0.939389 1 450 63.546 0.0107654 -3.50673 63.546000 Cu 0.0286045 0.943105 1 454 63.546 0.0108001 -3.50839 63.546000 Cu 0.0903604 0.945134 0.5 460 63.546 0.0086938 -3.51148 63.546000 Cu 0.0193524 0.958538 0.5 487 63.546 0.0519032 -3.50292 63.546000 Cu 0.0813564 0.960202 1 489 63.546 0.0366109 -3.50696 63.546000 Cu 0.153224 0.947208 1 458 63.546 0.00976051 -3.51183 63.546000 Cu 0.216489 0.949319 0.5 464 63.546 0.0161408 -3.51177 63.546000 Cu 0.145006 0.962068 0.5 491 63.546 0.0142679 -3.50614 63.546000 Cu 0.209446 0.964203 2.30943e-15 493 63.546 0.0159125 -3.5052 63.546000 Cu 0.279362 0.951389 6.34236e-16 462 63.546 0.0225291 -3.51162 63.546000 Cu 0.340882 0.953322 0.5 468 63.546 0.0222608 -3.50594 63.546000 Cu 0.273376 0.966592 0.5 495 63.546 0.0638335 -3.50006 63.546000 Cu 0.335442 0.969067 1 497 63.546 0.173791 -3.47895 63.546000 Cu 0.400848 0.955115 8.3841e-17 466 63.546 0.029328 -3.49696 63.546000 Cu 0.467875 0.941159 1 469 63.546 0.0173043 -3.50465 63.546000 Cu 0.459717 0.956902 0.5 472 63.546 0.0256952 -3.49663 63.546000 Cu 0.519352 0.958538 1 470 63.546 0.0519032 -3.50292 63.546000 Cu 0.528604 0.943105 0.5 471 63.546 0.0108001 -3.50839 63.546000 Cu 0.59036 0.945134 1 473 63.546 0.0086938 -3.51148 63.546000 Cu 0.581356 0.960202 0.5 476 63.546 0.0366109 -3.50696 63.546000 Cu 0.645006 0.962068 5.73195e-16 474 63.546 0.0142679 -3.50614 63.546000 Cu 0.653224 0.947208 0.5 475 63.546 0.00976051 -3.51183 63.546000 Cu 0.716489 0.949319 2.65818e-16 477 63.546 0.0161408 -3.51177 63.546000 Cu 0.709446 0.964203 0.5 480 63.546 0.0159125 -3.5052 63.546000 Cu 0.773376 0.966592 4.68665e-17 478 63.546 0.0638335 -3.50006 63.546000 Cu 0.779362 0.951389 0.5 479 63.546 0.0225291 -3.51162 63.546000 Cu 0.840882 0.953322 1 481 63.546 0.0222608 -3.50594 63.546000 Cu 0.835442 0.969067 0.5 484 63.546 0.173791 -3.47895 63.546000 Cu 0.967875 0.941159 0.5 456 63.546 0.0173043 -3.50465 63.546000 Cu 0.900848 0.955115 0.5 483 63.546 0.029328 -3.49696 63.546000 Cu 0.959717 0.956902 1.31063e-15 485 63.546 0.0256952 -3.49663 63.546000 Cu 0.010842 0.974225 2.0228e-15 486 63.546 0.0946701 -3.5018 63.546000 Cu 0.0726379 0.975127 0.5 492 63.546 0.121651 -3.49319 63.546000 Cu 0.00514328 0.990026 0.5 517 63.546 0.0899862 -3.50738 63.546000 Cu 0.0667577 0.990306 1.32734e-15 518 63.546 0.125561 -3.50085 63.546000 Cu 0.137176 0.976598 3.2324e-16 490 63.546 0.0479108 -3.49282 63.546000 Cu 0.202009 0.978669 0.5 496 63.546 0.02468 -3.48789 63.546000 Cu 0.128818 0.990745 0.5 519 63.546 0.352864 -3.46086 63.546000 Cu 0.195689 0.992653 4.58188e-15 520 63.546 4.47489 -3.38179 63.546000 Cu 0.267027 0.98133 6.49074e-16 494 63.546 1.458 -3.39692 63.546000 Cu 0.328905 0.985043 0.5 500 63.546 1.86175 -3.32305 63.546000 Cu 0.259451 0.995816 0.5 521 63.546 10.0151 -3.2495 63.546000 Cu 0.384211 0.988802 1.20635e-17 498 63.546 0.648321 -3.40962 63.546000 Cu 0.393931 0.971321 0.5 499 63.546 0.0801385 -3.46485 63.546000 Cu 0.451138 0.973227 1 501 63.546 0.081297 -3.48948 63.546000 Cu 0.443656 0.989591 0.5 504 63.546 0.201936 -3.49437 63.546000 Cu 0.505143 0.990026 9.53013e-18 502 63.546 0.0899862 -3.50738 63.546000 Cu 0.510842 0.974225 0.5 503 63.546 0.0946701 -3.5018 63.546000 Cu 0.572638 0.975127 1 505 63.546 0.121651 -3.49319 63.546000 Cu 0.566758 0.990306 0.5 508 63.546 0.125561 -3.50085 63.546000 Cu 0.628818 0.990745 1.46746e-15 506 63.546 0.352864 -3.46086 63.546000 Cu 0.637176 0.976598 0.5 507 63.546 0.0479108 -3.49282 63.546000 Cu 0.702009 0.978669 3.91399e-15 509 63.546 0.02468 -3.48789 63.546000 Cu 0.695689 0.992653 0.5 512 63.546 4.47489 -3.38179 63.546000 Cu 0.759451 0.995816 7.89674e-16 510 63.546 10.0151 -3.2495 63.546000 Cu 0.767027 0.98133 0.5 511 63.546 1.458 -3.39692 63.546000 Cu 0.828905 0.985043 1 513 63.546 1.86175 -3.32305 63.546000 Cu 0.893931 0.971321 4.68665e-17 482 63.546 0.0801385 -3.46485 63.546000 Cu 0.951138 0.973227 0.5 488 63.546 0.081297 -3.48948 63.546000 Cu 0.884211 0.988802 0.5 514 63.546 0.648321 -3.40962 63.546000 Cu 0.943656 0.989591 8.58375e-16 516 63.546 0.201936 -3.49437