Number of particles = 1032 A = 1 Angstrom (basic length-scale) H0(1,1) = 29.1642 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 116.586 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60723 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 0.0669559 0.0115002 1.26718e-16 526 63.546 0.331682 -3.50286 63.546000 Cu 0.00466667 0.0118861 0.5 527 63.546 0.119777 -3.53023 63.546000 Cu 0.134345 0.00966077 0.5 529 63.546 4.73951 -3.46142 63.546000 Cu 0.0112219 0.0273653 6.01127e-19 537 63.546 0.123373 -3.5211 63.546000 Cu 0.0757804 0.0259649 0.5 539 63.546 0.0526423 -3.53595 63.546000 Cu 0.140661 0.0240991 0 541 63.546 0.0705459 -3.51516 63.546000 Cu 0.197124 0.00643967 1.2263e-16 528 63.546 9.28403 -3.32697 63.546000 Cu 0.212996 0.0360692 1 542 63.546 0.104734 -3.53742 63.546000 Cu 0.206552 0.0209996 0.5 543 63.546 1.03958 -3.45147 63.546000 Cu 0.267639 0.0168584 7.7906e-17 545 63.546 1.13402 -3.41472 63.546000 Cu 0.332712 0.0311095 1.44631e-16 546 63.546 0.086382 -3.49825 63.546000 Cu 0.322318 0.0132116 0.5 547 63.546 0.54709 -3.46759 63.546000 Cu 0.274663 0.0333639 0.5 548 63.546 0.197945 -3.50333 63.546000 Cu 0.381923 0.0126154 9.41365e-17 549 63.546 0.167623 -3.51659 63.546000 Cu 0.449722 0.0282593 1.50642e-16 550 63.546 0.0855505 -3.5286 63.546000 Cu 0.44301 0.012164 0.5 551 63.546 0.0920815 -3.52912 63.546000 Cu 0.389981 0.0292398 0.5 552 63.546 0.0830937 -3.52576 63.546000 Cu 0.504667 0.0118861 1.83945e-17 553 63.546 0.119777 -3.53023 63.546000 Cu 0.57578 0.0259649 8.36769e-17 554 63.546 0.0526423 -3.53595 63.546000 Cu 0.566956 0.0115002 0.5 555 63.546 0.331682 -3.50286 63.546000 Cu 0.511222 0.0273653 0.5 556 63.546 0.123373 -3.5211 63.546000 Cu 0.634345 0.00966077 6.01127e-19 557 63.546 4.73951 -3.46142 63.546000 Cu 0.640661 0.0240991 0.5 560 63.546 0.0705459 -3.51516 63.546000 Cu 0.706552 0.0209996 2.42855e-17 558 63.546 1.03958 -3.45147 63.546000 Cu 0.697124 0.00643967 0.5 559 63.546 9.28403 -3.32697 63.546000 Cu 0.822318 0.0132116 0 562 63.546 0.54709 -3.46759 63.546000 Cu 0.767639 0.0168584 0.5 564 63.546 1.13402 -3.41472 63.546000 Cu 0.712996 0.0360692 0.5 591 63.546 0.104734 -3.53742 63.546000 Cu 0.774663 0.0333639 0 593 63.546 0.197945 -3.50333 63.546000 Cu 0.832712 0.0311095 0.5 595 63.546 0.086382 -3.49825 63.546000 Cu 0.94301 0.012164 1 524 63.546 0.0920815 -3.52912 63.546000 Cu 0.881923 0.0126154 0.5 525 63.546 0.167623 -3.51659 63.546000 Cu 0.889981 0.0292398 2.42855e-17 533 63.546 0.0830937 -3.52576 63.546000 Cu 0.949722 0.0282593 0.5 535 63.546 0.0855505 -3.5286 63.546000 Cu 0.0840015 0.0407534 1 538 63.546 0.022706 -3.53565 63.546000 Cu 0.0206265 0.0425407 0.5 540 63.546 0.0380909 -3.53679 63.546000 Cu 0.148952 0.0385929 0.5 544 63.546 0.0247071 -3.5342 63.546000 Cu 0.0300868 0.0577724 6.01127e-19 569 63.546 0.01009 -3.53769 63.546000 Cu 0.101489 0.0708643 6.01127e-19 570 63.546 0.0075468 -3.54256 63.546000 Cu 0.0929078 0.0556843 0.5 571 63.546 0.0105005 -3.5422 63.546000 Cu 0.0393389 0.0730162 0.5 572 63.546 0.00171439 -3.53952 63.546000 Cu 0.156364 0.0535361 0 573 63.546 0.0202084 -3.54249 63.546000 Cu 0.163714 0.0688063 0.5 576 63.546 0.011996 -3.54304 63.546000 Cu 0.22554 0.0669395 6.01127e-19 574 63.546 0.00525189 -3.54036 63.546000 Cu 0.219275 0.051421 0.5 575 63.546 0.0314347 -3.54008 63.546000 Cu 0.280469 0.0494544 6.01127e-19 577 63.546 0.0291022 -3.5337 63.546000 Cu 0.2868 0.0651982 0.5 580 63.546 0.00463625 -3.53572 63.546000 Cu 0.34748 0.0634675 1 578 63.546 0.0126341 -3.53104 63.546000 Cu 0.340257 0.0475881 0.5 579 63.546 0.0341865 -3.52299 63.546000 Cu 0.399259 0.0458133 0 581 63.546 0.031086 -3.52699 63.546000 Cu 0.468566 0.0597701 1.29483e-16 582 63.546 0.0125018 -3.53375 63.546000 Cu 0.458831 0.0441792 0.5 583 63.546 0.049736 -3.53008 63.546000 Cu 0.407875 0.0616803 0.5 584 63.546 0.0177898 -3.52858 63.546000 Cu 0.520627 0.0425407 0 585 63.546 0.0380909 -3.53679 63.546000 Cu 0.592908 0.0556843 1.07722e-16 586 63.546 0.0105005 -3.5422 63.546000 Cu 0.584001 0.0407534 0.5 587 63.546 0.022706 -3.53565 63.546000 Cu 0.530087 0.0577724 0.5 588 63.546 0.01009 -3.53769 63.546000 Cu 0.648952 0.0385929 6.01127e-19 589 63.546 0.0247071 -3.5342 63.546000 Cu 0.656364 0.0535361 0.5 592 63.546 0.0202084 -3.54249 63.546000 Cu 0.539339 0.0730162 6.01127e-19 617 63.546 0.00171439 -3.53952 63.546000 Cu 0.601489 0.0708643 0.5 619 63.546 0.0075468 -3.54256 63.546000 Cu 0.663714 0.0688063 1 621 63.546 0.011996 -3.54304 63.546000 Cu 0.719275 0.051421 1 590 63.546 0.0314347 -3.54008 63.546000 Cu 0.780469 0.0494544 0.5 596 63.546 0.0291022 -3.5337 63.546000 Cu 0.72554 0.0669395 0.5 623 63.546 0.00525189 -3.54036 63.546000 Cu 0.7868 0.0651982 1.19744e-16 625 63.546 0.00463625 -3.53572 63.546000 Cu 0.958831 0.0441792 1 534 63.546 0.049736 -3.53008 63.546000 Cu 0.899259 0.0458133 0.5 536 63.546 0.031086 -3.52699 63.546000 Cu 0.907875 0.0616803 1 565 63.546 0.0177898 -3.52858 63.546000 Cu 0.968566 0.0597701 0.5 567 63.546 0.0125018 -3.53375 63.546000 Cu 0.840257 0.0475881 1 594 63.546 0.0341865 -3.52299 63.546000 Cu 0.84748 0.0634675 0.5 627 63.546 0.0126341 -3.53104 63.546000 Cu 0.0479014 0.0883231 0 601 63.546 0.00198633 -3.54034 63.546000 Cu 0.117321 0.101706 1.22389e-16 602 63.546 0.00124024 -3.54044 63.546000 Cu 0.109572 0.0862311 0.5 603 63.546 0.00429674 -3.54116 63.546000 Cu 0.0559117 0.103706 0.5 604 63.546 0.00157733 -3.54081 63.546000 Cu 0.171071 0.084285 6.01127e-19 605 63.546 0.00292549 -3.54097 63.546000 Cu 0.239861 0.0980005 1 606 63.546 0.000544666 -3.53948 63.546000 Cu 0.232452 0.0824826 0.5 607 63.546 0.000911365 -3.53983 63.546000 Cu 0.178621 0.0998038 0.5 608 63.546 0.000572519 -3.53978 63.546000 Cu 0.293723 0.0807513 0 609 63.546 0.00163358 -3.53782 63.546000 Cu 0.301233 0.096229 0.5 612 63.546 0.00137034 -3.53927 63.546000 Cu 0.362694 0.0944068 0 610 63.546 0.00207472 -3.53882 63.546000 Cu 0.35496 0.0790068 0.5 611 63.546 0.00445488 -3.53513 63.546000 Cu 0.41619 0.077148 8.65623e-17 613 63.546 0.00558358 -3.53467 63.546000 Cu 0.48612 0.0904456 6.01127e-19 614 63.546 0.000738194 -3.5391 63.546000 Cu 0.477603 0.0751492 0.5 615 63.546 0.00328103 -3.53591 63.546000 Cu 0.424359 0.0924892 0.5 616 63.546 0.00155805 -3.53866 63.546000 Cu 0.370672 0.109755 0.5 645 63.546 0.000707397 -3.53954 63.546000 Cu 0.432467 0.107791 4.76093e-17 647 63.546 0.00033274 -3.53999 63.546000 Cu 0.494239 0.105757 0.5 649 63.546 0.00066507 -3.54051 63.546000 Cu 0.609572 0.0862311 1.07361e-16 618 63.546 0.00429674 -3.54116 63.546000 Cu 0.547901 0.0883231 0.5 620 63.546 0.00198633 -3.54034 63.546000 Cu 0.555912 0.103706 1 651 63.546 0.00157733 -3.54081 63.546000 Cu 0.617321 0.101706 0.5 653 63.546 0.00124024 -3.54044 63.546000 Cu 0.732452 0.0824826 1.03514e-16 622 63.546 0.000911365 -3.53983 63.546000 Cu 0.671071 0.084285 0.5 624 63.546 0.00292549 -3.54097 63.546000 Cu 0.793723 0.0807513 0.5 628 63.546 0.00163358 -3.53782 63.546000 Cu 0.678621 0.0998038 1.15897e-16 655 63.546 0.000572519 -3.53978 63.546000 Cu 0.739861 0.0980005 0.5 657 63.546 0.000544666 -3.53948 63.546000 Cu 0.801233 0.096229 5.72273e-17 659 63.546 0.00137034 -3.53927 63.546000 Cu 0.977603 0.0751492 1.22389e-16 566 63.546 0.00328103 -3.53591 63.546000 Cu 0.91619 0.077148 0.5 568 63.546 0.00558358 -3.53467 63.546000 Cu 0.924359 0.0924892 1 597 63.546 0.00155805 -3.53866 63.546000 Cu 0.994239 0.105757 5.6025e-17 598 63.546 0.00066507 -3.54051 63.546000 Cu 0.98612 0.0904456 0.5 599 63.546 0.000738194 -3.5391 63.546000 Cu 0.932467 0.107791 0.5 600 63.546 0.00033274 -3.53999 63.546000 Cu 0.85496 0.0790068 6.01127e-19 626 63.546 0.00445488 -3.53513 63.546000 Cu 0.870672 0.109755 4.49643e-17 660 63.546 0.000707397 -3.53954 63.546000 Cu 0.862694 0.0944068 0.5 661 63.546 0.00207472 -3.53882 63.546000 Cu 0.00981343 0.136516 2.83732e-17 632 63.546 0.000354307 -3.54034 63.546000 Cu 0.00212676 0.121123 0.5 633 63.546 0.000708726 -3.54086 63.546000 Cu 0.0636751 0.119143 0 635 63.546 0.000733055 -3.54068 63.546000 Cu 0.132686 0.132686 0 636 63.546 0.000110522 -3.53963 63.546000 Cu 0.125031 0.117205 0.5 637 63.546 0.000269699 -3.54016 63.546000 Cu 0.0713092 0.134592 0.5 638 63.546 0.000202817 -3.53999 63.546000 Cu 0.140332 0.148129 0.5 671 63.546 0.000110466 -3.5394 63.546000 Cu 0.186262 0.11532 1.2263e-16 639 63.546 0.000175729 -3.53946 63.546000 Cu 0.255379 0.128908 1 640 63.546 0.000387135 -3.53926 63.546000 Cu 0.247535 0.113476 0.5 641 63.546 0.000714717 -3.53921 63.546000 Cu 0.193999 0.130796 0.5 642 63.546 0.000224447 -3.53931 63.546000 Cu 0.309012 0.111638 6.01127e-19 643 63.546 0.000897482 -3.53916 63.546000 Cu 0.316893 0.127005 0.5 646 63.546 0.000362992 -3.53932 63.546000 Cu 0.201762 0.146228 0 673 63.546 0.000186861 -3.53954 63.546000 Cu 0.263241 0.144309 0.5 675 63.546 0.000151761 -3.53972 63.546000 Cu 0.324804 0.142371 1.04115e-16 677 63.546 6.86079e-05 -3.54004 63.546000 Cu 0.378598 0.125077 4.68879e-17 644 63.546 0.00011366 -3.53977 63.546000 Cu 0.440395 0.123111 0.5 650 63.546 0.000242177 -3.54035 63.546000 Cu 0.386463 0.140416 0.5 679 63.546 0.000100789 -3.54035 63.546000 Cu 0.448157 0.138461 3.10181e-17 681 63.546 0.000236526 -3.54054 63.546000 Cu 0.502127 0.121123 7.71847e-17 648 63.546 0.000708726 -3.54086 63.546000 Cu 0.625031 0.117205 1.4427e-17 652 63.546 0.000269699 -3.54016 63.546000 Cu 0.563675 0.119143 0.5 654 63.546 0.000733055 -3.54068 63.546000 Cu 0.509813 0.136516 0.5 683 63.546 0.000354307 -3.54034 63.546000 Cu 0.571309 0.134592 5.2298e-17 685 63.546 0.000202817 -3.53999 63.546000 Cu 0.640332 0.148129 1.90317e-16 686 63.546 0.000110466 -3.5394 63.546000 Cu 0.632686 0.132686 0.5 687 63.546 0.000110522 -3.53963 63.546000 Cu 0.747535 0.113476 2.50069e-17 656 63.546 0.000714717 -3.53921 63.546000 Cu 0.686262 0.11532 0.5 658 63.546 0.000175729 -3.53946 63.546000 Cu 0.809012 0.111638 0.5 662 63.546 0.000897482 -3.53916 63.546000 Cu 0.693999 0.130796 4.88115e-17 689 63.546 0.000224447 -3.53931 63.546000 Cu 0.763241 0.144309 0 690 63.546 0.000151761 -3.53972 63.546000 Cu 0.755379 0.128908 0.5 691 63.546 0.000387135 -3.53926 63.546000 Cu 0.701762 0.146228 0.5 692 63.546 0.000186861 -3.53954 63.546000 Cu 0.816893 0.127005 1.28641e-17 693 63.546 0.000362992 -3.53932 63.546000 Cu 0.824804 0.142371 0.5 694 63.546 6.86079e-05 -3.54004 63.546000 Cu 0.886463 0.140416 1 629 63.546 0.000100789 -3.54035 63.546000 Cu 0.878598 0.125077 0.5 630 63.546 0.00011366 -3.53977 63.546000 Cu 0.940395 0.123111 6.63644e-17 631 63.546 0.000242177 -3.54035 63.546000 Cu 0.948157 0.138461 0.5 634 63.546 0.000236526 -3.54054 63.546000 Cu 0.025002 0.167341 1.68316e-18 666 63.546 1.10924e-05 -3.54011 63.546000 Cu 0.0173914 0.151926 0.5 667 63.546 5.976e-05 -3.54029 63.546000 Cu 0.0788927 0.150023 1.04957e-16 669 63.546 3.13184e-05 -3.53972 63.546000 Cu 0.147991 0.163537 1 670 63.546 8.12779e-05 -3.53943 63.546000 Cu 0.0864973 0.165437 0.5 672 63.546 2.50597e-05 -3.53973 63.546000 Cu 0.0326516 0.182747 0.5 699 63.546 9.85508e-06 -3.53987 63.546000 Cu 0.0941489 0.180836 0 701 63.546 3.23906e-05 -3.53976 63.546000 Cu 0.155679 0.178922 0.5 703 63.546 3.29105e-05 -3.5397 63.546000 Cu 0.271064 0.159693 1 674 63.546 4.19813e-05 -3.5398 63.546000 Cu 0.209513 0.161626 0.5 676 63.546 0.000105905 -3.53949 63.546000 Cu 0.332654 0.157744 0.5 680 63.546 2.6369e-05 -3.54023 63.546000 Cu 0.217245 0.176999 0 705 63.546 1.08165e-05 -3.53972 63.546000 Cu 0.278832 0.175066 0.5 707 63.546 1.39179e-05 -3.53994 63.546000 Cu 0.394253 0.155791 6.01127e-19 678 63.546 9.21389e-05 -3.54056 63.546000 Cu 0.455843 0.153849 0.5 684 63.546 0.000124889 -3.54067 63.546000 Cu 0.340413 0.173125 6.01127e-19 709 63.546 3.26518e-05 -3.54017 63.546000 Cu 0.401965 0.171186 0.5 711 63.546 3.3259e-05 -3.54034 63.546000 Cu 0.463498 0.169257 2.39249e-17 713 63.546 2.41884e-05 -3.54031 63.546000 Cu 0.471158 0.184662 0.5 716 63.546 4.8144e-06 -3.53998 63.546000 Cu 0.517391 0.151926 1.44391e-16 682 63.546 5.976e-05 -3.54029 63.546000 Cu 0.578893 0.150023 0.5 688 63.546 3.13184e-05 -3.53972 63.546000 Cu 0.532652 0.182747 1.2251e-16 714 63.546 9.85508e-06 -3.53987 63.546000 Cu 0.525002 0.167341 0.5 715 63.546 1.10924e-05 -3.54011 63.546000 Cu 0.586497 0.165437 1 717 63.546 2.50597e-05 -3.53973 63.546000 Cu 0.655679 0.178922 1.22269e-16 718 63.546 3.29105e-05 -3.5397 63.546000 Cu 0.647991 0.163537 0.5 719 63.546 8.12779e-05 -3.53943 63.546000 Cu 0.594149 0.180836 0.5 720 63.546 3.23906e-05 -3.53976 63.546000 Cu 0.709513 0.161626 1.19384e-16 721 63.546 0.000105905 -3.53949 63.546000 Cu 0.778832 0.175066 1 722 63.546 1.39179e-05 -3.53994 63.546000 Cu 0.771064 0.159693 0.5 723 63.546 4.19813e-05 -3.5398 63.546000 Cu 0.717245 0.176999 0.5 724 63.546 1.08165e-05 -3.53972 63.546000 Cu 0.832654 0.157744 1 725 63.546 2.6369e-05 -3.54023 63.546000 Cu 0.901965 0.171186 1 663 63.546 3.3259e-05 -3.54034 63.546000 Cu 0.894253 0.155791 0.5 664 63.546 9.21389e-05 -3.54056 63.546000 Cu 0.955843 0.153849 6.01127e-19 665 63.546 0.000124889 -3.54067 63.546000 Cu 0.963498 0.169257 0.5 668 63.546 2.41884e-05 -3.54031 63.546000 Cu 0.971158 0.184662 1.20225e-18 697 63.546 4.8144e-06 -3.53998 63.546000 Cu 0.840413 0.173125 0.5 726 63.546 3.26518e-05 -3.54017 63.546000 Cu 0.0403295 0.198141 7.63431e-17 698 63.546 1.80108e-05 -3.53988 63.546000 Cu 0.163401 0.1943 2.26024e-17 702 63.546 4.69368e-06 -3.54018 63.546000 Cu 0.101851 0.196223 0.5 704 63.546 1.66702e-05 -3.54001 63.546000 Cu 0.0480343 0.213522 0.5 731 63.546 9.41106e-06 -3.53981 63.546000 Cu 0.109576 0.211601 3.00563e-18 733 63.546 7.4703e-06 -3.53993 63.546000 Cu 0.286544 0.190444 1.85147e-17 706 63.546 7.53882e-06 -3.54038 63.546000 Cu 0.224966 0.192374 0.5 708 63.546 1.95779e-06 -3.54032 63.546000 Cu 0.171128 0.209677 0.5 735 63.546 6.0622e-06 -3.54002 63.546000 Cu 0.232684 0.207752 0 737 63.546 7.27346e-06 -3.54008 63.546000 Cu 0.301925 0.221198 1.22389e-16 738 63.546 2.08192e-06 -3.53956 63.546000 Cu 0.29424 0.205825 0.5 739 63.546 9.46682e-06 -3.54008 63.546000 Cu 0.409652 0.186584 5.54239e-17 710 63.546 1.50565e-05 -3.54015 63.546000 Cu 0.34811 0.188513 0.5 712 63.546 1.37284e-05 -3.54031 63.546000 Cu 0.355783 0.2039 1 741 63.546 9.04785e-06 -3.54004 63.546000 Cu 0.424976 0.217358 1 742 63.546 6.25695e-06 -3.53969 63.546000 Cu 0.417313 0.201977 0.5 743 63.546 8.19633e-06 -3.53993 63.546000 Cu 0.363453 0.219277 0.5 744 63.546 2.5781e-06 -3.53963 63.546000 Cu 0.478822 0.200058 6.67251e-17 745 63.546 1.09566e-05 -3.53985 63.546000 Cu 0.486501 0.21544 0.5 748 63.546 1.00746e-05 -3.53975 63.546000 Cu 0.548034 0.213522 4.52047e-17 746 63.546 9.41106e-06 -3.53981 63.546000 Cu 0.540329 0.198141 0.5 747 63.546 1.80108e-05 -3.53988 63.546000 Cu 0.601851 0.196223 6.01127e-19 749 63.546 1.66702e-05 -3.54001 63.546000 Cu 0.663401 0.1943 0.5 751 63.546 4.69368e-06 -3.54018 63.546000 Cu 0.609576 0.211601 0.5 752 63.546 7.4703e-06 -3.53993 63.546000 Cu 0.671128 0.209677 1.599e-17 750 63.546 6.0622e-06 -3.54002 63.546000 Cu 0.724966 0.192374 1.92481e-16 753 63.546 1.95779e-06 -3.54032 63.546000 Cu 0.79424 0.205825 1.7577e-16 754 63.546 9.46682e-06 -3.54008 63.546000 Cu 0.786544 0.190444 0.5 755 63.546 7.53882e-06 -3.54038 63.546000 Cu 0.732684 0.207752 0.5 756 63.546 7.27346e-06 -3.54008 63.546000 Cu 0.801925 0.221198 0.5 789 63.546 2.08192e-06 -3.53956 63.546000 Cu 0.917313 0.201977 1.29843e-16 695 63.546 8.19633e-06 -3.53993 63.546000 Cu 0.909652 0.186584 0.5 696 63.546 1.50565e-05 -3.54015 63.546000 Cu 0.978822 0.200058 0.5 700 63.546 1.09566e-05 -3.53985 63.546000 Cu 0.924976 0.217358 0.5 728 63.546 6.25695e-06 -3.53969 63.546000 Cu 0.986501 0.21544 1 729 63.546 1.00746e-05 -3.53975 63.546000 Cu 0.84811 0.188513 9.47376e-17 757 63.546 1.37284e-05 -3.54031 63.546000 Cu 0.855783 0.2039 0.5 758 63.546 9.04785e-06 -3.54004 63.546000 Cu 0.863453 0.219277 5.07351e-17 791 63.546 2.5781e-06 -3.53963 63.546000 Cu 0.0557476 0.228892 0 730 63.546 1.11177e-06 -3.53974 63.546000 Cu 0.117295 0.22697 0.5 736 63.546 1.25067e-06 -3.53968 63.546000 Cu 0.00191544 0.246181 5.95116e-17 763 63.546 1.87826e-07 -3.53991 63.546000 Cu 0.0634554 0.244259 0.5 765 63.546 1.21403e-06 -3.53991 63.546000 Cu 0.124998 0.242336 0 767 63.546 3.15717e-06 -3.53992 63.546000 Cu 0.132692 0.257711 0.5 770 63.546 7.6132e-07 -3.5401 63.546000 Cu 0.178843 0.225046 0 734 63.546 1.66718e-06 -3.53961 63.546000 Cu 0.240388 0.223121 0.5 740 63.546 2.30669e-06 -3.53956 63.546000 Cu 0.194227 0.255789 1 768 63.546 8.89917e-08 -3.54021 63.546000 Cu 0.186539 0.240413 0.5 769 63.546 4.70835e-06 -3.53992 63.546000 Cu 0.248077 0.23849 0 771 63.546 4.31864e-06 -3.5399 63.546000 Cu 0.317302 0.251944 1 772 63.546 9.45147e-07 -3.54016 63.546000 Cu 0.309609 0.236569 0.5 773 63.546 2.07858e-06 -3.53986 63.546000 Cu 0.255764 0.253866 0.5 774 63.546 2.61538e-07 -3.54024 63.546000 Cu 0.371139 0.234649 6.01127e-19 775 63.546 1.07847e-06 -3.53983 63.546000 Cu 0.440377 0.248102 5.25385e-17 776 63.546 2.22746e-07 -3.53996 63.546000 Cu 0.43267 0.232731 0.5 777 63.546 1.36973e-06 -3.5398 63.546000 Cu 0.37884 0.250023 0.5 778 63.546 7.97563e-07 -3.54005 63.546000 Cu 0.494206 0.230812 1 779 63.546 1.20522e-06 -3.53978 63.546000 Cu 0.563455 0.244259 6.19161e-17 780 63.546 1.21403e-06 -3.53991 63.546000 Cu 0.555748 0.228892 0.5 781 63.546 1.11177e-06 -3.53974 63.546000 Cu 0.501915 0.246181 0.5 782 63.546 1.87826e-07 -3.53991 63.546000 Cu 0.617295 0.22697 6.01127e-19 783 63.546 1.25067e-06 -3.53968 63.546000 Cu 0.624998 0.242336 0.5 786 63.546 3.15717e-06 -3.53992 63.546000 Cu 0.632692 0.257711 0 817 63.546 7.6132e-07 -3.5401 63.546000 Cu 0.686539 0.240413 1.15416e-17 784 63.546 4.70835e-06 -3.53992 63.546000 Cu 0.678843 0.225046 0.5 785 63.546 1.66718e-06 -3.53961 63.546000 Cu 0.740388 0.223121 3.83519e-17 787 63.546 2.30669e-06 -3.53956 63.546000 Cu 0.809609 0.236569 1.74327e-17 788 63.546 2.07858e-06 -3.53986 63.546000 Cu 0.748077 0.23849 0.5 790 63.546 4.31864e-06 -3.5399 63.546000 Cu 0.694227 0.255789 0.5 819 63.546 8.89917e-08 -3.54021 63.546000 Cu 0.755764 0.253866 2.46462e-17 821 63.546 2.61538e-07 -3.54024 63.546000 Cu 0.817302 0.251944 0.5 823 63.546 9.45147e-07 -3.54016 63.546000 Cu 0.93267 0.232731 6.01127e-19 727 63.546 1.36973e-06 -3.5398 63.546000 Cu 0.994206 0.230812 0.5 732 63.546 1.20522e-06 -3.53978 63.546000 Cu 0.87884 0.250023 6.01127e-19 759 63.546 7.97563e-07 -3.54005 63.546000 Cu 0.940377 0.248102 0.5 761 63.546 2.22746e-07 -3.53996 63.546000 Cu 0.871139 0.234649 0.5 792 63.546 1.07847e-06 -3.53983 63.546000 Cu 0.0711569 0.259632 1 764 63.546 9.98213e-07 -3.53994 63.546000 Cu 0.00962239 0.261552 0.5 766 63.546 5.59633e-07 -3.53982 63.546000 Cu 0.0173271 0.276924 0 797 63.546 6.36971e-06 -3.53968 63.546000 Cu 0.0865306 0.290386 1 798 63.546 8.48758e-06 -3.53982 63.546000 Cu 0.0788535 0.275006 0.5 799 63.546 2.91833e-06 -3.53974 63.546000 Cu 0.0250164 0.292305 0.5 800 63.546 1.5804e-05 -3.53991 63.546000 Cu 0.14038 0.273087 3.5226e-17 801 63.546 8.7794e-07 -3.53982 63.546000 Cu 0.148054 0.288464 0.5 804 63.546 6.18274e-06 -3.53976 63.546000 Cu 0.209596 0.286539 6.01127e-19 802 63.546 4.59351e-06 -3.53976 63.546000 Cu 0.201913 0.271166 0.5 803 63.546 2.10122e-06 -3.53989 63.546000 Cu 0.263453 0.269242 0 805 63.546 2.90558e-06 -3.53989 63.546000 Cu 0.332704 0.282686 1 806 63.546 3.53275e-06 -3.53973 63.546000 Cu 0.324999 0.267318 0.5 807 63.546 1.96882e-06 -3.53984 63.546000 Cu 0.271149 0.284612 0.5 808 63.546 2.88875e-06 -3.53975 63.546000 Cu 0.386544 0.265394 1 809 63.546 7.00959e-07 -3.53978 63.546000 Cu 0.455795 0.278842 1.39461e-17 810 63.546 7.95194e-06 -3.53968 63.546000 Cu 0.448085 0.263472 0.5 811 63.546 1.8116e-07 -3.53976 63.546000 Cu 0.394254 0.280762 0.5 812 63.546 6.30225e-06 -3.5397 63.546000 Cu 0.401974 0.296139 1.22269e-16 841 63.546 1.82514e-05 -3.54005 63.546000 Cu 0.463502 0.294222 0.5 843 63.546 2.15138e-05 -3.53999 63.546000 Cu 0.509622 0.261552 3.02968e-17 813 63.546 5.59633e-07 -3.53982 63.546000 Cu 0.578854 0.275006 6.01127e-19 814 63.546 2.91833e-06 -3.53974 63.546000 Cu 0.571157 0.259632 0.5 815 63.546 9.98213e-07 -3.53994 63.546000 Cu 0.517327 0.276924 0.5 816 63.546 6.36971e-06 -3.53968 63.546000 Cu 0.64038 0.273087 0.5 820 63.546 8.7794e-07 -3.53982 63.546000 Cu 0.525016 0.292305 1 845 63.546 1.5804e-05 -3.53991 63.546000 Cu 0.586531 0.290386 0.5 847 63.546 8.48758e-06 -3.53982 63.546000 Cu 0.648054 0.288464 6.01127e-19 849 63.546 6.18274e-06 -3.53976 63.546000 Cu 0.701913 0.271166 6.01127e-19 818 63.546 2.10122e-06 -3.53989 63.546000 Cu 0.824999 0.267318 0 822 63.546 1.96882e-06 -3.53984 63.546000 Cu 0.763453 0.269242 0.5 824 63.546 2.90558e-06 -3.53989 63.546000 Cu 0.709596 0.286539 0.5 851 63.546 4.59351e-06 -3.53976 63.546000 Cu 0.771149 0.284612 5.51834e-17 853 63.546 2.88875e-06 -3.53975 63.546000 Cu 0.832704 0.282686 0.5 855 63.546 3.53275e-06 -3.53973 63.546000 Cu 0.948085 0.263472 0 760 63.546 1.8116e-07 -3.53976 63.546000 Cu 0.886544 0.265394 0.5 762 63.546 7.00959e-07 -3.53978 63.546000 Cu 0.894254 0.280762 6.01127e-19 793 63.546 6.30225e-06 -3.5397 63.546000 Cu 0.963502 0.294222 0 794 63.546 2.15138e-05 -3.53999 63.546000 Cu 0.955795 0.278842 0.5 795 63.546 7.95194e-06 -3.53968 63.546000 Cu 0.901974 0.296139 0.5 796 63.546 1.82514e-05 -3.54005 63.546000 Cu 0.0326734 0.307702 0 829 63.546 6.74552e-06 -3.54012 63.546000 Cu 0.101848 0.321175 6.01127e-19 830 63.546 3.96032e-05 -3.54033 63.546000 Cu 0.0941823 0.305777 0.5 831 63.546 1.5118e-05 -3.54015 63.546000 Cu 0.0403188 0.323108 0.5 832 63.546 3.54857e-05 -3.5402 63.546000 Cu 0.155718 0.303846 1 833 63.546 1.78259e-05 -3.54014 63.546000 Cu 0.163404 0.319232 0.5 836 63.546 2.68073e-05 -3.54031 63.546000 Cu 0.224988 0.317291 1 834 63.546 8.76102e-06 -3.54016 63.546000 Cu 0.217283 0.301913 0.5 835 63.546 8.57522e-06 -3.54015 63.546000 Cu 0.278857 0.299983 3.39036e-17 837 63.546 6.21068e-06 -3.54015 63.546000 Cu 0.286575 0.31536 0.5 840 63.546 1.31231e-05 -3.54006 63.546000 Cu 0.232725 0.332668 0.5 867 63.546 4.00918e-05 -3.53957 63.546000 Cu 0.294282 0.330738 2.05585e-17 869 63.546 9.72802e-05 -3.53944 63.546000 Cu 0.348145 0.313441 6.98509e-17 838 63.546 3.3789e-05 -3.53997 63.546000 Cu 0.340428 0.298058 0.5 839 63.546 1.31558e-05 -3.54012 63.546000 Cu 0.471186 0.309618 1 842 63.546 1.76164e-05 -3.54002 63.546000 Cu 0.409681 0.311528 0.5 844 63.546 3.72941e-05 -3.53997 63.546000 Cu 0.355811 0.328828 0.5 871 63.546 8.39509e-05 -3.5395 63.546000 Cu 0.417319 0.326929 1 873 63.546 3.5757e-05 -3.53971 63.546000 Cu 0.478813 0.325025 0.5 875 63.546 1.96834e-05 -3.53994 63.546000 Cu 0.594182 0.305777 1 846 63.546 1.5118e-05 -3.54015 63.546000 Cu 0.532673 0.307702 0.5 848 63.546 6.74552e-06 -3.54012 63.546000 Cu 0.655718 0.303846 0.5 852 63.546 1.78259e-05 -3.54014 63.546000 Cu 0.540319 0.323108 1 877 63.546 3.54857e-05 -3.5402 63.546000 Cu 0.601848 0.321175 0.5 879 63.546 3.96032e-05 -3.54033 63.546000 Cu 0.663404 0.319232 0 881 63.546 2.68073e-05 -3.54031 63.546000 Cu 0.717283 0.301913 2.12799e-17 850 63.546 8.57522e-06 -3.54015 63.546000 Cu 0.778857 0.299983 0.5 856 63.546 6.21068e-06 -3.54015 63.546000 Cu 0.732725 0.332668 1 882 63.546 4.00918e-05 -3.53957 63.546000 Cu 0.724988 0.317291 0.5 883 63.546 8.76102e-06 -3.54016 63.546000 Cu 0.786575 0.31536 2.40451e-18 885 63.546 1.31231e-05 -3.54006 63.546000 Cu 0.794282 0.330738 0.5 888 63.546 9.72802e-05 -3.53944 63.546000 Cu 0.909681 0.311528 1.20225e-19 825 63.546 3.72941e-05 -3.53997 63.546000 Cu 0.978813 0.325025 1.2263e-16 826 63.546 1.96834e-05 -3.53994 63.546000 Cu 0.971186 0.309618 0.5 827 63.546 1.76164e-05 -3.54002 63.546000 Cu 0.917319 0.326929 0.5 828 63.546 3.5757e-05 -3.53971 63.546000 Cu 0.840428 0.298058 6.01127e-19 854 63.546 1.31558e-05 -3.54012 63.546000 Cu 0.855811 0.328828 6.01127e-19 886 63.546 8.39509e-05 -3.5395 63.546000 Cu 0.848145 0.313441 0.5 887 63.546 3.3789e-05 -3.53997 63.546000 Cu 0.0479546 0.338509 1.67234e-16 861 63.546 0.00011581 -3.54039 63.546000 Cu 0.117297 0.351936 6.01127e-19 862 63.546 7.59909e-05 -3.54063 63.546000 Cu 0.109549 0.336565 0.5 863 63.546 7.42795e-05 -3.54032 63.546000 Cu 0.0555831 0.353893 0.5 864 63.546 0.000191494 -3.5408 63.546000 Cu 0.0632531 0.369243 6.01127e-19 895 63.546 0.000212146 -3.54061 63.546000 Cu 0.125089 0.367284 0.5 897 63.546 0.0001547 -3.54035 63.546000 Cu 0.171158 0.334613 8.30757e-17 865 63.546 1.47511e-05 -3.53999 63.546000 Cu 0.240524 0.34805 1.35855e-17 866 63.546 0.000199021 -3.5395 63.546000 Cu 0.178965 0.349985 0.5 868 63.546 8.73451e-05 -3.54004 63.546000 Cu 0.301986 0.346137 0.5 872 63.546 0.000223067 -3.53932 63.546000 Cu 0.186797 0.365358 7.29768e-17 899 63.546 0.000454398 -3.54 63.546000 Cu 0.248318 0.363459 0.5 901 63.546 0.00046267 -3.53966 63.546000 Cu 0.309676 0.361575 1.28641e-17 903 63.546 0.000182216 -3.53942 63.546000 Cu 0.363404 0.344237 5.6025e-17 870 63.546 0.000128014 -3.53963 63.546000 Cu 0.486382 0.340436 0 874 63.546 7.8846e-05 -3.54019 63.546000 Cu 0.424872 0.342342 0.5 876 63.546 3.62873e-05 -3.53993 63.546000 Cu 0.370983 0.359686 0.5 905 63.546 9.49803e-05 -3.53972 63.546000 Cu 0.432367 0.357773 6.01127e-19 907 63.546 0.000231935 -3.54026 63.546000 Cu 0.493907 0.355841 0.5 909 63.546 0.000287048 -3.54065 63.546000 Cu 0.609549 0.336565 5.06149e-17 878 63.546 7.42795e-05 -3.54032 63.546000 Cu 0.547955 0.338509 0.5 880 63.546 0.00011581 -3.54039 63.546000 Cu 0.555583 0.353893 2.01979e-17 911 63.546 0.000191494 -3.5408 63.546000 Cu 0.625089 0.367284 1.75529e-17 912 63.546 0.0001547 -3.54035 63.546000 Cu 0.617297 0.351936 0.5 913 63.546 7.59909e-05 -3.54063 63.546000 Cu 0.563253 0.369243 0.5 914 63.546 0.000212146 -3.54061 63.546000 Cu 0.671158 0.334613 0.5 884 63.546 1.47511e-05 -3.53999 63.546000 Cu 0.678965 0.349985 6.01127e-19 915 63.546 8.73451e-05 -3.54004 63.546000 Cu 0.748318 0.363459 4.7489e-17 916 63.546 0.00046267 -3.53966 63.546000 Cu 0.740524 0.34805 0.5 917 63.546 0.000199021 -3.5395 63.546000 Cu 0.686797 0.365358 0.5 918 63.546 0.000454398 -3.54 63.546000 Cu 0.801986 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0.386578 0.5 943 63.546 0.000542323 -3.54027 63.546000 Cu 0.571084 0.384554 2.53676e-17 945 63.546 0.000320548 -3.53953 63.546000 Cu 0.640595 0.397948 4.46036e-17 946 63.546 0.00216472 -3.53782 63.546000 Cu 0.632873 0.382607 0.5 947 63.546 0.000759614 -3.53912 63.546000 Cu 0.579005 0.39985 0.5 948 63.546 0.00194792 -3.5378 63.546000 Cu 0.694541 0.380737 1 949 63.546 0.00100351 -3.53928 63.546000 Cu 0.76346 0.394377 6.01127e-19 950 63.546 0.000664266 -3.53957 63.546000 Cu 0.756002 0.378903 0.5 951 63.546 0.000688551 -3.53928 63.546000 Cu 0.702071 0.396144 0.5 952 63.546 0.00141412 -3.53866 63.546000 Cu 0.817287 0.377054 6.01127e-19 953 63.546 0.000187288 -3.5393 63.546000 Cu 0.824761 0.392566 0.5 954 63.546 0.000783919 -3.54003 63.546000 Cu 0.886067 0.390648 0 889 63.546 0.00146584 -3.54039 63.546000 Cu 0.878544 0.375162 0.5 890 63.546 0.00030069 -3.5396 63.546000 Cu 0.939905 0.373215 1 891 63.546 0.000772921 -3.54033 63.546000 Cu 0.947556 0.388634 0.5 894 63.546 0.00147066 -3.5406 63.546000 Cu 0.893705 0.406112 0.5 924 63.546 0.00440435 -3.54193 63.546000 Cu 0.955455 0.404003 0 925 63.546 0.0014011 -3.54045 63.546000 Cu 0.0255438 0.417184 1 926 63.546 0.004048 -3.5353 63.546000 Cu 0.148068 0.41335 2.96957e-17 930 63.546 0.00520678 -3.53543 63.546000 Cu 0.086843 0.415199 0.5 932 63.546 0.00634776 -3.53461 63.546000 Cu 0.0342591 0.432592 0.5 959 63.546 0.0142013 -3.53345 63.546000 Cu 0.094814 0.430706 0 961 63.546 0.0178184 -3.52916 63.546000 Cu 0.155133 0.428922 0.5 963 63.546 0.0124653 -3.53123 63.546000 Cu 0.270578 0.409896 6.01127e-19 934 63.546 0.00121206 -3.54027 63.546000 Cu 0.209271 0.411618 0.5 936 63.546 0.00178343 -3.53774 63.546000 Cu 0.332065 0.408084 0.5 940 63.546 0.00400255 -3.5419 63.546000 Cu 0.215811 0.427185 1.385e-16 965 63.546 0.00514386 -3.53539 63.546000 Cu 0.283147 0.440894 1.2263e-17 966 63.546 0.0360443 -3.53887 63.546000 Cu 0.277197 0.425424 0.5 967 63.546 0.00735362 -3.54027 63.546000 Cu 0.221707 0.442933 0.5 968 63.546 0.0347938 -3.53236 63.546000 Cu 0.339231 0.423532 1 969 63.546 0.0131299 -3.54311 63.546000 Cu 0.410043 0.436608 5.99925e-17 970 63.546 0.0120057 -3.54157 63.546000 Cu 0.401669 0.42146 0.5 971 63.546 0.00719369 -3.54264 63.546000 Cu 0.346399 0.438745 0.5 972 63.546 0.0197313 -3.54109 63.546000 Cu 0.463854 0.419304 6.01127e-19 973 63.546 0.00167617 -3.53914 63.546000 Cu 0.472863 0.434554 0.5 976 63.546 0.0131206 -3.53732 63.546000 Cu 0.534259 0.432592 6.01127e-19 974 63.546 0.0142013 -3.53345 63.546000 Cu 0.525544 0.417184 0.5 975 63.546 0.004048 -3.5353 63.546000 Cu 0.586843 0.415199 6.01127e-19 977 63.546 0.00634776 -3.53461 63.546000 Cu 0.655133 0.428922 6.01127e-19 978 63.546 0.0124653 -3.53123 63.546000 Cu 0.648068 0.41335 0.5 979 63.546 0.00520678 -3.53543 63.546000 Cu 0.594814 0.430706 0.5 980 63.546 0.0178184 -3.52916 63.546000 Cu 0.709271 0.411618 1.34172e-16 981 63.546 0.00178343 -3.53774 63.546000 Cu 0.777197 0.425424 7.27364e-17 982 63.546 0.00735362 -3.54027 63.546000 Cu 0.770578 0.409896 0.5 983 63.546 0.00121206 -3.54027 63.546000 Cu 0.715811 0.427185 0.5 984 63.546 0.00514386 -3.53539 63.546000 Cu 0.832065 0.408084 0 985 63.546 0.00400255 -3.5419 63.546000 Cu 0.721707 0.442933 1.05919e-16 1013 63.546 0.0347938 -3.53236 63.546000 Cu 0.783147 0.440894 0.5 1015 63.546 0.0360443 -3.53887 63.546000 Cu 0.901669 0.42146 2.16406e-17 923 63.546 0.00719369 -3.54264 63.546000 Cu 0.963854 0.419304 0.5 928 63.546 0.00167617 -3.53914 63.546000 Cu 0.910043 0.436608 0.5 956 63.546 0.0120057 -3.54157 63.546000 Cu 0.972863 0.434554 1 957 63.546 0.0131206 -3.53732 63.546000 Cu 0.839231 0.423532 0.5 986 63.546 0.0131299 -3.54311 63.546000 Cu 0.846399 0.438745 7.67038e-17 1017 63.546 0.0197313 -3.54109 63.546000 Cu 0.161887 0.444829 6.01127e-19 962 63.546 0.035783 -3.52143 63.546000 Cu 0.0435326 0.448251 3.29418e-17 958 63.546 0.050066 -3.53146 63.546000 Cu 0.102925 0.446624 0.5 964 63.546 0.0304889 -3.52724 63.546000 Cu 0.0580898 0.480317 1 990 63.546 0.0985161 -3.53073 63.546000 Cu 0.0521159 0.464235 0.5 991 63.546 0.0919412 -3.53062 63.546000 Cu 0.111708 0.463265 0 993 63.546 0.0869209 -3.52589 63.546000 Cu 0.119368 0.479943 0.5 996 63.546 0.203783 -3.51648 63.546000 Cu 0.178725 0.479292 3.7871e-17 994 63.546 0.522814 -3.46996 63.546000 Cu 0.168928 0.461355 0.5 995 63.546 0.0867412 -3.49519 63.546000 Cu 0.227032 0.459028 1 997 63.546 0.223296 -3.5072 63.546000 Cu 0.295317 0.471159 1.60501e-16 998 63.546 0.838663 -3.45225 63.546000 Cu 0.289106 0.456189 0.5 999 63.546 0.119621 -3.53496 63.546000 Cu 0.233564 0.475626 0.5 1000 63.546 0.932411 -3.43156 63.546000 Cu 0.353521 0.453612 1 1001 63.546 0.0255621 -3.53265 63.546000 Cu 0.426392 0.466312 1 1002 63.546 0.0580326 -3.53553 63.546000 Cu 0.418696 0.451507 0.5 1003 63.546 0.0306993 -3.53528 63.546000 Cu 0.361586 0.468038 0.5 1004 63.546 0.089655 -3.51166 63.546000 Cu 0.48201 0.44982 1.03033e-16 1005 63.546 0.0459518 -3.53712 63.546000 Cu 0.490638 0.465055 0.5 1008 63.546 0.116226 -3.52431 63.546000 Cu 0.496367 0.480544 7.15341e-17 1031 63.546 0.111728 -3.53202 63.546000 Cu 0.434161 0.48085 0.5 1029 63.546 0.293597 -3.50906 63.546000 Cu 0.661887 0.444829 0.5 1011 63.546 0.035783 -3.52143 63.546000 Cu 0.619368 0.479943 1.62905e-16 516 63.546 0.203783 -3.51648 63.546000 Cu 0.55809 0.480317 0.5 518 63.546 0.0985161 -3.53073 63.546000 Cu 0.552116 0.464235 6.01127e-19 1006 63.546 0.0919412 -3.53062 63.546000 Cu 0.543533 0.448251 0.5 1007 63.546 0.050066 -3.53146 63.546000 Cu 0.602925 0.446624 6.42004e-17 1009 63.546 0.0304889 -3.52724 63.546000 Cu 0.611708 0.463265 0.5 1012 63.546 0.0869209 -3.52589 63.546000 Cu 0.795317 0.471159 0.5 10 63.546 0.838663 -3.45225 63.546000 Cu 0.733564 0.475626 1.19023e-17 13 63.546 0.932411 -3.43156 63.546000 Cu 0.678725 0.479292 0.5 504 63.546 0.522814 -3.46996 63.546000 Cu 0.668928 0.461355 0 1010 63.546 0.0867412 -3.49519 63.546000 Cu 0.789106 0.456189 5.56644e-17 1014 63.546 0.119621 -3.53496 63.546000 Cu 0.727032 0.459028 0.5 1016 63.546 0.223296 -3.5072 63.546000 Cu 0.861586 0.468038 3.88328e-17 2 63.546 0.089655 -3.51166 63.546000 Cu 0.918696 0.451507 1.06159e-16 955 63.546 0.0306993 -3.53528 63.546000 Cu 0.98201 0.44982 0.5 960 63.546 0.0459518 -3.53712 63.546000 Cu 0.926392 0.466312 0.5 988 63.546 0.0580326 -3.53553 63.546000 Cu 0.990638 0.465055 2.32035e-17 989 63.546 0.116226 -3.52431 63.546000 Cu 0.996367 0.480544 0.5 992 63.546 0.111728 -3.53202 63.546000 Cu 0.853521 0.453612 0.5 1018 63.546 0.0255621 -3.53265 63.546000 Cu 0.934161 0.48085 1.42828e-16 987 63.546 0.293597 -3.50906 63.546000 Cu 0.0567847 0.512038 6.01127e-19 7 63.546 0.0860857 -3.52868 63.546000 Cu 0.117841 0.51259 0.5 9 63.546 0.15513 -3.51566 63.546000 Cu 0.0600921 0.496179 0.5 1022 63.546 0.121494 -3.53427 63.546000 Cu 0.123155 0.496249 1 1023 63.546 0.383869 -3.52068 63.546000 Cu 0.177434 0.513323 1.37418e-16 11 63.546 0.547591 -3.46407 63.546000 Cu 0.301608 0.505966 0.5 15 63.546 9.51172 -3.34029 63.546000 Cu 0.188436 0.49641 0.5 1024 63.546 2.41568 -3.516 63.546000 Cu 0.251386 0.494942 1 1025 63.546 7.94135 -3.54296 63.546000 Cu 0.305044 0.485529 0.5 1026 63.546 8.89944 -3.30865 63.546000 Cu 0.232178 0.516884 0.5 16 63.546 1.43706 -3.40111 63.546000 Cu 0.364848 0.509293 3.8953e-17 17 63.546 4.93802 -3.45749 63.546000 Cu 0.432915 0.511264 0.5 19 63.546 0.363716 -3.49955 63.546000 Cu 0.495244 0.511686 5.4943e-17 21 63.546 0.122088 -3.52945 63.546000 Cu 0.367521 0.48247 3.99148e-17 1027 63.546 4.43577 -3.46133 63.546000 Cu 0.436644 0.496086 2.28188e-16 1028 63.546 0.414329 -3.49936 63.546000 Cu 0.376656 0.496048 0.5 1030 63.546 6.26768 -3.22103 63.546000 Cu 0.497918 0.496098 0.5 517 63.546 0.0837671 -3.53389 63.546000 Cu 0.556785 0.512038 0.5 23 63.546 0.0860857 -3.52868 63.546000 Cu 0.617841 0.51259 6.01127e-19 25 63.546 0.15513 -3.51566 63.546000 Cu 0.623155 0.496249 0.5 502 63.546 0.383869 -3.52068 63.546000 Cu 0.560092 0.496179 1 1032 63.546 0.121494 -3.53427 63.546000 Cu 0.801608 0.505966 6.01127e-19 3 63.546 9.51172 -3.34029 63.546000 Cu 0.751386 0.494942 0.5 4 63.546 7.94135 -3.54296 63.546000 Cu 0.805044 0.485529 6.01127e-19 12 63.546 8.89944 -3.30865 63.546000 Cu 0.677434 0.513323 0.5 27 63.546 0.547591 -3.46407 63.546000 Cu 0.688436 0.49641 1.15416e-17 508 63.546 2.41568 -3.516 63.546000 Cu 0.732178 0.516884 6.01127e-19 29 63.546 1.43706 -3.40111 63.546000 Cu 0.997918 0.496098 6.01127e-19 1021 63.546 0.0837671 -3.53389 63.546000 Cu 0.867521 0.48247 0.5 1 63.546 4.43577 -3.46133 63.546000 Cu 0.932915 0.511264 0 5 63.546 0.363716 -3.49955 63.546000 Cu 0.864848 0.509293 0.5 6 63.546 4.93802 -3.45749 63.546000 Cu 0.995244 0.511686 0.5 8 63.546 0.122088 -3.52945 63.546000 Cu 0.876656 0.496048 2.30111e-16 1019 63.546 6.26768 -3.22103 63.546000 Cu 0.936644 0.496086 0.5 1020 63.546 0.414329 -3.49936 63.546000 Cu 0.0407229 0.544016 7.74251e-17 38 63.546 0.0475869 -3.52949 63.546000 Cu 0.0498699 0.528126 0.5 39 63.546 0.080273 -3.52819 63.546000 Cu 0.109514 0.529189 0 41 63.546 0.0671098 -3.52762 63.546000 Cu 0.100342 0.545705 0.5 42 63.546 0.0319609 -3.52714 63.546000 Cu 0.159528 0.54747 0 43 63.546 0.0327625 -3.52412 63.546000 Cu 0.293021 0.5207 0 14 63.546 1.23956 -3.4507 63.546000 Cu 0.166986 0.531083 0.5 44 63.546 0.0866839 -3.50367 63.546000 Cu 0.225329 0.533348 6.01127e-19 45 63.546 0.172955 -3.50138 63.546000 Cu 0.280856 0.551222 0 46 63.546 0.0217715 -3.53956 63.546000 Cu 0.286913 0.535827 0.5 47 63.546 0.0876045 -3.53781 63.546000 Cu 0.21957 0.549314 0.5 48 63.546 0.0222662 -3.53363 63.546000 Cu 0.423772 0.525675 1.00629e-16 18 63.546 0.0520854 -3.53694 63.546000 Cu 0.358839 0.523723 0.5 20 63.546 0.0604907 -3.51754 63.546000 Cu 0.488446 0.527177 0.5 24 63.546 0.128483 -3.52068 63.546000 Cu 0.350737 0.538275 0 49 63.546 0.0256041 -3.53458 63.546000 Cu 0.415511 0.540455 0.5 51 63.546 0.0189132 -3.53613 63.546000 Cu 0.343524 0.553278 0.5 52 63.546 0.0190778 -3.54229 63.546000 Cu 0.478894 0.542306 6.01127e-19 53 63.546 0.0350228 -3.53705 63.546000 Cu 0.406745 0.555407 1.65911e-17 50 63.546 0.0109296 -3.54211 63.546000 Cu 0.54987 0.528126 6.01127e-19 22 63.546 0.080273 -3.52819 63.546000 Cu 0.609514 0.529189 0.5 28 63.546 0.0671098 -3.52762 63.546000 Cu 0.540723 0.544016 0.5 55 63.546 0.0475869 -3.52949 63.546000 Cu 0.600342 0.545705 0 57 63.546 0.0319609 -3.52714 63.546000 Cu 0.659528 0.54747 0.5 59 63.546 0.0327625 -3.52412 63.546000 Cu 0.666986 0.531083 1 26 63.546 0.0866839 -3.50367 63.546000 Cu 0.786913 0.535827 8.71634e-17 30 63.546 0.0876045 -3.53781 63.546000 Cu 0.793021 0.5207 0.5 31 63.546 1.23956 -3.4507 63.546000 Cu 0.725329 0.533348 0.5 32 63.546 0.172955 -3.50138 63.546000 Cu 0.71957 0.549314 6.01127e-19 61 63.546 0.0222662 -3.53363 63.546000 Cu 0.780856 0.551222 0.5 63 63.546 0.0217715 -3.53956 63.546000 Cu 0.858839 0.523723 1.10126e-16 33 63.546 0.0604907 -3.51754 63.546000 Cu 0.915511 0.540455 8.17533e-18 34 63.546 0.0189132 -3.53613 63.546000 Cu 0.923772 0.525675 0.5 35 63.546 0.0520854 -3.53694 63.546000 Cu 0.850737 0.538275 0.5 36 63.546 0.0256041 -3.53458 63.546000 Cu 0.988446 0.527177 1 37 63.546 0.128483 -3.52068 63.546000 Cu 0.978894 0.542306 0.5 40 63.546 0.0350228 -3.53705 63.546000 Cu 0.843524 0.553278 5.87902e-17 65 63.546 0.0190778 -3.54229 63.546000 Cu 0.906745 0.555407 0.5 67 63.546 0.0109296 -3.54211 63.546000 Cu 0.0221121 0.574925 2.10394e-17 70 63.546 0.00233339 -3.53673 63.546000 Cu 0.0309932 0.559566 0.5 71 63.546 0.0106436 -3.53416 63.546000 Cu 0.0918727 0.561498 6.01127e-19 73 63.546 0.0163739 -3.52881 63.546000 Cu 0.083599 0.576935 0.5 74 63.546 0.00439916 -3.53546 63.546000 Cu 0.144917 0.5788 2.15203e-17 75 63.546 0.00376162 -3.53592 63.546000 Cu 0.152462 0.56329 0.5 76 63.546 0.0109073 -3.53169 63.546000 Cu 0.0136736 0.590231 0.5 103 63.546 0.000641813 -3.5394 63.546000 Cu 0.0754408 0.592273 1 105 63.546 0.00125414 -3.53869 63.546000 Cu 0.213247 0.565005 0 77 63.546 0.00333984 -3.5361 63.546000 Cu 0.267501 0.582282 1.2251e-16 78 63.546 0.000896994 -3.54052 63.546000 Cu 0.274495 0.566734 0.5 79 63.546 0.00427886 -3.54001 63.546000 Cu 0.206202 0.580559 0.5 80 63.546 0.00163686 -3.53838 63.546000 Cu 0.328833 0.584091 0.5 84 63.546 0.00255623 -3.54145 63.546000 Cu 0.469459 0.557524 0.5 56 63.546 0.00787818 -3.5384 63.546000 Cu 0.336264 0.568589 2.46462e-17 81 63.546 0.00990541 -3.54254 63.546000 Cu 0.390288 0.586042 0 82 63.546 0.00345107 -3.5414 63.546000 Cu 0.398314 0.570629 0.5 83 63.546 0.00719678 -3.54254 63.546000 Cu 0.460328 0.572788 1 85 63.546 0.00153774 -3.54003 63.546000 Cu 0.451909 0.58812 0.5 88 63.546 0.00190875 -3.54061 63.546000 Cu 0.530993 0.559566 2.40451e-17 54 63.546 0.0106436 -3.53416 63.546000 Cu 0.652462 0.56329 2.33237e-17 58 63.546 0.0109073 -3.53169 63.546000 Cu 0.591873 0.561498 0.5 60 63.546 0.0163739 -3.52881 63.546000 Cu 0.513674 0.590231 0 86 63.546 0.000641813 -3.5394 63.546000 Cu 0.522112 0.574925 0.5 87 63.546 0.00233339 -3.53673 63.546000 Cu 0.583599 0.576935 6.01127e-19 89 63.546 0.00439916 -3.53546 63.546000 Cu 0.644917 0.5788 0.5 91 63.546 0.00376162 -3.53592 63.546000 Cu 0.575441 0.592273 0.5 92 63.546 0.00125414 -3.53869 63.546000 Cu 0.774495 0.566734 1 62 63.546 0.00427886 -3.54001 63.546000 Cu 0.713247 0.565005 0.5 64 63.546 0.00333984 -3.5361 63.546000 Cu 0.706202 0.580559 6.01127e-19 93 63.546 0.00163686 -3.53838 63.546000 Cu 0.767501 0.582282 0.5 95 63.546 0.000896994 -3.54052 63.546000 Cu 0.828833 0.584091 1 97 63.546 0.00255623 -3.54145 63.546000 Cu 0.898314 0.570629 7.06925e-17 66 63.546 0.00719678 -3.54254 63.546000 Cu 0.836264 0.568589 0.5 68 63.546 0.00990541 -3.54254 63.546000 Cu 0.969459 0.557524 1.22149e-16 69 63.546 0.00787818 -3.5384 63.546000 Cu 0.960328 0.572788 0.5 72 63.546 0.00153774 -3.54003 63.546000 Cu 0.890288 0.586042 0.5 99 63.546 0.00345107 -3.5414 63.546000 Cu 0.951909 0.58812 6.01127e-19 101 63.546 0.00190875 -3.54061 63.546000 Cu 0.00558939 0.605558 6.01127e-19 102 63.546 0.000922887 -3.5404 63.546000 Cu 0.0674003 0.607578 0.5 106 63.546 0.000234987 -3.53992 63.546000 Cu 0.129213 0.609544 1 107 63.546 0.000442415 -3.53951 63.546000 Cu 0.137134 0.5942 0.5 108 63.546 0.00178829 -3.53891 63.546000 Cu 0.0595358 0.622919 6.01127e-19 137 63.546 0.000217589 -3.5407 63.546000 Cu 0.121297 0.624885 0.5 140 63.546 7.51684e-05 -3.54002 63.546000 Cu 0.198661 0.596029 2.52473e-17 109 63.546 0.0013037 -3.53952 63.546000 Cu 0.252346 0.613309 0 110 63.546 0.000634994 -3.53891 63.546000 Cu 0.260045 0.597827 0.5 111 63.546 0.000659938 -3.5399 63.546000 Cu 0.190889 0.611451 0.5 112 63.546 0.000920863 -3.53915 63.546000 Cu 0.321283 0.599641 2.83732e-17 113 63.546 0.000348595 -3.54005 63.546000 Cu 0.313645 0.615167 0.5 116 63.546 0.000189151 -3.53905 63.546000 Cu 0.182986 0.626826 1 141 63.546 0.000216155 -3.53928 63.546000 Cu 0.244534 0.628744 0.5 143 63.546 0.00034567 -3.53904 63.546000 Cu 0.374901 0.617052 2.62091e-17 114 63.546 0.000184 -3.53966 63.546000 Cu 0.382538 0.601539 0.5 115 63.546 0.00109559 -3.54047 63.546000 Cu 0.443959 0.603527 3.82317e-17 117 63.546 0.00144509 -3.54062 63.546000 Cu 0.497823 0.620942 6.01127e-19 118 63.546 0.000550647 -3.54085 63.546000 Cu 0.436252 0.618977 0.5 120 63.546 0.000635132 -3.54036 63.546000 Cu 0.637134 0.5942 6.01127e-19 90 63.546 0.00178829 -3.53891 63.546000 Cu 0.505589 0.605558 0.5 119 63.546 0.000922887 -3.5404 63.546000 Cu 0.5674 0.607578 8.34364e-17 121 63.546 0.000234987 -3.53992 63.546000 Cu 0.621297 0.624885 4.68879e-18 122 63.546 7.51684e-05 -3.54002 63.546000 Cu 0.629213 0.609544 0.5 123 63.546 0.000442415 -3.53951 63.546000 Cu 0.559536 0.622919 0.5 124 63.546 0.000217589 -3.5407 63.546000 Cu 0.760045 0.597827 8.65623e-17 94 63.546 0.000659938 -3.5399 63.546000 Cu 0.698661 0.596029 0.5 96 63.546 0.0013037 -3.53952 63.546000 Cu 0.821283 0.599641 0.5 100 63.546 0.000348595 -3.54005 63.546000 Cu 0.690889 0.611451 1.56293e-18 125 63.546 0.000920863 -3.53915 63.546000 Cu 0.744534 0.628744 3.60676e-18 126 63.546 0.00034567 -3.53904 63.546000 Cu 0.752346 0.613309 0.5 127 63.546 0.000634994 -3.53891 63.546000 Cu 0.682986 0.626826 0.5 128 63.546 0.000216155 -3.53928 63.546000 Cu 0.813645 0.615167 6.01127e-19 129 63.546 0.000189151 -3.53905 63.546000 Cu 0.882538 0.601539 1.2251e-16 98 63.546 0.00109559 -3.54047 63.546000 Cu 0.943959 0.603527 0.5 104 63.546 0.00144509 -3.54062 63.546000 Cu 0.874901 0.617052 0.5 131 63.546 0.000184 -3.53966 63.546000 Cu 0.936252 0.618977 6.01127e-19 133 63.546 0.000635132 -3.54036 63.546000 Cu 0.997823 0.620942 0.5 135 63.546 0.000550647 -3.54085 63.546000 Cu 0.113465 0.640252 1 138 63.546 8.64969e-05 -3.54047 63.546000 Cu 0.0517848 0.638298 0.5 139 63.546 0.000228025 -3.5407 63.546000 Cu 0.0441227 0.65371 1 169 63.546 0.000103178 -3.54047 63.546000 Cu 0.1057 0.655647 0.5 171 63.546 9.62807e-05 -3.54044 63.546000 Cu 0.23669 0.644152 0 142 63.546 9.14249e-05 -3.53984 63.546000 Cu 0.175116 0.642205 0.5 144 63.546 4.07979e-05 -3.54012 63.546000 Cu 0.305948 0.630642 1.39101e-16 145 63.546 0.000234947 -3.53914 63.546000 Cu 0.298193 0.64608 0.5 148 63.546 0.000148263 -3.53972 63.546000 Cu 0.167292 0.6576 0 173 63.546 2.10637e-05 -3.54027 63.546000 Cu 0.228878 0.659553 0.5 175 63.546 2.39725e-05 -3.53999 63.546000 Cu 0.290432 0.661494 9.72623e-17 177 63.546 8.19729e-05 -3.53973 63.546000 Cu 0.359652 0.647992 1.59178e-16 146 63.546 0.000120333 -3.5397 63.546000 Cu 0.367292 0.632535 0.5 147 63.546 7.10332e-05 -3.53944 63.546000 Cu 0.428688 0.63444 6.01127e-19 149 63.546 9.66403e-05 -3.54001 63.546000 Cu 0.482585 0.651793 1 150 63.546 3.4271e-05 -3.54019 63.546000 Cu 0.490164 0.636358 0.5 151 63.546 0.000276994 -3.5405 63.546000 Cu 0.421093 0.64989 0.5 152 63.546 3.25046e-05 -3.53985 63.546000 Cu 0.351969 0.663414 0.5 179 63.546 7.7536e-05 -3.53957 63.546000 Cu 0.413481 0.665321 1 181 63.546 3.29475e-05 -3.53969 63.546000 Cu 0.551785 0.638298 0 153 63.546 0.000228025 -3.5407 63.546000 Cu 0.6057 0.655647 0 154 63.546 9.62807e-05 -3.54044 63.546000 Cu 0.613465 0.640252 0.5 155 63.546 8.64969e-05 -3.54047 63.546000 Cu 0.544123 0.65371 0.5 156 63.546 0.000103178 -3.54047 63.546000 Cu 0.805948 0.630642 0.5 132 63.546 0.000234947 -3.53914 63.546000 Cu 0.675116 0.642205 6.01127e-19 157 63.546 4.07979e-05 -3.54012 63.546000 Cu 0.728878 0.659553 1 158 63.546 2.39725e-05 -3.53999 63.546000 Cu 0.73669 0.644152 0.5 159 63.546 9.14249e-05 -3.53984 63.546000 Cu 0.667292 0.6576 0.5 160 63.546 2.10637e-05 -3.54027 63.546000 Cu 0.798193 0.64608 6.01127e-19 161 63.546 0.000148263 -3.53972 63.546000 Cu 0.790432 0.661494 0.5 164 63.546 8.19729e-05 -3.53973 63.546000 Cu 0.867292 0.632535 1.21187e-16 130 63.546 7.10332e-05 -3.53944 63.546000 Cu 0.990164 0.636358 7.98297e-17 134 63.546 0.000276994 -3.5405 63.546000 Cu 0.928688 0.63444 0.5 136 63.546 9.66403e-05 -3.54001 63.546000 Cu 0.851969 0.663414 6.69655e-17 162 63.546 7.7536e-05 -3.53957 63.546000 Cu 0.859652 0.647992 0.5 163 63.546 0.000120333 -3.5397 63.546000 Cu 0.921093 0.64989 6.01127e-19 165 63.546 3.25046e-05 -3.53985 63.546000 Cu 0.982585 0.651793 0.5 167 63.546 3.4271e-05 -3.54019 63.546000 Cu 0.913481 0.665321 0.5 168 63.546 3.29475e-05 -3.53969 63.546000 Cu 0.0979973 0.671063 0 170 63.546 3.84724e-05 -3.54029 63.546000 Cu 0.0364804 0.669136 0.5 172 63.546 2.20291e-05 -3.54013 63.546000 Cu 0.159533 0.673002 0.5 176 63.546 4.66445e-05 -3.54027 63.546000 Cu 0.0288272 0.684562 7.44195e-17 201 63.546 4.95897e-06 -3.53998 63.546000 Cu 0.0826707 0.701896 5.04947e-17 202 63.546 8.87672e-06 -3.53979 63.546000 Cu 0.0903189 0.686484 0.5 203 63.546 1.57283e-05 -3.54015 63.546000 Cu 0.0211664 0.699977 0.5 204 63.546 1.38727e-05 -3.53979 63.546000 Cu 0.151847 0.688414 1 205 63.546 2.08035e-05 -3.5403 63.546000 Cu 0.221111 0.674948 0 174 63.546 1.86943e-05 -3.54014 63.546000 Cu 0.282703 0.676889 0.5 180 63.546 1.08298e-05 -3.53994 63.546000 Cu 0.213406 0.690348 0.5 207 63.546 1.45178e-05 -3.54037 63.546000 Cu 0.274991 0.692283 1 209 63.546 3.7197e-06 -3.54032 63.546000 Cu 0.344285 0.678817 9.82241e-17 178 63.546 2.95222e-05 -3.53988 63.546000 Cu 0.467337 0.682647 0 182 63.546 1.41754e-05 -3.5399 63.546000 Cu 0.474988 0.667224 0.5 183 63.546 1.25172e-05 -3.53993 63.546000 Cu 0.405831 0.680734 0.5 184 63.546 3.30737e-05 -3.53986 63.546000 Cu 0.336569 0.694214 0.5 211 63.546 8.0064e-06 -3.54021 63.546000 Cu 0.39813 0.696139 5.56644e-17 213 63.546 2.13902e-05 -3.54005 63.546000 Cu 0.459657 0.698059 0.5 215 63.546 2.15063e-05 -3.53989 63.546000 Cu 0.53648 0.669136 1.20225e-17 185 63.546 2.20291e-05 -3.54013 63.546000 Cu 0.590319 0.686484 1 186 63.546 1.57283e-05 -3.54015 63.546000 Cu 0.597997 0.671063 0.5 187 63.546 3.84724e-05 -3.54029 63.546000 Cu 0.528827 0.684562 0.5 188 63.546 4.95897e-06 -3.53998 63.546000 Cu 0.659533 0.673002 0 189 63.546 4.66445e-05 -3.54027 63.546000 Cu 0.651847 0.688414 0.5 192 63.546 2.08035e-05 -3.5403 63.546000 Cu 0.521166 0.699977 0 217 63.546 1.38727e-05 -3.53979 63.546000 Cu 0.582671 0.701896 0.5 219 63.546 8.87672e-06 -3.53979 63.546000 Cu 0.713406 0.690348 6.01127e-19 190 63.546 1.45178e-05 -3.54037 63.546000 Cu 0.721111 0.674948 0.5 191 63.546 1.86943e-05 -3.54014 63.546000 Cu 0.782703 0.676889 1.33089e-16 193 63.546 1.08298e-05 -3.53994 63.546000 Cu 0.774991 0.692283 0.5 196 63.546 3.7197e-06 -3.54032 63.546000 Cu 0.974988 0.667224 6.01127e-19 166 63.546 1.25172e-05 -3.53993 63.546000 Cu 0.836569 0.694214 2.69305e-17 194 63.546 8.0064e-06 -3.54021 63.546000 Cu 0.844285 0.678817 0.5 195 63.546 2.95222e-05 -3.53988 63.546000 Cu 0.905831 0.680734 6.01127e-19 197 63.546 3.30737e-05 -3.53986 63.546000 Cu 0.959657 0.698059 2.17608e-17 198 63.546 2.15063e-05 -3.53989 63.546000 Cu 0.967337 0.682647 0.5 199 63.546 1.41754e-05 -3.5399 63.546000 Cu 0.89813 0.696139 0.5 200 63.546 2.13902e-05 -3.54005 63.546000 Cu 0.144193 0.70382 0.5 208 63.546 8.6992e-06 -3.53985 63.546000 Cu 0.0134894 0.715377 2.98159e-17 233 63.546 9.83755e-06 -3.53988 63.546000 Cu 0.0673269 0.73269 1.07722e-16 234 63.546 5.36066e-06 -3.53991 63.546000 Cu 0.0750148 0.717296 0.5 235 63.546 5.61336e-06 -3.53984 63.546000 Cu 0.00578895 0.730769 0.5 236 63.546 5.12044e-06 -3.53989 63.546000 Cu 0.136536 0.719216 0 237 63.546 2.17132e-06 -3.53979 63.546000 Cu 0.128858 0.73461 0.5 240 63.546 2.78388e-06 -3.53993 63.546000 Cu 0.20573 0.705747 1 206 63.546 9.99138e-06 -3.5399 63.546000 Cu 0.328845 0.709606 9.61803e-19 210 63.546 5.33493e-06 -3.53996 63.546000 Cu 0.267285 0.707676 0.5 212 63.546 7.30916e-06 -3.53995 63.546000 Cu 0.190387 0.73653 1.03033e-16 238 63.546 5.42955e-07 -3.53994 63.546000 Cu 0.198062 0.721138 0.5 239 63.546 2.34794e-06 -3.53975 63.546000 Cu 0.259596 0.723064 1.20225e-19 241 63.546 3.09598e-06 -3.53975 63.546000 Cu 0.313456 0.740378 0 242 63.546 1.65488e-06 -3.53989 63.546000 Cu 0.321142 0.724992 0.5 243 63.546 2.30411e-06 -3.53978 63.546000 Cu 0.251918 0.738453 0.5 244 63.546 7.8574e-07 -3.53993 63.546000 Cu 0.451953 0.713457 6.01127e-19 214 63.546 9.5408e-06 -3.5399 63.546000 Cu 0.390405 0.711533 0.5 216 63.546 7.05342e-06 -3.53995 63.546000 Cu 0.382693 0.726919 2.47544e-16 245 63.546 1.88941e-06 -3.53982 63.546000 Cu 0.444244 0.728845 0.5 247 63.546 3.14267e-06 -3.53986 63.546000 Cu 0.575015 0.717296 5.0134e-17 218 63.546 5.61336e-06 -3.53984 63.546000 Cu 0.513489 0.715377 0.5 220 63.546 9.83755e-06 -3.53988 63.546000 Cu 0.644193 0.70382 0 221 63.546 8.6992e-06 -3.53985 63.546000 Cu 0.636536 0.719216 0.5 224 63.546 2.17132e-06 -3.53979 63.546000 Cu 0.505789 0.730769 7.45397e-18 249 63.546 5.12044e-06 -3.53989 63.546000 Cu 0.567327 0.73269 0.5 251 63.546 5.36066e-06 -3.53991 63.546000 Cu 0.628858 0.73461 1 253 63.546 2.78388e-06 -3.53993 63.546000 Cu 0.698062 0.721138 1 222 63.546 2.34794e-06 -3.53975 63.546000 Cu 0.70573 0.705747 0.5 223 63.546 9.99138e-06 -3.5399 63.546000 Cu 0.767285 0.707676 1.06039e-16 225 63.546 7.30916e-06 -3.53995 63.546000 Cu 0.821142 0.724992 6.01127e-19 226 63.546 2.30411e-06 -3.53978 63.546000 Cu 0.828845 0.709606 0.5 227 63.546 5.33493e-06 -3.53996 63.546000 Cu 0.759596 0.723064 0.5 228 63.546 3.09598e-06 -3.53975 63.546000 Cu 0.690387 0.73653 0.5 255 63.546 5.42955e-07 -3.53994 63.546000 Cu 0.751918 0.738453 1 257 63.546 7.8574e-07 -3.53993 63.546000 Cu 0.813456 0.740378 0.5 259 63.546 1.65488e-06 -3.53989 63.546000 Cu 0.890405 0.711533 3.63081e-17 229 63.546 7.05342e-06 -3.53995 63.546000 Cu 0.944244 0.728845 9.99073e-17 230 63.546 3.14267e-06 -3.53986 63.546000 Cu 0.951953 0.713457 0.5 231 63.546 9.5408e-06 -3.5399 63.546000 Cu 0.882693 0.726919 0.5 232 63.546 1.88941e-06 -3.53982 63.546000 Cu 0.0519231 0.763456 1.86349e-17 266 63.546 1.81562e-06 -3.53968 63.546000 Cu 0.0596261 0.748075 0.5 267 63.546 8.97416e-07 -3.53971 63.546000 Cu 0.113469 0.765381 0.5 269 63.546 1.36321e-06 -3.53975 63.546000 Cu 0.121165 0.749997 6.39599e-17 270 63.546 1.71276e-06 -3.5398 63.546000 Cu 0.175017 0.767308 8.37971e-17 271 63.546 2.07435e-06 -3.53986 63.546000 Cu 0.182703 0.75192 0.5 272 63.546 1.40459e-06 -3.53993 63.546000 Cu 0.244241 0.753844 0 273 63.546 3.93799e-07 -3.54002 63.546000 Cu 0.298102 0.771161 6.37195e-17 274 63.546 1.45693e-06 -3.53998 63.546000 Cu 0.305777 0.755767 0.5 275 63.546 8.87527e-07 -3.54002 63.546000 Cu 0.236563 0.769235 0.5 276 63.546 2.22782e-06 -3.53996 63.546000 Cu 0.436542 0.744228 3.11384e-17 246 63.546 6.56986e-07 -3.53973 63.546000 Cu 0.374998 0.742303 0.5 248 63.546 1.63609e-06 -3.53982 63.546000 Cu 0.498085 0.746152 0.5 252 63.546 1.72957e-07 -3.53969 63.546000 Cu 0.367311 0.75769 9.25735e-18 277 63.546 2.83878e-06 -3.53993 63.546000 Cu 0.421156 0.775004 6.01127e-19 278 63.546 6.60656e-06 -3.53987 63.546000 Cu 0.428846 0.759612 0.5 279 63.546 4.12808e-06 -3.5398 63.546000 Cu 0.359631 0.773084 0.5 280 63.546 2.13413e-06 -3.53993 63.546000 Cu 0.490382 0.761534 6.01127e-19 281 63.546 3.61288e-06 -3.5397 63.546000 Cu 0.482681 0.776923 0.5 284 63.546 1.21186e-05 -3.53984 63.546000 Cu 0.559626 0.748075 6.01127e-19 250 63.546 8.97416e-07 -3.53971 63.546000 Cu 0.621165 0.749997 0.5 256 63.546 1.71276e-06 -3.5398 63.546000 Cu 0.551923 0.763456 0.5 283 63.546 1.81562e-06 -3.53968 63.546000 Cu 0.613469 0.765381 0 285 63.546 1.36321e-06 -3.53975 63.546000 Cu 0.682703 0.75192 0 254 63.546 1.40459e-06 -3.53993 63.546000 Cu 0.805777 0.755767 6.05936e-17 258 63.546 8.87527e-07 -3.54002 63.546000 Cu 0.744241 0.753844 0.5 260 63.546 3.93799e-07 -3.54002 63.546000 Cu 0.675017 0.767308 0.5 287 63.546 2.07435e-06 -3.53986 63.546000 Cu 0.736563 0.769235 1 289 63.546 2.22782e-06 -3.53996 63.546000 Cu 0.798102 0.771161 0.5 291 63.546 1.45693e-06 -3.53998 63.546000 Cu 0.874998 0.742303 1.04716e-16 261 63.546 1.63609e-06 -3.53982 63.546000 Cu 0.928846 0.759612 1.85147e-17 262 63.546 4.12808e-06 -3.5398 63.546000 Cu 0.936542 0.744228 0.5 263 63.546 6.56986e-07 -3.53973 63.546000 Cu 0.867311 0.75769 0.5 264 63.546 2.83878e-06 -3.53993 63.546000 Cu 0.998085 0.746152 6.01127e-19 265 63.546 1.72957e-07 -3.53969 63.546000 Cu 0.990382 0.761534 0.5 268 63.546 3.61288e-06 -3.5397 63.546000 Cu 0.859631 0.773084 1.67113e-17 293 63.546 2.13413e-06 -3.53993 63.546000 Cu 0.921156 0.775004 0.5 295 63.546 6.60656e-06 -3.53987 63.546000 Cu 0.982681 0.776923 1.54129e-16 297 63.546 1.21186e-05 -3.53984 63.546000 Cu 0.0365131 0.794243 1.08203e-17 298 63.546 2.27106e-05 -3.54005 63.546000 Cu 0.0442155 0.778843 0.5 299 63.546 1.41322e-05 -3.53984 63.546000 Cu 0.105763 0.780767 1.1193e-16 301 63.546 8.98314e-06 -3.53985 63.546000 Cu 0.0980455 0.796163 0.5 302 63.546 2.27342e-05 -3.54013 63.546000 Cu 0.159602 0.798086 1 303 63.546 1.65147e-05 -3.54014 63.546000 Cu 0.0288356 0.80966 0.5 331 63.546 2.01619e-05 -3.53996 63.546000 Cu 0.0903475 0.811572 8.37971e-17 333 63.546 3.4507e-05 -3.53994 63.546000 Cu 0.151892 0.813488 0.5 336 63.546 3.08863e-05 -3.53998 63.546000 Cu 0.167322 0.782695 0.5 304 63.546 4.19582e-06 -3.53986 63.546000 Cu 0.228882 0.784625 8.27151e-17 305 63.546 4.76755e-06 -3.53983 63.546000 Cu 0.282762 0.80195 6.46813e-17 306 63.546 1.67537e-05 -3.54009 63.546000 Cu 0.290434 0.786555 0.5 307 63.546 6.35772e-06 -3.53977 63.546000 Cu 0.221184 0.800016 0.5 308 63.546 8.67958e-06 -3.54011 63.546000 Cu 0.35197 0.788482 1.07481e-16 309 63.546 6.49453e-06 -3.53974 63.546000 Cu 0.405847 0.805817 5.69868e-17 310 63.546 1.71197e-05 -3.54008 63.546000 Cu 0.413487 0.790405 0.5 311 63.546 8.91255e-06 -3.53979 63.546000 Cu 0.344322 0.803885 0.5 312 63.546 2.6166e-05 -3.54007 63.546000 Cu 0.474998 0.792325 2.52473e-17 313 63.546 1.6434e-05 -3.53992 63.546000 Cu 0.467347 0.807743 0.5 316 63.546 7.51875e-06 -3.54006 63.546000 Cu 0.544215 0.778843 6.7206e-17 282 63.546 1.41322e-05 -3.53984 63.546000 Cu 0.605763 0.780767 0.5 288 63.546 8.98314e-06 -3.53985 63.546000 Cu 0.528836 0.80966 0 314 63.546 2.01619e-05 -3.53996 63.546000 Cu 0.536513 0.794243 0.5 315 63.546 2.27106e-05 -3.54005 63.546000 Cu 0.598046 0.796163 0 317 63.546 2.27342e-05 -3.54013 63.546000 Cu 0.651892 0.813488 0 318 63.546 3.08863e-05 -3.53998 63.546000 Cu 0.659602 0.798086 0.5 319 63.546 1.65147e-05 -3.54014 63.546000 Cu 0.590347 0.811572 0.5 320 63.546 3.4507e-05 -3.53994 63.546000 Cu 0.667322 0.782695 1 286 63.546 4.19582e-06 -3.53986 63.546000 Cu 0.790434 0.786555 2.1881e-17 290 63.546 6.35772e-06 -3.53977 63.546000 Cu 0.728882 0.784625 0.5 292 63.546 4.76755e-06 -3.53983 63.546000 Cu 0.721184 0.800016 0 321 63.546 8.67958e-06 -3.54011 63.546000 Cu 0.782762 0.80195 0.5 323 63.546 1.67537e-05 -3.54009 63.546000 Cu 0.913487 0.790405 8.89668e-18 294 63.546 8.91255e-06 -3.53979 63.546000 Cu 0.85197 0.788482 0.5 296 63.546 6.49453e-06 -3.53974 63.546000 Cu 0.974998 0.792325 0.5 300 63.546 1.6434e-05 -3.53992 63.546000 Cu 0.844322 0.803885 7.51409e-17 325 63.546 2.6166e-05 -3.54007 63.546000 Cu 0.905847 0.805817 0.5 327 63.546 1.71197e-05 -3.54008 63.546000 Cu 0.967347 0.807743 4.46036e-17 329 63.546 7.51875e-06 -3.54006 63.546000 Cu 0.0212099 0.825087 6.37195e-17 330 63.546 1.38216e-05 -3.53986 63.546000 Cu 0.0827061 0.82699 0.5 334 63.546 4.22445e-05 -3.5396 63.546000 Cu 0.144229 0.828895 6.01127e-19 335 63.546 7.36269e-05 -3.53949 63.546000 Cu 0.0136362 0.840521 0.5 363 63.546 5.52688e-05 -3.54018 63.546000 Cu 0.0751393 0.842424 5.57846e-17 365 63.546 3.85117e-05 -3.54006 63.546000 Cu 0.136616 0.844322 0.5 368 63.546 0.000141394 -3.53991 63.546000 Cu 0.213466 0.815412 1.80939e-16 337 63.546 1.78405e-05 -3.54013 63.546000 Cu 0.267326 0.832752 6.01127e-19 338 63.546 2.36617e-05 -3.53976 63.546000 Cu 0.275061 0.81735 0.5 339 63.546 1.12078e-05 -3.54028 63.546000 Cu 0.205768 0.830814 0.5 340 63.546 7.00775e-05 -3.53955 63.546000 Cu 0.328896 0.834704 0.5 344 63.546 8.53446e-06 -3.54009 63.546000 Cu 0.198072 0.846232 3.53463e-17 369 63.546 0.000195656 -3.53956 63.546000 Cu 0.259565 0.848158 0.5 371 63.546 0.000135091 -3.53966 63.546000 Cu 0.321131 0.850102 4.76093e-17 373 63.546 4.87625e-05 -3.54004 63.546000 Cu 0.336644 0.819297 1.59539e-16 341 63.546 3.45551e-05 -3.54048 63.546000 Cu 0.390504 0.83666 1 342 63.546 8.50908e-05 -3.54033 63.546000 Cu 0.398194 0.821242 0.5 343 63.546 4.58805e-05 -3.54047 63.546000 Cu 0.459711 0.823173 0 345 63.546 2.82106e-05 -3.54021 63.546000 Cu 0.452083 0.838601 0.5 348 63.546 0.000116884 -3.54032 63.546000 Cu 0.513636 0.840521 1 346 63.546 5.52688e-05 -3.54018 63.546000 Cu 0.52121 0.825087 0.5 347 63.546 1.38216e-05 -3.53986 63.546000 Cu 0.582706 0.82699 1.07121e-16 349 63.546 4.22445e-05 -3.5396 63.546000 Cu 0.636616 0.844322 0 350 63.546 0.000141394 -3.53991 63.546000 Cu 0.644229 0.828895 0.5 351 63.546 7.36269e-05 -3.53949 63.546000 Cu 0.575139 0.842424 0.5 352 63.546 3.85117e-05 -3.54006 63.546000 Cu 0.775061 0.81735 3.40238e-17 322 63.546 1.12078e-05 -3.54028 63.546000 Cu 0.713466 0.815412 0.5 324 63.546 1.78405e-05 -3.54013 63.546000 Cu 0.705768 0.830814 0 353 63.546 7.00775e-05 -3.53955 63.546000 Cu 0.759565 0.848158 1 354 63.546 0.000135091 -3.53966 63.546000 Cu 0.767326 0.832752 0.5 355 63.546 2.36617e-05 -3.53976 63.546000 Cu 0.698072 0.846232 0.5 356 63.546 0.000195656 -3.53956 63.546000 Cu 0.828896 0.834704 7.55015e-17 357 63.546 8.53446e-06 -3.54009 63.546000 Cu 0.821131 0.850102 0.5 360 63.546 4.87625e-05 -3.54004 63.546000 Cu 0.898194 0.821242 0 326 63.546 4.58805e-05 -3.54047 63.546000 Cu 0.836644 0.819297 0.5 328 63.546 3.45551e-05 -3.54048 63.546000 Cu 0.959711 0.823173 0.5 332 63.546 2.82106e-05 -3.54021 63.546000 Cu 0.890504 0.83666 0.5 359 63.546 8.50908e-05 -3.54033 63.546000 Cu 0.952083 0.838601 1 361 63.546 0.000116884 -3.54032 63.546000 Cu 0.00610842 0.855954 0 362 63.546 0.000235345 -3.54066 63.546000 Cu 0.0676429 0.85788 0.5 366 63.546 0.000141884 -3.54039 63.546000 Cu 0.129055 0.859791 8.17533e-18 367 63.546 7.50193e-05 -3.53988 63.546000 Cu 0.060198 0.873339 0 397 63.546 0.000654435 -3.53994 63.546000 Cu 0.0526577 0.888774 0.5 399 63.546 0.00127255 -3.54037 63.546000 Cu 0.121582 0.875279 0.5 400 63.546 0.000230392 -3.53922 63.546000 Cu 0.251806 0.863585 6.01127e-19 370 63.546 0.000413911 -3.53965 63.546000 Cu 0.190415 0.861686 0.5 372 63.546 0.000204629 -3.53963 63.546000 Cu 0.31335 0.865498 0.5 376 63.546 0.000305163 -3.53996 63.546000 Cu 0.182857 0.877179 6.01127e-19 401 63.546 0.000168906 -3.53901 63.546000 Cu 0.244161 0.879042 0.5 403 63.546 0.000640519 -3.53912 63.546000 Cu 0.305619 0.880893 8.4278e-17 405 63.546 0.00103548 -3.53929 63.546000 Cu 0.375036 0.867433 3.96744e-17 374 63.546 0.000124503 -3.54033 63.546000 Cu 0.382769 0.852055 0.5 375 63.546 5.77098e-05 -3.54051 63.546000 Cu 0.444465 0.854011 1.03875e-16 377 63.546 0.000171418 -3.54067 63.546000 Cu 0.498574 0.871365 1.38981e-16 378 63.546 0.000455534 -3.54047 63.546000 Cu 0.436826 0.86939 0.5 380 63.546 0.000153355 -3.54058 63.546000 Cu 0.367307 0.882781 0.5 407 63.546 0.000536504 -3.53915 63.546000 Cu 0.429125 0.884726 1.15897e-16 409 63.546 0.000209567 -3.53957 63.546000 Cu 0.490984 0.886734 0.5 411 63.546 0.000755611 -3.5402 63.546000 Cu 0.506108 0.855954 0.5 379 63.546 0.000235345 -3.54066 63.546000 Cu 0.567643 0.85788 2.30833e-17 381 63.546 0.000141884 -3.54039 63.546000 Cu 0.621582 0.875279 9.97871e-17 382 63.546 0.000230392 -3.53922 63.546000 Cu 0.629055 0.859791 0.5 383 63.546 7.50193e-05 -3.53988 63.546000 Cu 0.560198 0.873339 0.5 384 63.546 0.000654435 -3.53994 63.546000 Cu 0.552658 0.888774 6.01127e-19 413 63.546 0.00127255 -3.54037 63.546000 Cu 0.690415 0.861686 2.40451e-19 385 63.546 0.000204629 -3.53963 63.546000 Cu 0.744161 0.879042 1 386 63.546 0.000640519 -3.53912 63.546000 Cu 0.751806 0.863585 0.5 387 63.546 0.000413911 -3.53965 63.546000 Cu 0.682857 0.877179 0.5 388 63.546 0.000168906 -3.53901 63.546000 Cu 0.81335 0.865498 6.3479e-17 389 63.546 0.000305163 -3.53996 63.546000 Cu 0.805619 0.880893 0.5 392 63.546 0.00103548 -3.53929 63.546000 Cu 0.882769 0.852055 1 358 63.546 5.77098e-05 -3.54051 63.546000 Cu 0.944465 0.854011 0.5 364 63.546 0.000171418 -3.54067 63.546000 Cu 0.867307 0.882781 7.27364e-17 390 63.546 0.000536504 -3.53915 63.546000 Cu 0.875036 0.867433 0.5 391 63.546 0.000124503 -3.54033 63.546000 Cu 0.936826 0.86939 1 393 63.546 0.000153355 -3.54058 63.546000 Cu 0.990984 0.886734 1 394 63.546 0.000755611 -3.5402 63.546000 Cu 0.998574 0.871365 0.5 395 63.546 0.000455534 -3.54047 63.546000 Cu 0.929125 0.884726 0.5 396 63.546 0.000209567 -3.53957 63.546000 Cu 0.114148 0.890784 1.10848e-16 398 63.546 0.00126454 -3.54017 63.546000 Cu 0.0448485 0.904177 1 429 63.546 0.00140418 -3.54078 63.546000 Cu 0.0987011 0.921665 1 430 63.546 0.00708861 -3.5429 63.546000 Cu 0.10656 0.906272 0.5 431 63.546 0.00360889 -3.54213 63.546000 Cu 0.0365841 0.919509 0.5 432 63.546 0.00143898 -3.53946 63.546000 Cu 0.161049 0.923725 0.5 436 63.546 0.0112752 -3.5429 63.546000 Cu 0.236723 0.89453 6.01127e-19 402 63.546 0.000808777 -3.53966 63.546000 Cu 0.175428 0.892704 0.5 404 63.546 0.000610662 -3.53991 63.546000 Cu 0.298128 0.896318 0.5 408 63.546 0.00143286 -3.53896 63.546000 Cu 0.16818 0.908252 6.01127e-19 433 63.546 0.00369029 -3.54209 63.546000 Cu 0.223038 0.925609 4.60463e-17 434 63.546 0.00592521 -3.53976 63.546000 Cu 0.229647 0.910072 0.5 435 63.546 0.00110839 -3.54037 63.546000 Cu 0.290991 0.911792 1 437 63.546 0.00163709 -3.53796 63.546000 Cu 0.359683 0.898125 1.05798e-17 406 63.546 0.00204608 -3.53832 63.546000 Cu 0.483081 0.902069 1.42347e-16 410 63.546 0.000679251 -3.53924 63.546000 Cu 0.421341 0.900038 0.5 412 63.546 0.00160151 -3.53823 63.546000 Cu 0.352222 0.913543 0.5 439 63.546 0.00442479 -3.536 63.546000 Cu 0.413472 0.915395 3.57069e-17 441 63.546 0.00530579 -3.5352 63.546000 Cu 0.47484 0.917388 0.5 443 63.546 0.00299908 -3.53578 63.546000 Cu 0.60656 0.906272 6.01127e-19 414 63.546 0.00360889 -3.54213 63.546000 Cu 0.614148 0.890784 0.5 415 63.546 0.00126454 -3.54017 63.546000 Cu 0.544849 0.904177 0.5 416 63.546 0.00140418 -3.54078 63.546000 Cu 0.536584 0.919509 0 445 63.546 0.00143898 -3.53946 63.546000 Cu 0.598701 0.921665 0.5 447 63.546 0.00708861 -3.5429 63.546000 Cu 0.661049 0.923725 1 449 63.546 0.0112752 -3.5429 63.546000 Cu 0.675428 0.892704 2.53676e-17 417 63.546 0.000610662 -3.53991 63.546000 Cu 0.729647 0.910072 0 418 63.546 0.00110839 -3.54037 63.546000 Cu 0.736723 0.89453 0.5 419 63.546 0.000808777 -3.53966 63.546000 Cu 0.66818 0.908252 0.5 420 63.546 0.00369029 -3.54209 63.546000 Cu 0.798128 0.896318 1 421 63.546 0.00143286 -3.53896 63.546000 Cu 0.790991 0.911792 0.5 424 63.546 0.00163709 -3.53796 63.546000 Cu 0.723038 0.925609 0.5 451 63.546 0.00592521 -3.53976 63.546000 Cu 0.852222 0.913543 1 422 63.546 0.00442479 -3.536 63.546000 Cu 0.859683 0.898125 0.5 423 63.546 0.00204608 -3.53832 63.546000 Cu 0.921341 0.900038 9.4978e-18 425 63.546 0.00160151 -3.53823 63.546000 Cu 0.97484 0.917388 4.95329e-17 426 63.546 0.00299908 -3.53578 63.546000 Cu 0.983081 0.902069 0.5 427 63.546 0.000679251 -3.53924 63.546000 Cu 0.913472 0.915395 0.5 428 63.546 0.00530579 -3.5352 63.546000 Cu 0.0277034 0.934775 6.01127e-19 461 63.546 0.0112047 -3.53815 63.546000 Cu 0.0820232 0.95177 1 462 63.546 0.0245082 -3.53601 63.546000 Cu 0.0905144 0.936849 0.5 463 63.546 0.011098 -3.5417 63.546000 Cu 0.018669 0.950035 0.5 464 63.546 0.0412558 -3.53767 63.546000 Cu 0.154007 0.938984 0 465 63.546 0.0191664 -3.54115 63.546000 Cu 0.147003 0.953907 0.5 468 63.546 0.0246239 -3.53243 63.546000 Cu 0.284378 0.927371 0.5 440 63.546 0.00407667 -3.53528 63.546000 Cu 0.211273 0.956447 0 466 63.546 0.109505 -3.53513 63.546000 Cu 0.217019 0.941097 0.5 467 63.546 0.0291245 -3.53896 63.546000 Cu 0.278468 0.943097 6.01127e-19 469 63.546 0.028893 -3.53262 63.546000 Cu 0.331492 0.96144 1 470 63.546 0.0854313 -3.49898 63.546000 Cu 0.273242 0.95916 0.5 472 63.546 0.204026 -3.50411 63.546000 Cu 0.345098 0.929097 0 438 63.546 0.0110545 -3.53127 63.546000 Cu 0.466271 0.932784 0 442 63.546 0.012342 -3.53371 63.546000 Cu 0.405571 0.930889 0.5 444 63.546 0.0159198 -3.52914 63.546000 Cu 0.338441 0.944972 0.5 471 63.546 0.0336586 -3.52251 63.546000 Cu 0.397561 0.946745 0 473 63.546 0.0312926 -3.52779 63.546000 Cu 0.457041 0.948411 0.5 475 63.546 0.048246 -3.53134 63.546000 Cu 0.590514 0.936849 1.20225e-19 446 63.546 0.011098 -3.5417 63.546000 Cu 0.527703 0.934775 0.5 448 63.546 0.0112047 -3.53815 63.546000 Cu 0.654007 0.938984 0.5 452 63.546 0.0191664 -3.54115 63.546000 Cu 0.518669 0.950035 1 477 63.546 0.0412558 -3.53767 63.546000 Cu 0.582023 0.95177 0.5 479 63.546 0.0245082 -3.53601 63.546000 Cu 0.647003 0.953907 0 481 63.546 0.0246239 -3.53243 63.546000 Cu 0.717019 0.941097 1 450 63.546 0.0291245 -3.53896 63.546000 Cu 0.784378 0.927371 0 453 63.546 0.00407667 -3.53528 63.546000 Cu 0.778468 0.943097 0.5 456 63.546 0.028893 -3.53262 63.546000 Cu 0.711273 0.956447 0.5 483 63.546 0.109505 -3.53513 63.546000 Cu 0.773242 0.95916 1.2263e-16 485 63.546 0.204026 -3.50411 63.546000 Cu 0.831492 0.96144 0.5 487 63.546 0.0854313 -3.49898 63.546000 Cu 0.838441 0.944972 6.14352e-17 454 63.546 0.0336586 -3.52251 63.546000 Cu 0.845098 0.929097 0.5 455 63.546 0.0110545 -3.53127 63.546000 Cu 0.905571 0.930889 1 457 63.546 0.0159198 -3.52914 63.546000 Cu 0.957041 0.948411 1.25515e-16 458 63.546 0.048246 -3.53134 63.546000 Cu 0.966271 0.932784 0.5 459 63.546 0.012342 -3.53371 63.546000 Cu 0.897561 0.946745 0.5 460 63.546 0.0312926 -3.52779 63.546000 Cu 0.00994969 0.965219 7.81465e-18 493 63.546 0.11923 -3.52394 63.546000 Cu 0.0662272 0.981067 1 494 63.546 0.319156 -3.50596 63.546000 Cu 0.0742565 0.96658 0.5 495 63.546 0.0554936 -3.5359 63.546000 Cu 0.0040433 0.980727 0.5 496 63.546 0.11156 -3.53172 63.546000 Cu 0.139082 0.96838 1 497 63.546 0.077633 -3.51369 63.546000 Cu 0.133359 0.982809 0.5 500 63.546 4.61628 -3.45734 63.546000 Cu 0.0634779 0.996289 0.5 521 63.546 0.410309 -3.49944 63.546000 Cu 0.123423 0.996259 1 522 63.546 6.33113 -3.22089 63.546000 Cu 0.0022521 0.996306 1.22269e-16 520 63.546 0.0827502 -3.53431 63.546000 Cu 0.312075 0.996288 5.02542e-17 530 63.546 2.1998 -3.51422 63.546000 Cu 0.249132 0.996087 0.5 531 63.546 8.29186 -3.54376 63.546000 Cu 0.196218 0.986005 1 498 63.546 9.13745 -3.3207 63.546000 Cu 0.205218 0.971456 0.5 499 63.546 0.97465 -3.45034 63.546000 Cu 0.266839 0.975738 1 501 63.546 1.05982 -3.41844 63.546000 Cu 0.321669 0.979301 0.5 503 63.546 0.502933 -3.46911 63.546000 Cu 0.377233 0.996267 0.5 532 63.546 0.348547 -3.52118 63.546000 Cu 0.388889 0.963337 0.5 476 63.546 0.0761162 -3.52749 63.546000 Cu 0.448471 0.964365 1 474 63.546 0.087404 -3.5307 63.546000 Cu 0.381218 0.979952 0 505 63.546 0.178424 -3.51796 63.546000 Cu 0.440122 0.99628 4.67677e-17 506 63.546 0.118048 -3.53438 63.546000 Cu 0.442475 0.980431 0.5 507 63.546 0.0872263 -3.53048 63.546000 Cu 0.502252 0.996306 0.5 512 63.546 0.0827502 -3.53431 63.546000 Cu 0.574257 0.96658 6.01127e-19 478 63.546 0.0554936 -3.5359 63.546000 Cu 0.50995 0.965219 0.5 480 63.546 0.11923 -3.52394 63.546000 Cu 0.639082 0.96838 0.5 484 63.546 0.077633 -3.51369 63.546000 Cu 0.504043 0.980727 6.29981e-17 509 63.546 0.11156 -3.53172 63.546000 Cu 0.563478 0.996289 2.58485e-17 510 63.546 0.410309 -3.49944 63.546000 Cu 0.566227 0.981067 0.5 511 63.546 0.319156 -3.50596 63.546000 Cu 0.633359 0.982809 2.54878e-17 513 63.546 4.61628 -3.45734 63.546000 Cu 0.623423 0.996259 0.5 515 63.546 6.33113 -3.22089 63.546000 Cu 0.749132 0.996087 5.72273e-17 561 63.546 8.29186 -3.54376 63.546000 Cu 0.812075 0.996288 0.5 563 63.546 2.1998 -3.51422 63.546000 Cu 0.705218 0.971456 8.36769e-17 482 63.546 0.97465 -3.45034 63.546000 Cu 0.821669 0.979301 2.40451e-19 486 63.546 0.502933 -3.46911 63.546000 Cu 0.766839 0.975738 0.5 488 63.546 1.05982 -3.41844 63.546000 Cu 0.696218 0.986005 0.5 514 63.546 9.13745 -3.3207 63.546000 Cu 0.877233 0.996267 2.06788e-17 523 63.546 0.348547 -3.52118 63.546000 Cu 0.888889 0.963337 6.01127e-19 489 63.546 0.0761162 -3.52749 63.546000 Cu 0.942475 0.980431 6.01127e-19 490 63.546 0.0872263 -3.53048 63.546000 Cu 0.948471 0.964365 0.5 491 63.546 0.087404 -3.5307 63.546000 Cu 0.881218 0.979952 0.5 492 63.546 0.178424 -3.51796 63.546000 Cu 0.940122 0.99628 0.5 519 63.546 0.118048 -3.53438