Number of particles = 1032 A = 1 Angstrom (basic length-scale) H0(1,1) = 29.1641 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) = 3.60728 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 0.0669562 0.0115001 1.33088e-16 526 63.546 0.331521 -3.50285 63.546000 Cu 0.00466632 0.0118865 0.5 527 63.546 0.119749 -3.53024 63.546000 Cu 0.134344 0.0096606 0.5 529 63.546 4.73924 -3.46143 63.546000 Cu 0.0112196 0.0273655 5.86692e-17 537 63.546 0.123461 -3.52111 63.546000 Cu 0.0757783 0.0259652 0.5 539 63.546 0.0526789 -3.53597 63.546000 Cu 0.14066 0.0240988 2.00172e-16 541 63.546 0.0704622 -3.51518 63.546000 Cu 0.197126 0.00643994 1.27197e-16 528 63.546 9.28413 -3.32697 63.546000 Cu 0.206552 0.0209996 0.5 543 63.546 1.03974 -3.45143 63.546000 Cu 0.267638 0.0168581 3.763e-17 545 63.546 1.13383 -3.41471 63.546000 Cu 0.332713 0.031109 1.04474e-16 546 63.546 0.0864251 -3.49826 63.546000 Cu 0.32232 0.0132106 0.5 547 63.546 0.547376 -3.4676 63.546000 Cu 0.381922 0.0126154 2.75312e-17 549 63.546 0.167655 -3.51657 63.546000 Cu 0.389982 0.0292395 0.5 552 63.546 0.0830707 -3.52573 63.546000 Cu 0.449721 0.0282595 5.83085e-17 550 63.546 0.0855575 -3.52857 63.546000 Cu 0.443008 0.0121641 0.5 551 63.546 0.0921453 -3.52911 63.546000 Cu 0.504666 0.0118865 0 553 63.546 0.119749 -3.53024 63.546000 Cu 0.566956 0.0115001 0.5 555 63.546 0.331521 -3.50285 63.546000 Cu 0.51122 0.0273655 0.5 556 63.546 0.123461 -3.52111 63.546000 Cu 0.575778 0.0259652 1 554 63.546 0.0526789 -3.53597 63.546000 Cu 0.634344 0.0096606 1 557 63.546 4.73924 -3.46143 63.546000 Cu 0.706552 0.0209996 0 558 63.546 1.03974 -3.45143 63.546000 Cu 0.697126 0.00643994 0.5 559 63.546 9.28413 -3.32697 63.546000 Cu 0.64066 0.0240988 0.5 560 63.546 0.0704622 -3.51518 63.546000 Cu 0.82232 0.0132106 1 562 63.546 0.547376 -3.4676 63.546000 Cu 0.767638 0.0168581 0.5 564 63.546 1.13383 -3.41471 63.546000 Cu 0.832713 0.031109 0.5 595 63.546 0.0864251 -3.49826 63.546000 Cu 0.943008 0.0121641 4.18378e-17 524 63.546 0.0921453 -3.52911 63.546000 Cu 0.881922 0.0126154 0.5 525 63.546 0.167655 -3.51657 63.546000 Cu 0.889982 0.0292395 1 533 63.546 0.0830707 -3.52573 63.546000 Cu 0.949721 0.0282595 0.5 535 63.546 0.0855575 -3.52857 63.546000 Cu 0.0840002 0.0407535 6.26365e-17 538 63.546 0.0227121 -3.53564 63.546000 Cu 0.0206249 0.0425411 0.5 540 63.546 0.0381293 -3.53678 63.546000 Cu 0.0300859 0.0577726 6.55219e-17 569 63.546 0.0101039 -3.5377 63.546000 Cu 0.0929081 0.0556842 0.5 571 63.546 0.0104952 -3.54219 63.546000 Cu 0.212996 0.0360687 0 542 63.546 0.104774 -3.53741 63.546000 Cu 0.14895 0.0385928 0.5 544 63.546 0.0246844 -3.5342 63.546000 Cu 0.274663 0.0333634 0.5 548 63.546 0.197962 -3.50333 63.546000 Cu 0.156364 0.0535353 2.30829e-17 573 63.546 0.0202371 -3.54248 63.546000 Cu 0.219276 0.0514204 0.5 575 63.546 0.0314678 -3.54009 63.546000 Cu 0.28047 0.0494538 1.1289e-16 577 63.546 0.029099 -3.53369 63.546000 Cu 0.34748 0.063467 6.81668e-17 578 63.546 0.0126127 -3.53102 63.546000 Cu 0.340257 0.0475877 0.5 579 63.546 0.0341895 -3.52298 63.546000 Cu 0.2868 0.0651977 0.5 580 63.546 0.00462984 -3.53571 63.546000 Cu 0.399259 0.0458133 3.78705e-17 581 63.546 0.0310989 -3.52699 63.546000 Cu 0.407873 0.0616803 0.5 584 63.546 0.0178081 -3.52857 63.546000 Cu 0.468565 0.0597702 0 582 63.546 0.0125071 -3.53375 63.546000 Cu 0.458832 0.0441795 0.5 583 63.546 0.049718 -3.53007 63.546000 Cu 0.520625 0.0425411 1.20224e-19 585 63.546 0.0381293 -3.53678 63.546000 Cu 0.530086 0.0577726 0.5 588 63.546 0.0101039 -3.5377 63.546000 Cu 0.592908 0.0556842 9.14902e-17 586 63.546 0.0104952 -3.54219 63.546000 Cu 0.584 0.0407535 0.5 587 63.546 0.0227121 -3.53564 63.546000 Cu 0.64895 0.0385928 2.03178e-17 589 63.546 0.0246844 -3.5342 63.546000 Cu 0.712996 0.0360687 0.5 591 63.546 0.104774 -3.53741 63.546000 Cu 0.656364 0.0535353 0.5 592 63.546 0.0202371 -3.54248 63.546000 Cu 0.719276 0.0514204 8.36757e-17 590 63.546 0.0314678 -3.54009 63.546000 Cu 0.774663 0.0333634 0 593 63.546 0.197962 -3.50333 63.546000 Cu 0.840257 0.0475877 0 594 63.546 0.0341895 -3.52298 63.546000 Cu 0.78047 0.0494538 0.5 596 63.546 0.029099 -3.53369 63.546000 Cu 0.7868 0.0651977 2.40447e-19 625 63.546 0.00462984 -3.53571 63.546000 Cu 0.84748 0.063467 0.5 627 63.546 0.0126127 -3.53102 63.546000 Cu 0.958832 0.0441795 0 534 63.546 0.049718 -3.53007 63.546000 Cu 0.899259 0.0458133 0.5 536 63.546 0.0310989 -3.52699 63.546000 Cu 0.907873 0.0616803 1 565 63.546 0.0178081 -3.52857 63.546000 Cu 0.968565 0.0597702 0.5 567 63.546 0.0125071 -3.53375 63.546000 Cu 0.10149 0.0708637 5.32591e-17 570 63.546 0.00755122 -3.54256 63.546000 Cu 0.0393384 0.0730163 0.5 572 63.546 0.00170493 -3.53951 63.546000 Cu 0.0479025 0.0883221 1.04955e-16 601 63.546 0.00200495 -3.54032 63.546000 Cu 0.109575 0.0862303 0.5 603 63.546 0.00432418 -3.54116 63.546000 Cu 0.225542 0.066939 6.40792e-17 574 63.546 0.00525393 -3.54037 63.546000 Cu 0.163715 0.0688055 0.5 576 63.546 0.0120307 -3.54305 63.546000 Cu 0.171074 0.0842844 0 605 63.546 0.00292059 -3.54094 63.546000 Cu 0.23986 0.0979997 1.10005e-16 606 63.546 0.000544842 -3.53946 63.546000 Cu 0.23245 0.082482 0.5 607 63.546 0.000920404 -3.53981 63.546000 Cu 0.178622 0.0998032 0.5 608 63.546 0.000567778 -3.53977 63.546000 Cu 0.293723 0.080751 9.76216e-17 609 63.546 0.00163195 -3.53782 63.546000 Cu 0.362693 0.0944069 4.17176e-17 610 63.546 0.00208424 -3.53881 63.546000 Cu 0.354957 0.0790069 0.5 611 63.546 0.00447612 -3.53515 63.546000 Cu 0.301231 0.096229 0.5 612 63.546 0.00138268 -3.53925 63.546000 Cu 0.416188 0.0771477 0 613 63.546 0.00556821 -3.53469 63.546000 Cu 0.424357 0.0924895 0.5 616 63.546 0.00158005 -3.53866 63.546000 Cu 0.486119 0.0904454 1 614 63.546 0.000733888 -3.53907 63.546000 Cu 0.477602 0.0751493 0.5 615 63.546 0.00329991 -3.53591 63.546000 Cu 0.539338 0.0730163 5.32591e-17 617 63.546 0.00170493 -3.53951 63.546000 Cu 0.547903 0.0883221 0.5 620 63.546 0.00200495 -3.54032 63.546000 Cu 0.609575 0.0862303 1.31044e-17 618 63.546 0.00432418 -3.54116 63.546000 Cu 0.60149 0.0708637 0.5 619 63.546 0.00755122 -3.54256 63.546000 Cu 0.663715 0.0688055 4.15974e-17 621 63.546 0.0120307 -3.54305 63.546000 Cu 0.671074 0.0842844 0.5 624 63.546 0.00292059 -3.54094 63.546000 Cu 0.678622 0.0998032 1.57493e-17 655 63.546 0.000567778 -3.53977 63.546000 Cu 0.73245 0.082482 2.40447e-19 622 63.546 0.000920404 -3.53981 63.546000 Cu 0.725542 0.066939 0.5 623 63.546 0.00525393 -3.54037 63.546000 Cu 0.854957 0.0790069 2.40447e-19 626 63.546 0.00447612 -3.53515 63.546000 Cu 0.793723 0.080751 0.5 628 63.546 0.00163195 -3.53782 63.546000 Cu 0.73986 0.0979997 0.5 657 63.546 0.000544842 -3.53946 63.546000 Cu 0.801231 0.096229 1 659 63.546 0.00138268 -3.53925 63.546000 Cu 0.977602 0.0751493 0 566 63.546 0.00329991 -3.53591 63.546000 Cu 0.916188 0.0771477 0.5 568 63.546 0.00556821 -3.53469 63.546000 Cu 0.924357 0.0924895 1 597 63.546 0.00158005 -3.53866 63.546000 Cu 0.986119 0.0904454 0.5 599 63.546 0.000733888 -3.53907 63.546000 Cu 0.862693 0.0944069 0.5 661 63.546 0.00208424 -3.53881 63.546000 Cu 0.117322 0.101705 1.11087e-16 602 63.546 0.00125043 -3.54044 63.546000 Cu 0.055913 0.103705 0.5 604 63.546 0.00159121 -3.54081 63.546000 Cu 0.00213079 0.121122 0.5 633 63.546 0.000726406 -3.54087 63.546000 Cu 0.0636775 0.119142 0 635 63.546 0.000741886 -3.54066 63.546000 Cu 0.132687 0.132686 8.7042e-17 636 63.546 0.000110177 -3.53963 63.546000 Cu 0.12503 0.117204 0.5 637 63.546 0.000263962 -3.54015 63.546000 Cu 0.186261 0.11532 0 639 63.546 0.000175318 -3.53946 63.546000 Cu 0.255376 0.128908 0 640 63.546 0.00039774 -3.53925 63.546000 Cu 0.247533 0.113476 0.5 641 63.546 0.000717909 -3.5392 63.546000 Cu 0.193998 0.130795 0.5 642 63.546 0.000223441 -3.5393 63.546000 Cu 0.309009 0.111638 1 643 63.546 0.000901563 -3.53916 63.546000 Cu 0.378597 0.125076 0 644 63.546 0.000114513 -3.53977 63.546000 Cu 0.370669 0.109755 0.5 645 63.546 0.000711746 -3.53952 63.546000 Cu 0.316889 0.127005 0.5 646 63.546 0.000370686 -3.53932 63.546000 Cu 0.432467 0.107791 6.80466e-17 647 63.546 0.000341758 -3.53998 63.546000 Cu 0.502131 0.121122 1.72401e-16 648 63.546 0.000726406 -3.54087 63.546000 Cu 0.494239 0.105756 0.5 649 63.546 0.000670947 -3.5405 63.546000 Cu 0.440395 0.12311 0.5 650 63.546 0.000245371 -3.54036 63.546000 Cu 0.555913 0.103705 3.08975e-17 651 63.546 0.00159121 -3.54081 63.546000 Cu 0.563678 0.119142 0.5 654 63.546 0.000741886 -3.54066 63.546000 Cu 0.62503 0.117204 1 652 63.546 0.000263962 -3.54015 63.546000 Cu 0.617322 0.101705 0.5 653 63.546 0.00125043 -3.54044 63.546000 Cu 0.686261 0.11532 0.5 658 63.546 0.000175318 -3.53946 63.546000 Cu 0.632687 0.132686 0.5 687 63.546 0.000110177 -3.53963 63.546000 Cu 0.693998 0.130795 1 689 63.546 0.000223441 -3.5393 63.546000 Cu 0.747533 0.113476 0 656 63.546 0.000717909 -3.5392 63.546000 Cu 0.809009 0.111638 0.5 662 63.546 0.000901563 -3.53916 63.546000 Cu 0.755376 0.128908 0.5 691 63.546 0.00039774 -3.53925 63.546000 Cu 0.816889 0.127005 0 693 63.546 0.000370686 -3.53932 63.546000 Cu 0.994239 0.105756 2.40447e-19 598 63.546 0.000670947 -3.5405 63.546000 Cu 0.932467 0.107791 0.5 600 63.546 0.000341758 -3.53998 63.546000 Cu 0.878597 0.125076 0.5 630 63.546 0.000114513 -3.53977 63.546000 Cu 0.940395 0.12311 1.22869e-16 631 63.546 0.000245371 -3.54036 63.546000 Cu 0.870669 0.109755 1 660 63.546 0.000711746 -3.53952 63.546000 Cu 0.00981504 0.136515 1 632 63.546 0.000360192 -3.54035 63.546000 Cu 0.0713121 0.134591 0.5 638 63.546 0.000207733 -3.54 63.546000 Cu 0.01739 0.151926 0.5 667 63.546 5.94162e-05 -3.54029 63.546000 Cu 0.0788933 0.150023 1.64706e-17 669 63.546 3.2724e-05 -3.53971 63.546000 Cu 0.140333 0.148129 0.5 671 63.546 0.000116233 -3.53939 63.546000 Cu 0.086497 0.165437 0.5 672 63.546 2.41713e-05 -3.53971 63.546000 Cu 0.147991 0.163537 1 670 63.546 8.1354e-05 -3.53941 63.546000 Cu 0.201762 0.146228 1 673 63.546 0.000192426 -3.53953 63.546000 Cu 0.271063 0.159693 1 674 63.546 4.18371e-05 -3.5398 63.546000 Cu 0.263242 0.144309 0.5 675 63.546 0.000151566 -3.53971 63.546000 Cu 0.209513 0.161626 0.5 676 63.546 0.00010595 -3.53948 63.546000 Cu 0.324804 0.14237 1.22748e-16 677 63.546 6.90496e-05 -3.54004 63.546000 Cu 0.394252 0.15579 1 678 63.546 9.10112e-05 -3.54057 63.546000 Cu 0.386462 0.140415 0.5 679 63.546 0.000105206 -3.54035 63.546000 Cu 0.332653 0.157744 0.5 680 63.546 2.57077e-05 -3.54023 63.546000 Cu 0.448157 0.13846 1.20224e-19 681 63.546 0.000240964 -3.54053 63.546000 Cu 0.51739 0.151926 5.60242e-17 682 63.546 5.94162e-05 -3.54029 63.546000 Cu 0.509815 0.136515 0.5 683 63.546 0.000360192 -3.54035 63.546000 Cu 0.455842 0.153848 0.5 684 63.546 0.000125419 -3.54067 63.546000 Cu 0.571312 0.134591 4.96524e-17 685 63.546 0.000207733 -3.54 63.546000 Cu 0.640333 0.148129 7.40578e-17 686 63.546 0.000116233 -3.53939 63.546000 Cu 0.578893 0.150023 0.5 688 63.546 3.2724e-05 -3.53971 63.546000 Cu 0.701762 0.146228 0.5 692 63.546 0.000192426 -3.53953 63.546000 Cu 0.586497 0.165437 0 717 63.546 2.41713e-05 -3.53971 63.546000 Cu 0.647991 0.163537 0.5 719 63.546 8.1354e-05 -3.53941 63.546000 Cu 0.709513 0.161626 0 721 63.546 0.00010595 -3.53948 63.546000 Cu 0.763242 0.144309 0 690 63.546 0.000151566 -3.53971 63.546000 Cu 0.824804 0.14237 0.5 694 63.546 6.90496e-05 -3.54004 63.546000 Cu 0.771063 0.159693 0.5 723 63.546 4.18371e-05 -3.5398 63.546000 Cu 0.832653 0.157744 0 725 63.546 2.57077e-05 -3.54023 63.546000 Cu 0.886462 0.140415 1 629 63.546 0.000105206 -3.54035 63.546000 Cu 0.948157 0.13846 0.5 634 63.546 0.000240964 -3.54053 63.546000 Cu 0.894252 0.15579 0.5 664 63.546 9.10112e-05 -3.54057 63.546000 Cu 0.955842 0.153848 2.40447e-19 665 63.546 0.000125419 -3.54067 63.546000 Cu 0.0250023 0.16734 6.94893e-17 666 63.546 1.12661e-05 -3.5401 63.546000 Cu 0.0403294 0.198141 2.40447e-19 698 63.546 1.78843e-05 -3.53987 63.546000 Cu 0.0326524 0.182746 0.5 699 63.546 9.60986e-06 -3.53987 63.546000 Cu 0.0941486 0.180835 1 701 63.546 3.31168e-05 -3.53976 63.546000 Cu 0.10185 0.196223 0.5 704 63.546 1.71104e-05 -3.53999 63.546000 Cu 0.1634 0.1943 1 702 63.546 4.91441e-06 -3.54017 63.546000 Cu 0.155678 0.178922 0.5 703 63.546 3.34063e-05 -3.53971 63.546000 Cu 0.217245 0.176999 1 705 63.546 1.12028e-05 -3.53971 63.546000 Cu 0.278832 0.175066 0.5 707 63.546 1.4345e-05 -3.53992 63.546000 Cu 0.224966 0.192373 0.5 708 63.546 2.02545e-06 -3.54032 63.546000 Cu 0.286545 0.190443 1.22869e-16 706 63.546 7.99138e-06 -3.54038 63.546000 Cu 0.340413 0.173125 1 709 63.546 3.31522e-05 -3.54014 63.546000 Cu 0.409653 0.186584 1 710 63.546 1.52721e-05 -3.54014 63.546000 Cu 0.401965 0.171186 0.5 711 63.546 3.32555e-05 -3.54032 63.546000 Cu 0.34811 0.188512 0.5 712 63.546 1.36023e-05 -3.5403 63.546000 Cu 0.463498 0.169256 1 713 63.546 2.41032e-05 -3.54031 63.546000 Cu 0.532652 0.182746 1 714 63.546 9.60986e-06 -3.53987 63.546000 Cu 0.525002 0.16734 0.5 715 63.546 1.12661e-05 -3.5401 63.546000 Cu 0.471158 0.184661 0.5 716 63.546 4.82781e-06 -3.53998 63.546000 Cu 0.540329 0.198141 0.5 747 63.546 1.78843e-05 -3.53987 63.546000 Cu 0.655678 0.178922 1 718 63.546 3.34063e-05 -3.53971 63.546000 Cu 0.594149 0.180835 0.5 720 63.546 3.31168e-05 -3.53976 63.546000 Cu 0.60185 0.196223 4.74884e-17 749 63.546 1.71104e-05 -3.53999 63.546000 Cu 0.6634 0.1943 0.5 751 63.546 4.91441e-06 -3.54017 63.546000 Cu 0.778832 0.175066 1.20224e-19 722 63.546 1.4345e-05 -3.53992 63.546000 Cu 0.717245 0.176999 0.5 724 63.546 1.12028e-05 -3.53971 63.546000 Cu 0.840413 0.173125 0.5 726 63.546 3.31522e-05 -3.54014 63.546000 Cu 0.724966 0.192373 2.40447e-19 753 63.546 2.02545e-06 -3.54032 63.546000 Cu 0.786545 0.190443 0.5 755 63.546 7.99138e-06 -3.54038 63.546000 Cu 0.84811 0.188512 1.67832e-16 757 63.546 1.36023e-05 -3.5403 63.546000 Cu 0.901965 0.171186 2.40447e-19 663 63.546 3.32555e-05 -3.54032 63.546000 Cu 0.963498 0.169256 0.5 668 63.546 2.41032e-05 -3.54031 63.546000 Cu 0.909653 0.186584 0.5 696 63.546 1.52721e-05 -3.54014 63.546000 Cu 0.971158 0.184661 0 697 63.546 4.82781e-06 -3.53998 63.546000 Cu 0.0557472 0.228892 2.40447e-19 730 63.546 1.03264e-06 -3.53975 63.546000 Cu 0.0480338 0.213521 0.5 731 63.546 9.80655e-06 -3.5398 63.546000 Cu 0.109576 0.211601 1 733 63.546 7.74766e-06 -3.53992 63.546000 Cu 0.117295 0.226969 0.5 736 63.546 1.22695e-06 -3.53969 63.546000 Cu 0.178843 0.225045 1 734 63.546 1.77883e-06 -3.53961 63.546000 Cu 0.171127 0.209677 0.5 735 63.546 6.12382e-06 -3.54002 63.546000 Cu 0.232684 0.207752 2.40447e-19 737 63.546 7.5324e-06 -3.54009 63.546000 Cu 0.240389 0.223121 0.5 740 63.546 2.52678e-06 -3.53955 63.546000 Cu 0.301926 0.221198 1 738 63.546 2.18869e-06 -3.53955 63.546000 Cu 0.29424 0.205825 0.5 739 63.546 9.62827e-06 -3.54009 63.546000 Cu 0.355784 0.203899 2.40447e-19 741 63.546 9.03547e-06 -3.54005 63.546000 Cu 0.424977 0.217358 2.40447e-19 742 63.546 6.57497e-06 -3.53968 63.546000 Cu 0.417313 0.201977 0.5 743 63.546 7.98976e-06 -3.53994 63.546000 Cu 0.363454 0.219277 0.5 744 63.546 2.72612e-06 -3.53962 63.546000 Cu 0.478822 0.200058 9.19711e-17 745 63.546 1.05787e-05 -3.53986 63.546000 Cu 0.548034 0.213521 0 746 63.546 9.80655e-06 -3.5398 63.546000 Cu 0.486501 0.21544 0.5 748 63.546 1.04658e-05 -3.53974 63.546000 Cu 0.43267 0.232731 0.5 777 63.546 1.35904e-06 -3.5398 63.546000 Cu 0.494206 0.230812 1.20224e-17 779 63.546 1.09557e-06 -3.53978 63.546000 Cu 0.555747 0.228892 0.5 781 63.546 1.03264e-06 -3.53975 63.546000 Cu 0.671127 0.209677 1.90074e-16 750 63.546 6.12382e-06 -3.54002 63.546000 Cu 0.609576 0.211601 0.5 752 63.546 7.74766e-06 -3.53992 63.546000 Cu 0.617295 0.226969 9.85834e-18 783 63.546 1.22695e-06 -3.53969 63.546000 Cu 0.678843 0.225045 0.5 785 63.546 1.77883e-06 -3.53961 63.546000 Cu 0.79424 0.205825 1 754 63.546 9.62827e-06 -3.54009 63.546000 Cu 0.732684 0.207752 0.5 756 63.546 7.5324e-06 -3.54009 63.546000 Cu 0.855784 0.203899 0.5 758 63.546 9.03547e-06 -3.54005 63.546000 Cu 0.740389 0.223121 3.88323e-17 787 63.546 2.52678e-06 -3.53955 63.546000 Cu 0.801926 0.221198 0.5 789 63.546 2.18869e-06 -3.53955 63.546000 Cu 0.917313 0.201977 1 695 63.546 7.98976e-06 -3.53994 63.546000 Cu 0.978822 0.200058 0.5 700 63.546 1.05787e-05 -3.53986 63.546000 Cu 0.93267 0.232731 0 727 63.546 1.35904e-06 -3.5398 63.546000 Cu 0.924977 0.217358 0.5 728 63.546 6.57497e-06 -3.53968 63.546000 Cu 0.986501 0.21544 1.20224e-19 729 63.546 1.04658e-05 -3.53974 63.546000 Cu 0.994206 0.230812 0.5 732 63.546 1.09557e-06 -3.53978 63.546000 Cu 0.863454 0.219277 7.11724e-17 791 63.546 2.72612e-06 -3.53962 63.546000 Cu 0.00191537 0.246181 1.20224e-19 763 63.546 1.03557e-07 -3.5399 63.546000 Cu 0.0711569 0.259632 1.20224e-19 764 63.546 1.18863e-06 -3.53993 63.546000 Cu 0.0634552 0.24426 0.5 765 63.546 9.38292e-07 -3.5399 63.546000 Cu 0.00962237 0.261552 0.5 766 63.546 6.31181e-07 -3.53979 63.546000 Cu 0.124998 0.242337 0 767 63.546 2.82802e-06 -3.53991 63.546000 Cu 0.132692 0.257711 0.5 770 63.546 9.41659e-07 -3.54009 63.546000 Cu 0.194228 0.255789 1.20224e-19 768 63.546 1.33694e-07 -3.54022 63.546000 Cu 0.18654 0.240413 0.5 769 63.546 4.58891e-06 -3.53992 63.546000 Cu 0.248078 0.23849 1 771 63.546 4.43314e-06 -3.53989 63.546000 Cu 0.255765 0.253866 0.5 774 63.546 2.82837e-07 -3.54024 63.546000 Cu 0.317302 0.251944 0 772 63.546 1.06555e-06 -3.54016 63.546000 Cu 0.30961 0.236568 0.5 773 63.546 2.26932e-06 -3.53985 63.546000 Cu 0.371139 0.234649 1 775 63.546 1.19172e-06 -3.53982 63.546000 Cu 0.37884 0.250023 0.5 778 63.546 9.05731e-07 -3.54005 63.546000 Cu 0.386544 0.265394 1 809 63.546 6.29266e-07 -3.53976 63.546000 Cu 0.440377 0.248102 5.39804e-17 776 63.546 2.46117e-07 -3.53995 63.546000 Cu 0.563455 0.24426 1.98369e-17 780 63.546 9.38292e-07 -3.5399 63.546000 Cu 0.501915 0.246181 0.5 782 63.546 1.03557e-07 -3.5399 63.546000 Cu 0.448085 0.263472 0.5 811 63.546 1.72144e-07 -3.53974 63.546000 Cu 0.509622 0.261552 5.77074e-17 813 63.546 6.31181e-07 -3.53979 63.546000 Cu 0.571157 0.259632 0.5 815 63.546 1.18863e-06 -3.53993 63.546000 Cu 0.68654 0.240413 0 784 63.546 4.58891e-06 -3.53992 63.546000 Cu 0.624998 0.242337 0.5 786 63.546 2.82802e-06 -3.53991 63.546000 Cu 0.632692 0.257711 1 817 63.546 9.41659e-07 -3.54009 63.546000 Cu 0.694228 0.255789 0.5 819 63.546 1.33694e-07 -3.54022 63.546000 Cu 0.80961 0.236568 1 788 63.546 2.26932e-06 -3.53985 63.546000 Cu 0.748078 0.23849 0.5 790 63.546 4.43314e-06 -3.53989 63.546000 Cu 0.755765 0.253866 7.87465e-17 821 63.546 2.82837e-07 -3.54024 63.546000 Cu 0.817302 0.251944 0.5 823 63.546 1.06555e-06 -3.54016 63.546000 Cu 0.87884 0.250023 0 759 63.546 9.05731e-07 -3.54005 63.546000 Cu 0.948085 0.263472 1.22869e-16 760 63.546 1.72144e-07 -3.53974 63.546000 Cu 0.940377 0.248102 0.5 761 63.546 2.46117e-07 -3.53995 63.546000 Cu 0.886544 0.265394 0.5 762 63.546 6.29266e-07 -3.53976 63.546000 Cu 0.871139 0.234649 0.5 792 63.546 1.19172e-06 -3.53982 63.546000 Cu 0.0173272 0.276924 2.40447e-19 797 63.546 6.64766e-06 -3.53968 63.546000 Cu 0.0865291 0.290387 1 798 63.546 8.32604e-06 -3.53981 63.546000 Cu 0.078853 0.275006 0.5 799 63.546 2.83256e-06 -3.53974 63.546000 Cu 0.0250158 0.292305 0.5 800 63.546 1.51596e-05 -3.53989 63.546000 Cu 0.14038 0.273088 1.22869e-16 801 63.546 9.12793e-07 -3.53982 63.546000 Cu 0.209594 0.286539 2.40447e-19 802 63.546 4.75005e-06 -3.53974 63.546000 Cu 0.201912 0.271166 0.5 803 63.546 2.50208e-06 -3.53988 63.546000 Cu 0.148053 0.288464 0.5 804 63.546 6.25516e-06 -3.53974 63.546000 Cu 0.263453 0.269242 0 805 63.546 3.22914e-06 -3.53988 63.546000 Cu 0.271148 0.284612 0.5 808 63.546 3.06882e-06 -3.53974 63.546000 Cu 0.278857 0.299984 6.86477e-17 837 63.546 5.98101e-06 -3.54016 63.546000 Cu 0.332704 0.282686 1.15415e-16 806 63.546 3.83702e-06 -3.53974 63.546000 Cu 0.324999 0.267318 0.5 807 63.546 1.99727e-06 -3.53983 63.546000 Cu 0.394255 0.280762 0.5 812 63.546 6.73865e-06 -3.53971 63.546000 Cu 0.340428 0.298059 0.5 839 63.546 1.32122e-05 -3.54012 63.546000 Cu 0.401975 0.296139 0 841 63.546 1.81576e-05 -3.54004 63.546000 Cu 0.455796 0.278842 1.86347e-17 810 63.546 8.34862e-06 -3.53969 63.546000 Cu 0.517327 0.276924 0.5 816 63.546 6.64766e-06 -3.53968 63.546000 Cu 0.463503 0.294222 0.5 843 63.546 2.09827e-05 -3.53998 63.546000 Cu 0.525016 0.292305 0 845 63.546 1.51596e-05 -3.53989 63.546000 Cu 0.578853 0.275006 5.30186e-17 814 63.546 2.83256e-06 -3.53974 63.546000 Cu 0.701912 0.271166 7.93476e-18 818 63.546 2.50208e-06 -3.53988 63.546000 Cu 0.64038 0.273088 0.5 820 63.546 9.12793e-07 -3.53982 63.546000 Cu 0.586529 0.290387 0.5 847 63.546 8.32604e-06 -3.53981 63.546000 Cu 0.648053 0.288464 3.16188e-17 849 63.546 6.25516e-06 -3.53974 63.546000 Cu 0.709594 0.286539 0.5 851 63.546 4.75005e-06 -3.53974 63.546000 Cu 0.824999 0.267318 4.32805e-17 822 63.546 1.99727e-06 -3.53983 63.546000 Cu 0.763453 0.269242 0.5 824 63.546 3.22914e-06 -3.53988 63.546000 Cu 0.771148 0.284612 1 853 63.546 3.06882e-06 -3.53974 63.546000 Cu 0.840428 0.298059 5.63849e-17 854 63.546 1.32122e-05 -3.54012 63.546000 Cu 0.832704 0.282686 0.5 855 63.546 3.83702e-06 -3.53974 63.546000 Cu 0.778857 0.299984 0.5 856 63.546 5.98101e-06 -3.54016 63.546000 Cu 0.894255 0.280762 1 793 63.546 6.73865e-06 -3.53971 63.546000 Cu 0.963503 0.294222 1 794 63.546 2.09827e-05 -3.53998 63.546000 Cu 0.955796 0.278842 0.5 795 63.546 8.34862e-06 -3.53969 63.546000 Cu 0.901975 0.296139 0.5 796 63.546 1.81576e-05 -3.54004 63.546000 Cu 0.0326726 0.307702 2.40447e-19 829 63.546 6.79131e-06 -3.54011 63.546000 Cu 0.101849 0.321175 0 830 63.546 3.85681e-05 -3.54032 63.546000 Cu 0.094182 0.305777 0.5 831 63.546 1.50482e-05 -3.54015 63.546000 Cu 0.0403196 0.323108 0.5 832 63.546 3.46776e-05 -3.5402 63.546000 Cu 0.155718 0.303846 2.40447e-19 833 63.546 1.76388e-05 -3.54015 63.546000 Cu 0.224988 0.317292 2.01976e-17 834 63.546 8.49124e-06 -3.54014 63.546000 Cu 0.217283 0.301913 0.5 835 63.546 8.45937e-06 -3.54016 63.546000 Cu 0.163404 0.319232 0.5 836 63.546 2.68734e-05 -3.5403 63.546000 Cu 0.232725 0.332668 0.5 867 63.546 3.9688e-05 -3.53956 63.546000 Cu 0.348145 0.313441 0 838 63.546 3.48356e-05 -3.53996 63.546000 Cu 0.286574 0.31536 0.5 840 63.546 1.31219e-05 -3.54005 63.546000 Cu 0.40968 0.311529 0.5 844 63.546 3.68902e-05 -3.53995 63.546000 Cu 0.294281 0.330738 3.49851e-17 869 63.546 9.92693e-05 -3.53943 63.546000 Cu 0.355811 0.328828 0.5 871 63.546 8.52968e-05 -3.53949 63.546000 Cu 0.417319 0.326929 0 873 63.546 3.59999e-05 -3.53972 63.546000 Cu 0.471185 0.309619 1.40542e-16 842 63.546 1.68313e-05 -3.54 63.546000 Cu 0.532673 0.307702 0.5 848 63.546 6.79131e-06 -3.54011 63.546000 Cu 0.478813 0.325026 0.5 875 63.546 2.05608e-05 -3.53994 63.546000 Cu 0.54032 0.323108 1.05436e-16 877 63.546 3.46776e-05 -3.5402 63.546000 Cu 0.594182 0.305777 1.11808e-17 846 63.546 1.50482e-05 -3.54015 63.546000 Cu 0.655718 0.303846 0.5 852 63.546 1.76388e-05 -3.54015 63.546000 Cu 0.601849 0.321175 0.5 879 63.546 3.85681e-05 -3.54032 63.546000 Cu 0.663404 0.319232 9.137e-18 881 63.546 2.68734e-05 -3.5403 63.546000 Cu 0.717283 0.301913 1.55089e-17 850 63.546 8.45937e-06 -3.54016 63.546000 Cu 0.732725 0.332668 1 882 63.546 3.9688e-05 -3.53956 63.546000 Cu 0.724988 0.317292 0.5 883 63.546 8.49124e-06 -3.54014 63.546000 Cu 0.786574 0.31536 1.44629e-16 885 63.546 1.31219e-05 -3.54005 63.546000 Cu 0.855811 0.328828 1 886 63.546 8.52968e-05 -3.53949 63.546000 Cu 0.848145 0.313441 0.5 887 63.546 3.48356e-05 -3.53996 63.546000 Cu 0.794281 0.330738 0.5 888 63.546 9.92693e-05 -3.53943 63.546000 Cu 0.90968 0.311529 1 825 63.546 3.68902e-05 -3.53995 63.546000 Cu 0.978813 0.325026 5.27782e-17 826 63.546 2.05608e-05 -3.53994 63.546000 Cu 0.971185 0.309619 0.5 827 63.546 1.68313e-05 -3.54 63.546000 Cu 0.917319 0.326929 0.5 828 63.546 3.59999e-05 -3.53972 63.546000 Cu 0.0479555 0.33851 1.2888e-16 861 63.546 0.000117182 -3.5404 63.546000 Cu 0.117298 0.351937 0 862 63.546 7.83051e-05 -3.54064 63.546000 Cu 0.109549 0.336565 0.5 863 63.546 7.46007e-05 -3.54032 63.546000 Cu 0.0555823 0.353894 0.5 864 63.546 0.000196171 -3.5408 63.546000 Cu 0.171158 0.334613 1.00026e-16 865 63.546 1.49346e-05 -3.53997 63.546000 Cu 0.240525 0.34805 0 866 63.546 0.000197292 -3.5395 63.546000 Cu 0.178965 0.349985 0.5 868 63.546 8.69751e-05 -3.54005 63.546000 Cu 0.186799 0.365358 6.97297e-18 899 63.546 0.000458731 -3.54 63.546000 Cu 0.248321 0.36346 0.5 901 63.546 0.000474862 -3.53966 63.546000 Cu 0.363403 0.344238 8.87251e-17 870 63.546 0.000130112 -3.53961 63.546000 Cu 0.301986 0.346136 0.5 872 63.546 0.000230481 -3.53931 63.546000 Cu 0.424871 0.342343 0.5 876 63.546 3.6723e-05 -3.53993 63.546000 Cu 0.309676 0.361575 6.5041e-17 903 63.546 0.000184579 -3.53942 63.546000 Cu 0.370982 0.359686 0.5 905 63.546 9.57727e-05 -3.53972 63.546000 Cu 0.486383 0.340436 6.90084e-17 874 63.546 7.82005e-05 -3.5402 63.546000 Cu 0.547956 0.33851 0.5 880 63.546 0.000117182 -3.5404 63.546000 Cu 0.432365 0.357774 1 907 63.546 0.000237001 -3.54026 63.546000 Cu 0.493906 0.355842 0.5 909 63.546 0.00028754 -3.54064 63.546000 Cu 0.555582 0.353894 1.31044e-17 911 63.546 0.000196171 -3.5408 63.546000 Cu 0.609549 0.336565 9.76216e-17 878 63.546 7.46007e-05 -3.54032 63.546000 Cu 0.671158 0.334613 0.5 884 63.546 1.49346e-05 -3.53997 63.546000 Cu 0.617298 0.351937 0.5 913 63.546 7.83051e-05 -3.54064 63.546000 Cu 0.678965 0.349985 0 915 63.546 8.69751e-05 -3.54005 63.546000 Cu 0.686799 0.365358 0.5 918 63.546 0.000458731 -3.54 63.546000 Cu 0.748321 0.36346 0 916 63.546 0.000474862 -3.53966 63.546000 Cu 0.740525 0.34805 0.5 917 63.546 0.000197292 -3.5395 63.546000 Cu 0.801986 0.346136 9.71407e-17 919 63.546 0.000230481 -3.53931 63.546000 Cu 0.809676 0.361575 0.5 922 63.546 0.000184579 -3.53942 63.546000 Cu 0.924871 0.342343 0 857 63.546 3.6723e-05 -3.53993 63.546000 Cu 0.993906 0.355842 0 858 63.546 0.00028754 -3.54064 63.546000 Cu 0.986383 0.340436 0.5 859 63.546 7.82005e-05 -3.5402 63.546000 Cu 0.932365 0.357774 0.5 860 63.546 0.000237001 -3.54026 63.546000 Cu 0.870982 0.359686 0 920 63.546 9.57727e-05 -3.53972 63.546000 Cu 0.863403 0.344238 0.5 921 63.546 0.000130112 -3.53961 63.546000 Cu 0.00926559 0.386579 0 892 63.546 0.000547407 -3.54027 63.546000 Cu 0.00148798 0.371231 0.5 893 63.546 0.000681042 -3.54074 63.546000 Cu 0.0632522 0.369244 3.49851e-17 895 63.546 0.000216441 -3.5406 63.546000 Cu 0.132876 0.382607 0 896 63.546 0.000772453 -3.53911 63.546000 Cu 0.12509 0.367285 0.5 897 63.546 0.000157098 -3.54034 63.546000 Cu 0.0710847 0.384554 0.5 898 63.546 0.000325053 -3.53954 63.546000 Cu 0.140596 0.397949 0.5 931 63.546 0.00216363 -3.53785 63.546000 Cu 0.0790069 0.39985 2.9575e-17 929 63.546 0.00195385 -3.5378 63.546000 Cu 0.256003 0.378904 0 900 63.546 0.00068812 -3.53926 63.546000 Cu 0.194544 0.380738 0.5 902 63.546 0.00101312 -3.53926 63.546000 Cu 0.202073 0.396144 2.40447e-19 933 63.546 0.00142654 -3.53866 63.546000 Cu 0.263461 0.394378 0.5 935 63.546 0.000670224 -3.53954 63.546000 Cu 0.378543 0.375162 0 904 63.546 0.000302399 -3.5396 63.546000 Cu 0.317286 0.377055 0.5 906 63.546 0.000185743 -3.53931 63.546000 Cu 0.32476 0.392567 0 937 63.546 0.000788296 -3.54001 63.546000 Cu 0.386065 0.390649 0.5 939 63.546 0.00146933 -3.54037 63.546000 Cu 0.501488 0.371231 0 908 63.546 0.000681042 -3.54074 63.546000 Cu 0.439905 0.373216 0.5 910 63.546 0.000774453 -3.54032 63.546000 Cu 0.563252 0.369244 0.5 914 63.546 0.000216441 -3.5406 63.546000 Cu 0.447554 0.388635 4.73681e-17 941 63.546 0.00148302 -3.54058 63.546000 Cu 0.509266 0.386579 0.5 943 63.546 0.000547407 -3.54027 63.546000 Cu 0.571085 0.384554 1 945 63.546 0.000325053 -3.53954 63.546000 Cu 0.62509 0.367285 0 912 63.546 0.000157098 -3.54034 63.546000 Cu 0.640596 0.397949 1 946 63.546 0.00216363 -3.53785 63.546000 Cu 0.632876 0.382607 0.5 947 63.546 0.000772453 -3.53911 63.546000 Cu 0.694544 0.380738 6.52815e-17 949 63.546 0.00101312 -3.53926 63.546000 Cu 0.702073 0.396144 0.5 952 63.546 0.00142654 -3.53866 63.546000 Cu 0.579007 0.39985 0.5 948 63.546 0.00195385 -3.5378 63.546000 Cu 0.763461 0.394378 0 950 63.546 0.000670224 -3.53954 63.546000 Cu 0.756003 0.378904 0.5 951 63.546 0.00068812 -3.53926 63.546000 Cu 0.817286 0.377055 1 953 63.546 0.000185743 -3.53931 63.546000 Cu 0.82476 0.392567 0.5 954 63.546 0.000788296 -3.54001 63.546000 Cu 0.886065 0.390649 0 889 63.546 0.00146933 -3.54037 63.546000 Cu 0.878543 0.375162 0.5 890 63.546 0.000302399 -3.5396 63.546000 Cu 0.939905 0.373216 8.10308e-17 891 63.546 0.000774453 -3.54032 63.546000 Cu 0.947554 0.388635 0.5 894 63.546 0.00148302 -3.54058 63.546000 Cu 0.0255461 0.417183 2.68099e-17 926 63.546 0.00407652 -3.53531 63.546000 Cu 0.017249 0.401881 0.5 927 63.546 0.000761934 -3.53881 63.546000 Cu 0.0868443 0.415199 0.5 932 63.546 0.00634547 -3.53458 63.546000 Cu 0.0342587 0.432591 0.5 959 63.546 0.0141987 -3.53347 63.546000 Cu 0.0948141 0.430706 0 961 63.546 0.0178177 -3.52915 63.546000 Cu 0.14807 0.413351 1.20224e-19 930 63.546 0.00522002 -3.53543 63.546000 Cu 0.270577 0.409896 1.20224e-19 934 63.546 0.00120463 -3.54026 63.546000 Cu 0.209272 0.411619 0.5 936 63.546 0.00177786 -3.53774 63.546000 Cu 0.155132 0.428922 0.5 963 63.546 0.012497 -3.53121 63.546000 Cu 0.215811 0.427185 1 965 63.546 0.00512445 -3.53537 63.546000 Cu 0.277195 0.425425 0.5 967 63.546 0.00735444 -3.54027 63.546000 Cu 0.393704 0.406113 0 938 63.546 0.00442076 -3.54192 63.546000 Cu 0.332065 0.408085 0.5 940 63.546 0.00402083 -3.54192 63.546000 Cu 0.33923 0.423533 0 969 63.546 0.0131739 -3.54312 63.546000 Cu 0.401669 0.421461 0.5 971 63.546 0.0072332 -3.54262 63.546000 Cu 0.517249 0.401881 1 942 63.546 0.000761934 -3.53881 63.546000 Cu 0.455453 0.404004 0.5 944 63.546 0.00141343 -3.54043 63.546000 Cu 0.463854 0.419304 0 973 63.546 0.00167155 -3.53914 63.546000 Cu 0.534259 0.432591 9.00475e-17 974 63.546 0.0141987 -3.53347 63.546000 Cu 0.525546 0.417183 0.5 975 63.546 0.00407652 -3.53531 63.546000 Cu 0.586844 0.415199 1 977 63.546 0.00634547 -3.53458 63.546000 Cu 0.655132 0.428922 1.06398e-16 978 63.546 0.012497 -3.53121 63.546000 Cu 0.64807 0.413351 0.5 979 63.546 0.00522002 -3.53543 63.546000 Cu 0.594814 0.430706 0.5 980 63.546 0.0178177 -3.52915 63.546000 Cu 0.709272 0.411619 0 981 63.546 0.00177786 -3.53774 63.546000 Cu 0.777195 0.425425 0 982 63.546 0.00735444 -3.54027 63.546000 Cu 0.770577 0.409896 0.5 983 63.546 0.00120463 -3.54026 63.546000 Cu 0.715811 0.427185 0.5 984 63.546 0.00512445 -3.53537 63.546000 Cu 0.832065 0.408085 1.20224e-19 985 63.546 0.00402083 -3.54192 63.546000 Cu 0.83923 0.423533 0.5 986 63.546 0.0131739 -3.54312 63.546000 Cu 0.901669 0.421461 1 923 63.546 0.0072332 -3.54262 63.546000 Cu 0.893704 0.406113 0.5 924 63.546 0.00442076 -3.54192 63.546000 Cu 0.955453 0.404004 0 925 63.546 0.00141343 -3.54043 63.546000 Cu 0.963854 0.419304 0.5 928 63.546 0.00167155 -3.53914 63.546000 Cu 0.043533 0.448251 2.40447e-19 958 63.546 0.0500626 -3.53146 63.546000 Cu 0.102926 0.446624 0.5 964 63.546 0.0304872 -3.52726 63.546000 Cu 0.0521149 0.464235 0.5 991 63.546 0.0918754 -3.53062 63.546000 Cu 0.111709 0.463265 1 993 63.546 0.0869427 -3.52591 63.546000 Cu 0.161887 0.444829 2.40447e-19 962 63.546 0.0358101 -3.52143 63.546000 Cu 0.221705 0.442933 0.5 968 63.546 0.0348662 -3.53236 63.546000 Cu 0.168929 0.461356 0.5 995 63.546 0.0866678 -3.49518 63.546000 Cu 0.227032 0.459029 1 997 63.546 0.22339 -3.50717 63.546000 Cu 0.283146 0.440894 0 966 63.546 0.0360831 -3.53888 63.546000 Cu 0.410044 0.436608 1.49679e-16 970 63.546 0.0120053 -3.54156 63.546000 Cu 0.346399 0.438746 0.5 972 63.546 0.0197401 -3.54108 63.546000 Cu 0.289106 0.456189 0.5 999 63.546 0.119673 -3.53495 63.546000 Cu 0.353522 0.453612 8.99273e-17 1001 63.546 0.0255331 -3.53263 63.546000 Cu 0.418697 0.451507 0.5 1003 63.546 0.0307402 -3.5353 63.546000 Cu 0.426393 0.466312 1.03513e-16 1002 63.546 0.0580536 -3.53551 63.546000 Cu 0.472864 0.434554 0.5 976 63.546 0.0131661 -3.53733 63.546000 Cu 0.48201 0.44982 9.97857e-17 1005 63.546 0.0459638 -3.53712 63.546000 Cu 0.552115 0.464235 0 1006 63.546 0.0918754 -3.53062 63.546000 Cu 0.543533 0.448251 0.5 1007 63.546 0.0500626 -3.53146 63.546000 Cu 0.490637 0.465055 0.5 1008 63.546 0.116152 -3.52429 63.546000 Cu 0.602926 0.446624 1 1009 63.546 0.0304872 -3.52726 63.546000 Cu 0.668929 0.461356 0 1010 63.546 0.0866678 -3.49518 63.546000 Cu 0.661887 0.444829 0.5 1011 63.546 0.0358101 -3.52143 63.546000 Cu 0.611709 0.463265 0.5 1012 63.546 0.0869427 -3.52591 63.546000 Cu 0.721705 0.442933 1.22628e-16 1013 63.546 0.0348662 -3.53236 63.546000 Cu 0.789106 0.456189 1 1014 63.546 0.119673 -3.53495 63.546000 Cu 0.783146 0.440894 0.5 1015 63.546 0.0360831 -3.53888 63.546000 Cu 0.727032 0.459029 0.5 1016 63.546 0.22339 -3.50717 63.546000 Cu 0.846399 0.438746 0 1017 63.546 0.0197401 -3.54108 63.546000 Cu 0.853522 0.453612 0.5 1018 63.546 0.0255331 -3.53263 63.546000 Cu 0.918697 0.451507 4.60457e-17 955 63.546 0.0307402 -3.5353 63.546000 Cu 0.910044 0.436608 0.5 956 63.546 0.0120053 -3.54156 63.546000 Cu 0.972864 0.434554 9.04082e-17 957 63.546 0.0131661 -3.53733 63.546000 Cu 0.98201 0.44982 0.5 960 63.546 0.0459638 -3.53712 63.546000 Cu 0.990637 0.465055 1 989 63.546 0.116152 -3.52429 63.546000 Cu 0.926393 0.466312 0.5 988 63.546 0.0580536 -3.53551 63.546000 Cu 0.0580895 0.480318 2.40447e-19 990 63.546 0.0985141 -3.53074 63.546000 Cu 0.119368 0.479944 0.5 996 63.546 0.203732 -3.51648 63.546000 Cu 0.0600918 0.496179 0.5 1022 63.546 0.121499 -3.53426 63.546000 Cu 0.123153 0.496249 2.40447e-19 1023 63.546 0.383744 -3.52066 63.546000 Cu 0.178725 0.479293 2.40447e-19 994 63.546 0.523141 -3.46994 63.546000 Cu 0.233563 0.475626 0.5 1000 63.546 0.932566 -3.43156 63.546000 Cu 0.188435 0.49641 0.5 1024 63.546 2.41557 -3.51599 63.546000 Cu 0.251384 0.494943 2.40447e-19 1025 63.546 7.94256 -3.54297 63.546000 Cu 0.295318 0.471159 1 998 63.546 0.838796 -3.45226 63.546000 Cu 0.361588 0.468038 0.5 1004 63.546 0.0897144 -3.51165 63.546000 Cu 0.305045 0.48553 0.5 1026 63.546 8.90008 -3.3086 63.546000 Cu 0.367522 0.48247 1 1027 63.546 4.4358 -3.46136 63.546000 Cu 0.376654 0.496048 0.5 1030 63.546 6.26676 -3.221 63.546000 Cu 0.497917 0.496098 0.5 517 63.546 0.0836751 -3.53386 63.546000 Cu 0.55809 0.480318 0.5 518 63.546 0.0985141 -3.53074 63.546000 Cu 0.436646 0.496086 1.20224e-19 1028 63.546 0.414363 -3.49937 63.546000 Cu 0.434163 0.48085 0.5 1029 63.546 0.293835 -3.50907 63.546000 Cu 0.496368 0.480545 1 1031 63.546 0.111824 -3.532 63.546000 Cu 0.560092 0.496179 0 1032 63.546 0.121499 -3.53426 63.546000 Cu 0.623153 0.496249 0.5 502 63.546 0.383744 -3.52066 63.546000 Cu 0.678725 0.479293 0.5 504 63.546 0.523141 -3.46994 63.546000 Cu 0.688435 0.49641 7.53803e-17 508 63.546 2.41557 -3.51599 63.546000 Cu 0.619368 0.479944 1.39459e-17 516 63.546 0.203732 -3.51648 63.546000 Cu 0.751384 0.494943 0.5 4 63.546 7.94256 -3.54297 63.546000 Cu 0.795318 0.471159 0.5 10 63.546 0.838796 -3.45226 63.546000 Cu 0.805045 0.48553 1 12 63.546 8.90008 -3.3086 63.546000 Cu 0.733563 0.475626 0 13 63.546 0.932566 -3.43156 63.546000 Cu 0.997917 0.496098 2.40447e-19 1021 63.546 0.0836751 -3.53386 63.546000 Cu 0.867522 0.48247 0.5 1 63.546 4.4358 -3.46136 63.546000 Cu 0.861588 0.468038 1 2 63.546 0.0897144 -3.51165 63.546000 Cu 0.934163 0.48085 3.60671e-19 987 63.546 0.293835 -3.50907 63.546000 Cu 0.996368 0.480545 0.5 992 63.546 0.111824 -3.532 63.546000 Cu 0.876654 0.496048 1 1019 63.546 6.26676 -3.221 63.546000 Cu 0.936646 0.496086 0.5 1020 63.546 0.414363 -3.49937 63.546000 Cu 0.0567837 0.512038 2.40447e-19 7 63.546 0.0860948 -3.52869 63.546000 Cu 0.117841 0.51259 0.5 9 63.546 0.155193 -3.51567 63.546000 Cu 0.0498701 0.528126 0.5 39 63.546 0.0802957 -3.52821 63.546000 Cu 0.109513 0.52919 1 41 63.546 0.0670139 -3.5276 63.546000 Cu 0.177434 0.513323 1 11 63.546 0.547364 -3.46408 63.546000 Cu 0.232177 0.516884 0.5 16 63.546 1.43687 -3.40115 63.546000 Cu 0.166984 0.531082 0.5 44 63.546 0.0867392 -3.50367 63.546000 Cu 0.293022 0.5207 1 14 63.546 1.23925 -3.45076 63.546000 Cu 0.30161 0.505965 0.5 15 63.546 9.51259 -3.34025 63.546000 Cu 0.36485 0.509293 4.20783e-17 17 63.546 4.93753 -3.45747 63.546000 Cu 0.423773 0.525675 0 18 63.546 0.0521033 -3.53695 63.546000 Cu 0.35884 0.523723 0.5 20 63.546 0.0604822 -3.51756 63.546000 Cu 0.432915 0.511264 0.5 19 63.546 0.36374 -3.49953 63.546000 Cu 0.495242 0.511686 7.69432e-18 21 63.546 0.121923 -3.52942 63.546000 Cu 0.54987 0.528126 1.25273e-16 22 63.546 0.0802957 -3.52821 63.546000 Cu 0.556784 0.512038 0.5 23 63.546 0.0860948 -3.52869 63.546000 Cu 0.488446 0.527177 0.5 24 63.546 0.128448 -3.5207 63.546000 Cu 0.617841 0.51259 1 25 63.546 0.155193 -3.51567 63.546000 Cu 0.666984 0.531082 1 26 63.546 0.0867392 -3.50367 63.546000 Cu 0.677434 0.513323 0.5 27 63.546 0.547364 -3.46408 63.546000 Cu 0.609513 0.52919 0.5 28 63.546 0.0670139 -3.5276 63.546000 Cu 0.80161 0.505965 1 3 63.546 9.51259 -3.34025 63.546000 Cu 0.732177 0.516884 0 29 63.546 1.43687 -3.40115 63.546000 Cu 0.793022 0.5207 0.5 31 63.546 1.23925 -3.45076 63.546000 Cu 0.932915 0.511264 1 5 63.546 0.36374 -3.49953 63.546000 Cu 0.86485 0.509293 0.5 6 63.546 4.93753 -3.45747 63.546000 Cu 0.995242 0.511686 0.5 8 63.546 0.121923 -3.52942 63.546000 Cu 0.85884 0.523723 0 33 63.546 0.0604822 -3.51756 63.546000 Cu 0.923773 0.525675 0.5 35 63.546 0.0521033 -3.53695 63.546000 Cu 0.988446 0.527177 0 37 63.546 0.128448 -3.5207 63.546000 Cu 0.0407242 0.544016 2.40447e-19 38 63.546 0.0476033 -3.52949 63.546000 Cu 0.100343 0.545705 0.5 42 63.546 0.0319437 -3.52712 63.546000 Cu 0.0309956 0.559566 0.5 71 63.546 0.0106698 -3.53414 63.546000 Cu 0.0918743 0.561498 1.22628e-16 73 63.546 0.016353 -3.52881 63.546000 Cu 0.159529 0.54747 6.08332e-17 43 63.546 0.0327035 -3.52411 63.546000 Cu 0.225329 0.533347 1.22628e-16 45 63.546 0.172908 -3.50137 63.546000 Cu 0.280856 0.551221 1 46 63.546 0.0217778 -3.53955 63.546000 Cu 0.21957 0.549313 0.5 48 63.546 0.0222493 -3.53362 63.546000 Cu 0.152463 0.56329 0.5 76 63.546 0.0109056 -3.5317 63.546000 Cu 0.213247 0.565004 9.59385e-17 77 63.546 0.00334235 -3.5361 63.546000 Cu 0.286912 0.535826 0.5 47 63.546 0.0876526 -3.53777 63.546000 Cu 0.350737 0.538274 0 49 63.546 0.0255927 -3.53456 63.546000 Cu 0.406746 0.555406 1 50 63.546 0.010944 -3.54209 63.546000 Cu 0.415512 0.540455 0.5 51 63.546 0.0189176 -3.53613 63.546000 Cu 0.343522 0.553277 0.5 52 63.546 0.0191163 -3.54229 63.546000 Cu 0.478895 0.542306 1.29842e-16 53 63.546 0.0350535 -3.53707 63.546000 Cu 0.530996 0.559566 4.55648e-17 54 63.546 0.0106698 -3.53414 63.546000 Cu 0.540724 0.544016 0.5 55 63.546 0.0476033 -3.52949 63.546000 Cu 0.46946 0.557524 0.5 56 63.546 0.0078853 -3.53838 63.546000 Cu 0.600343 0.545705 1 57 63.546 0.0319437 -3.52712 63.546000 Cu 0.652463 0.56329 1.22869e-16 58 63.546 0.0109056 -3.5317 63.546000 Cu 0.659529 0.54747 0.5 59 63.546 0.0327035 -3.52411 63.546000 Cu 0.591874 0.561498 0.5 60 63.546 0.016353 -3.52881 63.546000 Cu 0.713247 0.565004 0.5 64 63.546 0.00334235 -3.5361 63.546000 Cu 0.786912 0.535826 3.42638e-17 30 63.546 0.0876526 -3.53777 63.546000 Cu 0.725329 0.533347 0.5 32 63.546 0.172908 -3.50137 63.546000 Cu 0.850737 0.538274 0.5 36 63.546 0.0255927 -3.53456 63.546000 Cu 0.71957 0.549313 2.40447e-19 61 63.546 0.0222493 -3.53362 63.546000 Cu 0.780856 0.551221 0.5 63 63.546 0.0217778 -3.53955 63.546000 Cu 0.843522 0.553277 1.61941e-16 65 63.546 0.0191163 -3.54229 63.546000 Cu 0.915512 0.540455 2.91903e-16 34 63.546 0.0189176 -3.53613 63.546000 Cu 0.978895 0.542306 0.5 40 63.546 0.0350535 -3.53707 63.546000 Cu 0.906746 0.555406 0.5 67 63.546 0.010944 -3.54209 63.546000 Cu 0.96946 0.557524 1 69 63.546 0.0078853 -3.53838 63.546000 Cu 0.0221131 0.574925 0 70 63.546 0.00233981 -3.53671 63.546000 Cu 0.0836001 0.576935 0.5 74 63.546 0.00441697 -3.53548 63.546000 Cu 0.0136725 0.59023 0.5 103 63.546 0.000641426 -3.53938 63.546000 Cu 0.0754408 0.592273 9.76216e-17 105 63.546 0.00127566 -3.53869 63.546000 Cu 0.137135 0.5942 0.5 108 63.546 0.00179371 -3.5389 63.546000 Cu 0.144918 0.5788 1 75 63.546 0.00377949 -3.53591 63.546000 Cu 0.267502 0.582281 1.22869e-16 78 63.546 0.000906376 -3.54051 63.546000 Cu 0.274493 0.566733 0.5 79 63.546 0.00428162 -3.54001 63.546000 Cu 0.206202 0.580559 0.5 80 63.546 0.00163864 -3.53837 63.546000 Cu 0.198663 0.596029 1 109 63.546 0.00131005 -3.53951 63.546000 Cu 0.260045 0.597827 0.5 111 63.546 0.000653185 -3.53989 63.546000 Cu 0.336263 0.568588 2.40447e-19 81 63.546 0.00990901 -3.54254 63.546000 Cu 0.390288 0.586041 0 82 63.546 0.00345592 -3.54141 63.546000 Cu 0.398314 0.570628 0.5 83 63.546 0.00722275 -3.54256 63.546000 Cu 0.328832 0.58409 0.5 84 63.546 0.00256336 -3.54144 63.546000 Cu 0.321284 0.599641 0 113 63.546 0.000347066 -3.54004 63.546000 Cu 0.46033 0.572787 0 85 63.546 0.00153727 -3.54002 63.546000 Cu 0.513672 0.59023 9.34138e-17 86 63.546 0.000641426 -3.53938 63.546000 Cu 0.522113 0.574925 0.5 87 63.546 0.00233981 -3.53671 63.546000 Cu 0.451908 0.588119 0.5 88 63.546 0.00191433 -3.54062 63.546000 Cu 0.5836 0.576935 1.20224e-17 89 63.546 0.00441697 -3.53548 63.546000 Cu 0.637135 0.5942 7.85061e-17 90 63.546 0.00179371 -3.5389 63.546000 Cu 0.644918 0.5788 0.5 91 63.546 0.00377949 -3.53591 63.546000 Cu 0.575441 0.592273 0.5 92 63.546 0.00127566 -3.53869 63.546000 Cu 0.706202 0.580559 9.43756e-17 93 63.546 0.00163864 -3.53837 63.546000 Cu 0.698663 0.596029 0.5 96 63.546 0.00131005 -3.53951 63.546000 Cu 0.774493 0.566733 1 62 63.546 0.00428162 -3.54001 63.546000 Cu 0.836263 0.568588 0.5 68 63.546 0.00990901 -3.54254 63.546000 Cu 0.760045 0.597827 1 94 63.546 0.000653185 -3.53989 63.546000 Cu 0.767502 0.582281 0.5 95 63.546 0.000906376 -3.54051 63.546000 Cu 0.828832 0.58409 1.21546e-16 97 63.546 0.00256336 -3.54144 63.546000 Cu 0.821284 0.599641 0.5 100 63.546 0.000347066 -3.54004 63.546000 Cu 0.898314 0.570628 1.04715e-16 66 63.546 0.00722275 -3.54256 63.546000 Cu 0.96033 0.572787 0.5 72 63.546 0.00153727 -3.54002 63.546000 Cu 0.890288 0.586041 0.5 99 63.546 0.00345592 -3.54141 63.546000 Cu 0.951908 0.588119 9.6179e-17 101 63.546 0.00191433 -3.54062 63.546000 Cu 0.00558796 0.605557 5.02535e-17 102 63.546 0.000926127 -3.54039 63.546000 Cu 0.0673987 0.607578 0.5 106 63.546 0.000239721 -3.53992 63.546000 Cu 0.129215 0.609544 3.60671e-19 107 63.546 0.000443027 -3.53951 63.546000 Cu 0.0595336 0.622918 8.41566e-19 137 63.546 0.000221341 -3.54072 63.546000 Cu 0.121297 0.624885 0.5 140 63.546 7.58665e-05 -3.54004 63.546000 Cu 0.252348 0.613309 2.40447e-19 110 63.546 0.000641335 -3.5389 63.546000 Cu 0.190893 0.611451 0.5 112 63.546 0.000941529 -3.53913 63.546000 Cu 0.182987 0.626825 1 141 63.546 0.000218252 -3.53927 63.546000 Cu 0.244535 0.628743 0.5 143 63.546 0.000348243 -3.53905 63.546000 Cu 0.374899 0.617052 8.19926e-17 114 63.546 0.000187298 -3.53963 63.546000 Cu 0.382537 0.601538 0.5 115 63.546 0.00110731 -3.54047 63.546000 Cu 0.313646 0.615166 0.5 116 63.546 0.00018854 -3.53903 63.546000 Cu 0.305951 0.630642 2.40447e-19 145 63.546 0.000239188 -3.53914 63.546000 Cu 0.367291 0.632535 0.5 147 63.546 7.02633e-05 -3.53944 63.546000 Cu 0.443958 0.603527 3.3302e-17 117 63.546 0.00143675 -3.54062 63.546000 Cu 0.497819 0.620941 6.10736e-17 118 63.546 0.000560941 -3.54082 63.546000 Cu 0.505588 0.605557 0.5 119 63.546 0.000926127 -3.54039 63.546000 Cu 0.43625 0.618976 0.5 120 63.546 0.000631788 -3.54034 63.546000 Cu 0.567399 0.607578 0 121 63.546 0.000239721 -3.53992 63.546000 Cu 0.559534 0.622918 0.5 124 63.546 0.000221341 -3.54072 63.546000 Cu 0.621297 0.624885 2.40447e-19 122 63.546 7.58665e-05 -3.54004 63.546000 Cu 0.629215 0.609544 0.5 123 63.546 0.000443027 -3.53951 63.546000 Cu 0.690893 0.611451 3.60671e-19 125 63.546 0.000941529 -3.53913 63.546000 Cu 0.682987 0.626825 0.5 128 63.546 0.000218252 -3.53927 63.546000 Cu 0.744535 0.628743 2.40447e-19 126 63.546 0.000348243 -3.53905 63.546000 Cu 0.752348 0.613309 0.5 127 63.546 0.000641335 -3.5389 63.546000 Cu 0.813646 0.615166 5.66254e-17 129 63.546 0.00018854 -3.53903 63.546000 Cu 0.805951 0.630642 0.5 132 63.546 0.000239188 -3.53914 63.546000 Cu 0.882537 0.601538 4.83299e-17 98 63.546 0.00110731 -3.54047 63.546000 Cu 0.943958 0.603527 0.5 104 63.546 0.00143675 -3.54062 63.546000 Cu 0.867291 0.632535 1 130 63.546 7.02633e-05 -3.53944 63.546000 Cu 0.874899 0.617052 0.5 131 63.546 0.000187298 -3.53963 63.546000 Cu 0.93625 0.618976 1 133 63.546 0.000631788 -3.54034 63.546000 Cu 0.997819 0.620941 0.5 135 63.546 0.000560941 -3.54082 63.546000 Cu 0.113464 0.640251 1.22869e-16 138 63.546 8.81185e-05 -3.54047 63.546000 Cu 0.0517821 0.638298 0.5 139 63.546 0.000232266 -3.5407 63.546000 Cu 0.0441231 0.653709 1.23951e-16 169 63.546 0.000104178 -3.54046 63.546000 Cu 0.1057 0.655646 0.5 171 63.546 9.86048e-05 -3.54043 63.546000 Cu 0.23669 0.644151 1 142 63.546 9.24702e-05 -3.53984 63.546000 Cu 0.175117 0.642205 0.5 144 63.546 4.10984e-05 -3.54011 63.546000 Cu 0.16729 0.657599 1.26235e-17 173 63.546 2.30398e-05 -3.54026 63.546000 Cu 0.228877 0.659553 0.5 175 63.546 2.42053e-05 -3.53998 63.546000 Cu 0.359652 0.647992 1 146 63.546 0.000126233 -3.53968 63.546000 Cu 0.298194 0.64608 0.5 148 63.546 0.000152747 -3.53971 63.546000 Cu 0.421093 0.64989 0.5 152 63.546 3.40128e-05 -3.53985 63.546000 Cu 0.290432 0.661494 1.22989e-16 177 63.546 8.04935e-05 -3.53972 63.546000 Cu 0.351969 0.663414 0.5 179 63.546 7.73509e-05 -3.53954 63.546000 Cu 0.413482 0.665321 1.9356e-17 181 63.546 3.44614e-05 -3.53967 63.546000 Cu 0.428686 0.634439 5.16962e-17 149 63.546 9.72458e-05 -3.54001 63.546000 Cu 0.482584 0.651793 0 150 63.546 3.46334e-05 -3.54019 63.546000 Cu 0.490162 0.636357 0.5 151 63.546 0.000277323 -3.54048 63.546000 Cu 0.551782 0.638298 1.20224e-19 153 63.546 0.000232266 -3.5407 63.546000 Cu 0.544123 0.653709 0.5 156 63.546 0.000104178 -3.54046 63.546000 Cu 0.6057 0.655646 1 154 63.546 9.86048e-05 -3.54043 63.546000 Cu 0.613464 0.640251 0.5 155 63.546 8.81185e-05 -3.54047 63.546000 Cu 0.675117 0.642205 1 157 63.546 4.10984e-05 -3.54011 63.546000 Cu 0.66729 0.657599 0.5 160 63.546 2.30398e-05 -3.54026 63.546000 Cu 0.728877 0.659553 2.40447e-19 158 63.546 2.42053e-05 -3.53998 63.546000 Cu 0.73669 0.644151 0.5 159 63.546 9.24702e-05 -3.53984 63.546000 Cu 0.798194 0.64608 8.89655e-17 161 63.546 0.000152747 -3.53971 63.546000 Cu 0.851969 0.663414 8.71622e-17 162 63.546 7.73509e-05 -3.53954 63.546000 Cu 0.790432 0.661494 0.5 164 63.546 8.04935e-05 -3.53972 63.546000 Cu 0.990162 0.636357 0 134 63.546 0.000277323 -3.54048 63.546000 Cu 0.928686 0.634439 0.5 136 63.546 9.72458e-05 -3.54001 63.546000 Cu 0.859652 0.647992 0.5 163 63.546 0.000126233 -3.53968 63.546000 Cu 0.921093 0.64989 1.95965e-17 165 63.546 3.40128e-05 -3.53985 63.546000 Cu 0.982584 0.651793 0.5 167 63.546 3.46334e-05 -3.54019 63.546000 Cu 0.913482 0.665321 0.5 168 63.546 3.44614e-05 -3.53967 63.546000 Cu 0.0979983 0.671062 1.20224e-19 170 63.546 3.79226e-05 -3.54029 63.546000 Cu 0.0364816 0.669135 0.5 172 63.546 2.24486e-05 -3.54013 63.546000 Cu 0.0288283 0.684562 2.40447e-19 201 63.546 5.19648e-06 -3.53998 63.546000 Cu 0.0903204 0.686484 0.5 203 63.546 1.49667e-05 -3.54015 63.546000 Cu 0.0211658 0.699977 0.5 204 63.546 1.30684e-05 -3.53979 63.546000 Cu 0.221111 0.674948 1 174 63.546 1.85886e-05 -3.54011 63.546000 Cu 0.159534 0.673002 0.5 176 63.546 4.58566e-05 -3.54025 63.546000 Cu 0.282702 0.676888 0.5 180 63.546 1.07732e-05 -3.53991 63.546000 Cu 0.151849 0.688413 0 205 63.546 1.9498e-05 -3.54029 63.546000 Cu 0.213408 0.690348 0.5 207 63.546 1.35132e-05 -3.54037 63.546000 Cu 0.274992 0.692282 1 209 63.546 3.29749e-06 -3.54031 63.546000 Cu 0.344284 0.678817 2.40447e-19 178 63.546 2.77964e-05 -3.53986 63.546000 Cu 0.40583 0.680734 0.5 184 63.546 3.18374e-05 -3.53986 63.546000 Cu 0.33657 0.694213 0.5 211 63.546 7.56083e-06 -3.54021 63.546000 Cu 0.39813 0.696139 1.90194e-16 213 63.546 2.0769e-05 -3.54005 63.546000 Cu 0.467338 0.682646 8.98071e-17 182 63.546 1.44335e-05 -3.53989 63.546000 Cu 0.474989 0.667224 0.5 183 63.546 1.36498e-05 -3.53993 63.546000 Cu 0.536482 0.669135 4.31603e-17 185 63.546 2.24486e-05 -3.54013 63.546000 Cu 0.528828 0.684562 0.5 188 63.546 5.19648e-06 -3.53998 63.546000 Cu 0.459657 0.698059 0.5 215 63.546 2.06431e-05 -3.53989 63.546000 Cu 0.521166 0.699977 1.21185e-16 217 63.546 1.30684e-05 -3.53979 63.546000 Cu 0.59032 0.686484 8.06701e-17 186 63.546 1.49667e-05 -3.54015 63.546000 Cu 0.597998 0.671062 0.5 187 63.546 3.79226e-05 -3.54029 63.546000 Cu 0.659534 0.673002 1.03152e-16 189 63.546 4.58566e-05 -3.54025 63.546000 Cu 0.713408 0.690348 8.82442e-17 190 63.546 1.35132e-05 -3.54037 63.546000 Cu 0.651849 0.688413 0.5 192 63.546 1.9498e-05 -3.54029 63.546000 Cu 0.721111 0.674948 0.5 191 63.546 1.85886e-05 -3.54011 63.546000 Cu 0.782702 0.676888 1 193 63.546 1.07732e-05 -3.53991 63.546000 Cu 0.83657 0.694213 2.93346e-17 194 63.546 7.56083e-06 -3.54021 63.546000 Cu 0.844284 0.678817 0.5 195 63.546 2.77964e-05 -3.53986 63.546000 Cu 0.774992 0.692282 0.5 196 63.546 3.29749e-06 -3.54031 63.546000 Cu 0.974989 0.667224 1.31765e-16 166 63.546 1.36498e-05 -3.53993 63.546000 Cu 0.90583 0.680734 0 197 63.546 3.18374e-05 -3.53986 63.546000 Cu 0.959657 0.698059 0 198 63.546 2.06431e-05 -3.53989 63.546000 Cu 0.967338 0.682646 0.5 199 63.546 1.44335e-05 -3.53989 63.546000 Cu 0.89813 0.696139 0.5 200 63.546 2.0769e-05 -3.54005 63.546000 Cu 0.0826701 0.701896 1 202 63.546 8.79024e-06 -3.5398 63.546000 Cu 0.0134898 0.715377 1 233 63.546 1.04969e-05 -3.53986 63.546000 Cu 0.0673273 0.732689 1 234 63.546 4.82336e-06 -3.53989 63.546000 Cu 0.0750144 0.717296 0.5 235 63.546 5.9579e-06 -3.5398 63.546000 Cu 0.00578939 0.730768 0.5 236 63.546 4.96122e-06 -3.53987 63.546000 Cu 0.136535 0.719216 1.20224e-19 237 63.546 2.25967e-06 -3.53974 63.546000 Cu 0.205729 0.705747 9.32936e-17 206 63.546 1.03813e-05 -3.53994 63.546000 Cu 0.144192 0.70382 0.5 208 63.546 9.08522e-06 -3.53988 63.546000 Cu 0.267285 0.707676 0.5 212 63.546 7.66651e-06 -3.53999 63.546000 Cu 0.19806 0.721138 0.5 239 63.546 2.30062e-06 -3.53969 63.546000 Cu 0.259595 0.723064 2.7411e-17 241 63.546 3.18207e-06 -3.53969 63.546000 Cu 0.328846 0.709606 2.10391e-17 210 63.546 5.45628e-06 -3.53998 63.546000 Cu 0.390406 0.711533 0.5 216 63.546 7.32169e-06 -3.53996 63.546000 Cu 0.321141 0.724992 0.5 243 63.546 2.57199e-06 -3.53972 63.546000 Cu 0.382692 0.726919 1 245 63.546 2.26351e-06 -3.53978 63.546000 Cu 0.451954 0.713457 1.22508e-16 214 63.546 1.03392e-05 -3.5399 63.546000 Cu 0.51349 0.715377 0.5 220 63.546 1.04969e-05 -3.53986 63.546000 Cu 0.444244 0.728845 0.5 247 63.546 3.27284e-06 -3.53983 63.546000 Cu 0.505789 0.730768 1 249 63.546 4.96122e-06 -3.53987 63.546000 Cu 0.567327 0.732689 0.5 251 63.546 4.82336e-06 -3.53989 63.546000 Cu 0.575014 0.717296 2.40447e-19 218 63.546 5.9579e-06 -3.5398 63.546000 Cu 0.58267 0.701896 0.5 219 63.546 8.79024e-06 -3.5398 63.546000 Cu 0.644192 0.70382 1 221 63.546 9.08522e-06 -3.53988 63.546000 Cu 0.69806 0.721138 2.40447e-19 222 63.546 2.30062e-06 -3.53969 63.546000 Cu 0.705729 0.705747 0.5 223 63.546 1.03813e-05 -3.53994 63.546000 Cu 0.636535 0.719216 0.5 224 63.546 2.25967e-06 -3.53974 63.546000 Cu 0.767285 0.707676 1.20224e-19 225 63.546 7.66651e-06 -3.53999 63.546000 Cu 0.821141 0.724992 1 226 63.546 2.57199e-06 -3.53972 63.546000 Cu 0.828846 0.709606 0.5 227 63.546 5.45628e-06 -3.53998 63.546000 Cu 0.759595 0.723064 0.5 228 63.546 3.18207e-06 -3.53969 63.546000 Cu 0.890406 0.711533 1.39459e-16 229 63.546 7.32169e-06 -3.53996 63.546000 Cu 0.944244 0.728845 1 230 63.546 3.27284e-06 -3.53983 63.546000 Cu 0.951954 0.713457 0.5 231 63.546 1.03392e-05 -3.5399 63.546000 Cu 0.882692 0.726919 0.5 232 63.546 2.26351e-06 -3.53978 63.546000 Cu 0.128858 0.734609 0.5 240 63.546 2.09343e-06 -3.53991 63.546000 Cu 0.0519228 0.763457 3.55862e-17 266 63.546 1.84849e-06 -3.53968 63.546000 Cu 0.059626 0.748074 0.5 267 63.546 1.00827e-06 -3.53973 63.546000 Cu 0.113469 0.765382 0.5 269 63.546 1.18257e-06 -3.53973 63.546000 Cu 0.121165 0.749997 0 270 63.546 1.99164e-06 -3.53984 63.546000 Cu 0.190387 0.736529 3.00559e-17 238 63.546 5.06384e-07 -3.53993 63.546000 Cu 0.251918 0.738452 0.5 244 63.546 1.50289e-06 -3.53992 63.546000 Cu 0.182704 0.75192 0.5 272 63.546 1.61547e-06 -3.53998 63.546000 Cu 0.244241 0.753844 5.45816e-17 273 63.546 3.33348e-07 -3.54007 63.546000 Cu 0.313456 0.740377 7.40578e-17 242 63.546 2.56152e-06 -3.53989 63.546000 Cu 0.374998 0.742302 0.5 248 63.546 2.25232e-06 -3.53981 63.546000 Cu 0.305777 0.755767 0.5 275 63.546 5.48954e-07 -3.54007 63.546000 Cu 0.367312 0.75769 0 277 63.546 2.44493e-06 -3.53997 63.546000 Cu 0.436542 0.744228 0 246 63.546 8.17982e-07 -3.53973 63.546000 Cu 0.559626 0.748074 9.55778e-17 250 63.546 1.00827e-06 -3.53973 63.546000 Cu 0.498085 0.746152 0.5 252 63.546 1.47277e-07 -3.53969 63.546000 Cu 0.428846 0.759612 0.5 279 63.546 3.93497e-06 -3.53982 63.546000 Cu 0.490381 0.761534 2.57279e-17 281 63.546 3.70086e-06 -3.53971 63.546000 Cu 0.551923 0.763457 0.5 283 63.546 1.84849e-06 -3.53968 63.546000 Cu 0.628858 0.734609 1 253 63.546 2.09343e-06 -3.53991 63.546000 Cu 0.682704 0.75192 2.40447e-19 254 63.546 1.61547e-06 -3.53998 63.546000 Cu 0.690387 0.736529 0.5 255 63.546 5.06384e-07 -3.53993 63.546000 Cu 0.621165 0.749997 0.5 256 63.546 1.99164e-06 -3.53984 63.546000 Cu 0.613469 0.765382 1 285 63.546 1.18257e-06 -3.53973 63.546000 Cu 0.751918 0.738452 1 257 63.546 1.50289e-06 -3.53992 63.546000 Cu 0.805777 0.755767 1 258 63.546 5.48954e-07 -3.54007 63.546000 Cu 0.813456 0.740377 0.5 259 63.546 2.56152e-06 -3.53989 63.546000 Cu 0.744241 0.753844 0.5 260 63.546 3.33348e-07 -3.54007 63.546000 Cu 0.874998 0.742302 6.37186e-18 261 63.546 2.25232e-06 -3.53981 63.546000 Cu 0.928846 0.759612 0 262 63.546 3.93497e-06 -3.53982 63.546000 Cu 0.936542 0.744228 0.5 263 63.546 8.17982e-07 -3.53973 63.546000 Cu 0.867312 0.75769 0.5 264 63.546 2.44493e-06 -3.53997 63.546000 Cu 0.998085 0.746152 6.73253e-18 265 63.546 1.47277e-07 -3.53969 63.546000 Cu 0.990381 0.761534 0.5 268 63.546 3.70086e-06 -3.53971 63.546000 Cu 0.0365132 0.794244 6.21557e-17 298 63.546 2.18951e-05 -3.54003 63.546000 Cu 0.044216 0.778843 0.5 299 63.546 1.3413e-05 -3.53984 63.546000 Cu 0.105763 0.780767 0 301 63.546 8.98831e-06 -3.53984 63.546000 Cu 0.0980457 0.796163 0.5 302 63.546 2.13985e-05 -3.54011 63.546000 Cu 0.175017 0.767308 5.28984e-17 271 63.546 1.98231e-06 -3.53983 63.546000 Cu 0.236563 0.769236 0.5 276 63.546 2.34357e-06 -3.53991 63.546000 Cu 0.159602 0.798086 4.5685e-18 303 63.546 1.58476e-05 -3.54013 63.546000 Cu 0.167321 0.782695 0.5 304 63.546 4.37997e-06 -3.53984 63.546000 Cu 0.228881 0.784625 1 305 63.546 4.67827e-06 -3.53981 63.546000 Cu 0.298102 0.771161 1.31164e-16 274 63.546 1.50974e-06 -3.53994 63.546000 Cu 0.421156 0.775004 1 278 63.546 5.73829e-06 -3.53984 63.546000 Cu 0.359632 0.773084 0.5 280 63.546 1.759e-06 -3.53989 63.546000 Cu 0.290434 0.786555 0.5 307 63.546 6.3058e-06 -3.53975 63.546000 Cu 0.35197 0.788482 1 309 63.546 6.78196e-06 -3.53971 63.546000 Cu 0.413487 0.790405 0.5 311 63.546 9.4024e-06 -3.53976 63.546000 Cu 0.544216 0.778843 0 282 63.546 1.3413e-05 -3.53984 63.546000 Cu 0.482682 0.776923 0.5 284 63.546 1.10707e-05 -3.53982 63.546000 Cu 0.474998 0.792325 2.40447e-19 313 63.546 1.65643e-05 -3.53989 63.546000 Cu 0.536513 0.794244 0.5 315 63.546 2.18951e-05 -3.54003 63.546000 Cu 0.667321 0.782695 2.40447e-19 286 63.546 4.37997e-06 -3.53984 63.546000 Cu 0.675017 0.767308 0.5 287 63.546 1.98231e-06 -3.53983 63.546000 Cu 0.605763 0.780767 0.5 288 63.546 8.98831e-06 -3.53984 63.546000 Cu 0.598046 0.796163 1 317 63.546 2.13985e-05 -3.54011 63.546000 Cu 0.659602 0.798086 0.5 319 63.546 1.58476e-05 -3.54013 63.546000 Cu 0.736563 0.769236 1 289 63.546 2.34357e-06 -3.53991 63.546000 Cu 0.790434 0.786555 1 290 63.546 6.3058e-06 -3.53975 63.546000 Cu 0.798102 0.771161 0.5 291 63.546 1.50974e-06 -3.53994 63.546000 Cu 0.728881 0.784625 0.5 292 63.546 4.67827e-06 -3.53981 63.546000 Cu 0.85197 0.788482 0.5 296 63.546 6.78196e-06 -3.53971 63.546000 Cu 0.859632 0.773084 7.21342e-18 293 63.546 1.759e-06 -3.53989 63.546000 Cu 0.913487 0.790405 3.96738e-18 294 63.546 9.4024e-06 -3.53976 63.546000 Cu 0.921156 0.775004 0.5 295 63.546 5.73829e-06 -3.53984 63.546000 Cu 0.982682 0.776923 1.03633e-16 297 63.546 1.10707e-05 -3.53982 63.546000 Cu 0.974998 0.792325 0.5 300 63.546 1.65643e-05 -3.53989 63.546000 Cu 0.0212084 0.825087 1 330 63.546 1.44936e-05 -3.53987 63.546000 Cu 0.0288334 0.80966 0.5 331 63.546 2.25496e-05 -3.53996 63.546000 Cu 0.0903465 0.811572 1.20224e-19 333 63.546 3.53173e-05 -3.53995 63.546000 Cu 0.0827046 0.82699 0.5 334 63.546 4.45747e-05 -3.5396 63.546000 Cu 0.221183 0.800016 0.5 308 63.546 8.57095e-06 -3.54012 63.546000 Cu 0.282762 0.80195 1.47995e-16 306 63.546 1.68365e-05 -3.5401 63.546000 Cu 0.144228 0.828895 1.1301e-17 335 63.546 7.40686e-05 -3.53947 63.546000 Cu 0.151892 0.813488 0.5 336 63.546 2.98017e-05 -3.53998 63.546000 Cu 0.213467 0.815413 8.05499e-17 337 63.546 1.74077e-05 -3.54012 63.546000 Cu 0.267327 0.832752 0 338 63.546 2.43738e-05 -3.53975 63.546000 Cu 0.27506 0.817351 0.5 339 63.546 1.11494e-05 -3.54028 63.546000 Cu 0.205768 0.830814 0.5 340 63.546 6.86406e-05 -3.53953 63.546000 Cu 0.405846 0.805818 0 310 63.546 1.7335e-05 -3.54008 63.546000 Cu 0.344322 0.803885 0.5 312 63.546 2.65675e-05 -3.54009 63.546000 Cu 0.336645 0.819298 0 341 63.546 3.53183e-05 -3.54048 63.546000 Cu 0.398194 0.821242 0.5 343 63.546 4.72129e-05 -3.54048 63.546000 Cu 0.528833 0.80966 1 314 63.546 2.25496e-05 -3.53996 63.546000 Cu 0.467345 0.807743 0.5 316 63.546 8.48283e-06 -3.54006 63.546000 Cu 0.45971 0.823174 3.0657e-17 345 63.546 2.94055e-05 -3.54022 63.546000 Cu 0.521208 0.825087 0.5 347 63.546 1.44936e-05 -3.53987 63.546000 Cu 0.651892 0.813488 8.41566e-19 318 63.546 2.98017e-05 -3.53998 63.546000 Cu 0.590346 0.811572 0.5 320 63.546 3.53173e-05 -3.53995 63.546000 Cu 0.713467 0.815413 0.5 324 63.546 1.74077e-05 -3.54012 63.546000 Cu 0.582705 0.82699 2.32032e-17 349 63.546 4.45747e-05 -3.5396 63.546000 Cu 0.644228 0.828895 0.5 351 63.546 7.40686e-05 -3.53947 63.546000 Cu 0.705768 0.830814 9.89441e-17 353 63.546 6.86406e-05 -3.53953 63.546000 Cu 0.721183 0.800016 7.8987e-17 321 63.546 8.57095e-06 -3.54012 63.546000 Cu 0.77506 0.817351 4.55648e-17 322 63.546 1.11494e-05 -3.54028 63.546000 Cu 0.782762 0.80195 0.5 323 63.546 1.68365e-05 -3.5401 63.546000 Cu 0.844322 0.803885 9.14902e-17 325 63.546 2.65675e-05 -3.54009 63.546000 Cu 0.836645 0.819298 0.5 328 63.546 3.53183e-05 -3.54048 63.546000 Cu 0.767327 0.832752 0.5 355 63.546 2.43738e-05 -3.53975 63.546000 Cu 0.898194 0.821242 2.40447e-19 326 63.546 4.72129e-05 -3.54048 63.546000 Cu 0.905846 0.805818 0.5 327 63.546 1.7335e-05 -3.54008 63.546000 Cu 0.967345 0.807743 1 329 63.546 8.48283e-06 -3.54006 63.546000 Cu 0.95971 0.823174 0.5 332 63.546 2.94055e-05 -3.54022 63.546000 Cu 0.0061098 0.855955 0 362 63.546 0.000237241 -3.54065 63.546000 Cu 0.0136374 0.840522 0.5 363 63.546 5.56077e-05 -3.54018 63.546000 Cu 0.0751404 0.842424 1.20224e-19 365 63.546 3.86837e-05 -3.54005 63.546000 Cu 0.0676451 0.85788 0.5 366 63.546 0.000143994 -3.54039 63.546000 Cu 0.129056 0.859791 1.20224e-19 367 63.546 7.40321e-05 -3.53989 63.546000 Cu 0.136616 0.844322 0.5 368 63.546 0.000148637 -3.5399 63.546000 Cu 0.198072 0.846232 1 369 63.546 0.000197527 -3.53955 63.546000 Cu 0.251803 0.863585 1.20224e-19 370 63.546 0.000422874 -3.53964 63.546000 Cu 0.259564 0.848158 0.5 371 63.546 0.000135887 -3.53966 63.546000 Cu 0.190414 0.861686 0.5 372 63.546 0.000206878 -3.53961 63.546000 Cu 0.390505 0.836661 6.7205e-17 342 63.546 8.8078e-05 -3.54031 63.546000 Cu 0.328898 0.834704 0.5 344 63.546 8.65571e-06 -3.54008 63.546000 Cu 0.321131 0.850103 1 373 63.546 4.9174e-05 -3.54004 63.546000 Cu 0.38277 0.852056 0.5 375 63.546 5.88964e-05 -3.5405 63.546000 Cu 0.313348 0.865498 0.5 376 63.546 0.00031001 -3.53996 63.546000 Cu 0.513637 0.840522 7.56207e-17 346 63.546 5.56077e-05 -3.54018 63.546000 Cu 0.452083 0.838602 0.5 348 63.546 0.000120138 -3.54032 63.546000 Cu 0.444467 0.854012 9.60587e-17 377 63.546 0.000175644 -3.54065 63.546000 Cu 0.50611 0.855955 0.5 379 63.546 0.000237241 -3.54065 63.546000 Cu 0.567645 0.85788 3.93131e-17 381 63.546 0.000143994 -3.54039 63.546000 Cu 0.636616 0.844322 4.19581e-17 350 63.546 0.000148637 -3.5399 63.546000 Cu 0.57514 0.842424 0.5 352 63.546 3.86837e-05 -3.54005 63.546000 Cu 0.698072 0.846232 0.5 356 63.546 0.000197527 -3.53955 63.546000 Cu 0.629056 0.859791 0.5 383 63.546 7.40321e-05 -3.53989 63.546000 Cu 0.690414 0.861686 2.40447e-19 385 63.546 0.000206878 -3.53961 63.546000 Cu 0.759564 0.848158 1.22748e-16 354 63.546 0.000135887 -3.53966 63.546000 Cu 0.828898 0.834704 1 357 63.546 8.65571e-06 -3.54008 63.546000 Cu 0.821131 0.850103 0.5 360 63.546 4.9174e-05 -3.54004 63.546000 Cu 0.751803 0.863585 0.5 387 63.546 0.000422874 -3.53964 63.546000 Cu 0.813348 0.865498 2.40447e-19 389 63.546 0.00031001 -3.53996 63.546000 Cu 0.88277 0.852056 1 358 63.546 5.88964e-05 -3.5405 63.546000 Cu 0.890505 0.836661 0.5 359 63.546 8.8078e-05 -3.54031 63.546000 Cu 0.952083 0.838602 1 361 63.546 0.000120138 -3.54032 63.546000 Cu 0.944467 0.854012 0.5 364 63.546 0.000175644 -3.54065 63.546000 Cu 0.0601977 0.87334 0 397 63.546 0.000653786 -3.53994 63.546000 Cu 0.11415 0.890785 1.20224e-19 398 63.546 0.00127368 -3.54017 63.546000 Cu 0.0526591 0.888775 0.5 399 63.546 0.0012798 -3.54035 63.546000 Cu 0.121582 0.87528 0.5 400 63.546 0.000230226 -3.53923 63.546000 Cu 0.182856 0.877179 0 401 63.546 0.000168897 -3.53899 63.546000 Cu 0.236723 0.894531 8.62004e-17 402 63.546 0.000801366 -3.53965 63.546000 Cu 0.244159 0.879042 0.5 403 63.546 0.000648412 -3.53911 63.546000 Cu 0.175429 0.892705 0.5 404 63.546 0.000609688 -3.53991 63.546000 Cu 0.375036 0.867434 1 374 63.546 0.000124204 -3.54033 63.546000 Cu 0.305618 0.880893 1.22508e-16 405 63.546 0.00104684 -3.5393 63.546000 Cu 0.359681 0.898126 0 406 63.546 0.0020447 -3.53833 63.546000 Cu 0.367307 0.882781 0.5 407 63.546 0.000539661 -3.53916 63.546000 Cu 0.298126 0.896318 0.5 408 63.546 0.00144401 -3.53896 63.546000 Cu 0.498577 0.871366 8.53588e-18 378 63.546 0.00046166 -3.54045 63.546000 Cu 0.436827 0.86939 0.5 380 63.546 0.000154168 -3.54056 63.546000 Cu 0.560198 0.87334 0.5 384 63.546 0.000653786 -3.53994 63.546000 Cu 0.429125 0.884726 1 409 63.546 0.000208034 -3.53956 63.546000 Cu 0.490984 0.886734 0.5 411 63.546 0.000750156 -3.54019 63.546000 Cu 0.552659 0.888775 0 413 63.546 0.0012798 -3.54035 63.546000 Cu 0.621582 0.87528 1.74084e-16 382 63.546 0.000230226 -3.53923 63.546000 Cu 0.682856 0.877179 0.5 388 63.546 0.000168897 -3.53899 63.546000 Cu 0.61415 0.890785 0.5 415 63.546 0.00127368 -3.54017 63.546000 Cu 0.675429 0.892705 1 417 63.546 0.000609688 -3.53991 63.546000 Cu 0.744159 0.879042 1.99571e-17 386 63.546 0.000648412 -3.53911 63.546000 Cu 0.805618 0.880893 0.5 392 63.546 0.00104684 -3.5393 63.546000 Cu 0.736723 0.894531 0.5 419 63.546 0.000801366 -3.53965 63.546000 Cu 0.798126 0.896318 2.40447e-19 421 63.546 0.00144401 -3.53896 63.546000 Cu 0.867307 0.882781 1.21065e-16 390 63.546 0.000539661 -3.53916 63.546000 Cu 0.875036 0.867434 0.5 391 63.546 0.000124204 -3.54033 63.546000 Cu 0.936827 0.86939 1.20224e-19 393 63.546 0.000154168 -3.54056 63.546000 Cu 0.990984 0.886734 5.84287e-17 394 63.546 0.000750156 -3.54019 63.546000 Cu 0.998577 0.871366 0.5 395 63.546 0.00046166 -3.54045 63.546000 Cu 0.929125 0.884726 0.5 396 63.546 0.000208034 -3.53956 63.546000 Cu 0.859681 0.898126 0.5 423 63.546 0.0020447 -3.53833 63.546000 Cu 0.0448498 0.904177 7.04511e-17 429 63.546 0.00140369 -3.54076 63.546000 Cu 0.0987037 0.921665 1.00026e-16 430 63.546 0.0070691 -3.5429 63.546000 Cu 0.106561 0.906273 0.5 431 63.546 0.00363447 -3.54212 63.546000 Cu 0.0365833 0.919509 0.5 432 63.546 0.00144201 -3.53947 63.546000 Cu 0.168181 0.908252 0 433 63.546 0.00369041 -3.54208 63.546000 Cu 0.223041 0.925609 1.20224e-19 434 63.546 0.00590642 -3.53976 63.546000 Cu 0.229648 0.910072 0.5 435 63.546 0.00110869 -3.54036 63.546000 Cu 0.161051 0.923726 0.5 436 63.546 0.0113045 -3.54289 63.546000 Cu 0.28438 0.927372 0.5 440 63.546 0.00406126 -3.53527 63.546000 Cu 0.42134 0.900038 0.5 412 63.546 0.00161471 -3.53823 63.546000 Cu 0.290991 0.911792 1.20224e-19 437 63.546 0.00163338 -3.53795 63.546000 Cu 0.345097 0.929098 1 438 63.546 0.0110013 -3.53127 63.546000 Cu 0.35222 0.913544 0.5 439 63.546 0.00444353 -3.536 63.546000 Cu 0.41347 0.915395 2.32753e-16 441 63.546 0.00533716 -3.53522 63.546000 Cu 0.40557 0.930889 0.5 444 63.546 0.0159672 -3.52913 63.546000 Cu 0.483083 0.902069 0 410 63.546 0.000684812 -3.53923 63.546000 Cu 0.54485 0.904177 0.5 416 63.546 0.00140369 -3.54076 63.546000 Cu 0.466269 0.932784 0 442 63.546 0.0123541 -3.53371 63.546000 Cu 0.47484 0.917388 0.5 443 63.546 0.00301611 -3.53579 63.546000 Cu 0.536583 0.919509 7.33365e-17 445 63.546 0.00144201 -3.53947 63.546000 Cu 0.606561 0.906273 2.40447e-19 414 63.546 0.00363447 -3.54212 63.546000 Cu 0.668181 0.908252 0.5 420 63.546 0.00369041 -3.54208 63.546000 Cu 0.598704 0.921665 0.5 447 63.546 0.0070691 -3.5429 63.546000 Cu 0.661051 0.923726 1 449 63.546 0.0113045 -3.54289 63.546000 Cu 0.729648 0.910072 2.40447e-19 418 63.546 0.00110869 -3.54036 63.546000 Cu 0.85222 0.913544 1 422 63.546 0.00444353 -3.536 63.546000 Cu 0.790991 0.911792 0.5 424 63.546 0.00163338 -3.53795 63.546000 Cu 0.723041 0.925609 0.5 451 63.546 0.00590642 -3.53976 63.546000 Cu 0.78438 0.927372 2.40447e-19 453 63.546 0.00406126 -3.53527 63.546000 Cu 0.845097 0.929098 0.5 455 63.546 0.0110013 -3.53127 63.546000 Cu 0.92134 0.900038 2.40447e-19 425 63.546 0.00161471 -3.53823 63.546000 Cu 0.97484 0.917388 0 426 63.546 0.00301611 -3.53579 63.546000 Cu 0.983083 0.902069 0.5 427 63.546 0.000684812 -3.53923 63.546000 Cu 0.91347 0.915395 0.5 428 63.546 0.00533716 -3.53522 63.546000 Cu 0.90557 0.930889 4.64063e-17 457 63.546 0.0159672 -3.52913 63.546000 Cu 0.966269 0.932784 0.5 459 63.546 0.0123541 -3.53371 63.546000 Cu 0.0277034 0.934775 8.68015e-17 461 63.546 0.011189 -3.53816 63.546000 Cu 0.0820226 0.95177 0 462 63.546 0.0245114 -3.536 63.546000 Cu 0.0905147 0.936849 0.5 463 63.546 0.0110908 -3.5417 63.546000 Cu 0.0186683 0.950035 0.5 464 63.546 0.0412465 -3.53768 63.546000 Cu 0.00994976 0.965219 4.02749e-17 493 63.546 0.119259 -3.52396 63.546000 Cu 0.0742567 0.96658 0.5 495 63.546 0.0555017 -3.5359 63.546000 Cu 0.154007 0.938985 7.526e-17 465 63.546 0.0191777 -3.54115 63.546000 Cu 0.211274 0.956448 1 466 63.546 0.109526 -3.53514 63.546000 Cu 0.217018 0.941098 0.5 467 63.546 0.0290899 -3.53897 63.546000 Cu 0.147003 0.953907 0.5 468 63.546 0.0246172 -3.53245 63.546000 Cu 0.278469 0.943098 1 469 63.546 0.0288627 -3.53262 63.546000 Cu 0.273243 0.959161 0.5 472 63.546 0.204044 -3.50412 63.546000 Cu 0.331493 0.961441 1.22508e-16 470 63.546 0.0854512 -3.49899 63.546000 Cu 0.338443 0.944972 0.5 471 63.546 0.0336669 -3.52249 63.546000 Cu 0.397562 0.946746 1 473 63.546 0.0312595 -3.52774 63.546000 Cu 0.388889 0.963338 0.5 476 63.546 0.0761345 -3.52749 63.546000 Cu 0.527703 0.934775 0.5 448 63.546 0.011189 -3.53816 63.546000 Cu 0.448471 0.964365 1.20224e-19 474 63.546 0.0873553 -3.5307 63.546000 Cu 0.457039 0.948411 0.5 475 63.546 0.0483477 -3.53131 63.546000 Cu 0.518668 0.950035 1 477 63.546 0.0412465 -3.53768 63.546000 Cu 0.50995 0.965219 0.5 480 63.546 0.119259 -3.52396 63.546000 Cu 0.590515 0.936849 1 446 63.546 0.0110908 -3.5417 63.546000 Cu 0.654007 0.938985 0.5 452 63.546 0.0191777 -3.54115 63.546000 Cu 0.582023 0.95177 0.5 479 63.546 0.0245114 -3.536 63.546000 Cu 0.647003 0.953907 1 481 63.546 0.0246172 -3.53245 63.546000 Cu 0.711274 0.956448 0.5 483 63.546 0.109526 -3.53514 63.546000 Cu 0.574257 0.96658 1 478 63.546 0.0555017 -3.5359 63.546000 Cu 0.717018 0.941098 1 450 63.546 0.0290899 -3.53897 63.546000 Cu 0.838443 0.944972 1.20224e-19 454 63.546 0.0336669 -3.52249 63.546000 Cu 0.778469 0.943098 0.5 456 63.546 0.0288627 -3.53262 63.546000 Cu 0.773243 0.959161 2.40447e-19 485 63.546 0.204044 -3.50412 63.546000 Cu 0.831493 0.961441 0.5 487 63.546 0.0854512 -3.49899 63.546000 Cu 0.957039 0.948411 1.22748e-16 458 63.546 0.0483477 -3.53131 63.546000 Cu 0.897562 0.946746 0.5 460 63.546 0.0312595 -3.52774 63.546000 Cu 0.888889 0.963338 1.54848e-16 489 63.546 0.0761345 -3.52749 63.546000 Cu 0.948471 0.964365 0.5 491 63.546 0.0873553 -3.5307 63.546000 Cu 0.066228 0.981067 0 494 63.546 0.319137 -3.50596 63.546000 Cu 0.00404331 0.980727 0.5 496 63.546 0.11156 -3.53174 63.546000 Cu 0.139081 0.968381 1.2924e-16 497 63.546 0.0775397 -3.51367 63.546000 Cu 0.133359 0.982809 0.5 500 63.546 4.61625 -3.45732 63.546000 Cu 0.0634777 0.996289 0.5 521 63.546 0.410382 -3.49942 63.546000 Cu 0.123421 0.996259 7.00904e-17 522 63.546 6.33126 -3.2209 63.546000 Cu 0.00225192 0.996306 4.00345e-17 520 63.546 0.0827674 -3.53432 63.546000 Cu 0.249132 0.996087 0.5 531 63.546 8.29194 -3.54377 63.546000 Cu 0.196219 0.986005 4.01547e-17 498 63.546 9.13723 -3.32069 63.546000 Cu 0.205217 0.971457 0.5 499 63.546 0.97459 -3.45031 63.546000 Cu 0.266837 0.975738 1 501 63.546 1.05955 -3.41841 63.546000 Cu 0.312074 0.996288 3.19795e-17 530 63.546 2.19991 -3.51422 63.546000 Cu 0.377234 0.996266 0.5 532 63.546 0.348394 -3.52115 63.546000 Cu 0.321669 0.979301 0.5 503 63.546 0.503046 -3.46913 63.546000 Cu 0.381218 0.979952 1.20224e-19 505 63.546 0.178407 -3.51796 63.546000 Cu 0.440122 0.99628 5.32591e-17 506 63.546 0.118046 -3.53438 63.546000 Cu 0.442476 0.980431 0.5 507 63.546 0.0871551 -3.53046 63.546000 Cu 0.504043 0.980727 2.05583e-17 509 63.546 0.11156 -3.53174 63.546000 Cu 0.563478 0.996289 1 510 63.546 0.410382 -3.49942 63.546000 Cu 0.566228 0.981067 0.5 511 63.546 0.319137 -3.50596 63.546000 Cu 0.502252 0.996306 0.5 512 63.546 0.0827674 -3.53432 63.546000 Cu 0.705217 0.971457 1 482 63.546 0.97459 -3.45031 63.546000 Cu 0.639081 0.968381 0.5 484 63.546 0.0775397 -3.51367 63.546000 Cu 0.633359 0.982809 1 513 63.546 4.61625 -3.45732 63.546000 Cu 0.696219 0.986005 0.5 514 63.546 9.13723 -3.32069 63.546000 Cu 0.623421 0.996259 0.5 515 63.546 6.33126 -3.2209 63.546000 Cu 0.749132 0.996087 8.41566e-19 561 63.546 8.29194 -3.54377 63.546000 Cu 0.812074 0.996288 0.5 563 63.546 2.19991 -3.51422 63.546000 Cu 0.821669 0.979301 7.2014e-17 486 63.546 0.503046 -3.46913 63.546000 Cu 0.766837 0.975738 0.5 488 63.546 1.05955 -3.41841 63.546000 Cu 0.877234 0.996266 2.76515e-17 523 63.546 0.348394 -3.52115 63.546000 Cu 0.942476 0.980431 3.84716e-17 490 63.546 0.0871551 -3.53046 63.546000 Cu 0.881218 0.979952 0.5 492 63.546 0.178407 -3.51796 63.546000 Cu 0.940122 0.99628 0.5 519 63.546 0.118046 -3.53438