Number of particles = 1048 A = 1 Angstrom (basic length-scale) H0(1,1) = 20.7371 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 117.426 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.0997 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 0.0682403 0.00187072 0.25 538 63.546 6.13744 -3.49236 63.546000 Cu 0.0682403 0.00187072 0.75 540 63.546 6.13744 -3.49236 63.546000 Cu 0.0180042 0.0179738 3.06996e-16 545 63.546 0.0556025 -3.53524 63.546000 Cu 0.142227 0.0149528 6.87467e-16 554 63.546 4.69908 -3.46241 63.546000 Cu 0.142227 0.0149528 0.5 555 63.546 4.69908 -3.46241 63.546000 Cu 0.0943233 0.0312553 0.25 556 63.546 0.0667382 -3.53286 63.546000 Cu 0.0180042 0.0179738 0.5 558 63.546 0.0556025 -3.53524 63.546000 Cu 0.0943233 0.0312553 0.75 560 63.546 0.0667382 -3.53286 63.546000 Cu 0.260214 0.00676799 1.32153e-16 553 63.546 4.79313 -3.31592 63.546000 Cu 0.220267 0.026351 0.25 557 63.546 0.41283 -3.48685 63.546000 Cu 0.382813 0.00439895 2.40664e-16 562 63.546 0.420949 -3.50737 63.546000 Cu 0.382813 0.00439895 0.5 563 63.546 0.420949 -3.50737 63.546000 Cu 0.335402 0.0217436 0.25 564 63.546 0.152601 -3.50515 63.546000 Cu 0.260214 0.00676799 0.5 566 63.546 4.79313 -3.31592 63.546000 Cu 0.220267 0.026351 0.75 567 63.546 0.41283 -3.48685 63.546000 Cu 0.335402 0.0217436 0.75 568 63.546 0.152601 -3.50515 63.546000 Cu 0.504799 0.00391766 5.91371e-16 561 63.546 0.358047 -3.52493 63.546000 Cu 0.45449 0.019855 0.25 565 63.546 0.136171 -3.52037 63.546000 Cu 0.578364 0.0175358 0.25 569 63.546 0.0392335 -3.5305 63.546000 Cu 0.504799 0.00391766 0.5 570 63.546 0.358047 -3.52493 63.546000 Cu 0.45449 0.019855 0.75 571 63.546 0.136171 -3.52037 63.546000 Cu 0.578364 0.0175358 0.75 572 63.546 0.0392335 -3.5305 63.546000 Cu 0.530222 0.0337762 1 595 63.546 0.0361825 -3.53285 63.546000 Cu 0.530222 0.0337762 0.5 604 63.546 0.0361825 -3.53285 63.546000 Cu 0.630632 0.00186764 3.3676e-16 531 63.546 5.77625 -3.48109 63.546000 Cu 0.630632 0.00186764 0.5 532 63.546 5.77625 -3.48109 63.546000 Cu 0.703641 0.0147816 0.25 533 63.546 4.70961 -3.45258 63.546000 Cu 0.703641 0.0147816 0.75 536 63.546 4.70961 -3.45258 63.546000 Cu 0.782332 0.0257404 3.53258e-16 541 63.546 0.511262 -3.48642 63.546000 Cu 0.654048 0.0306073 3.47135e-16 542 63.546 0.100647 -3.52278 63.546000 Cu 0.654048 0.0306073 0.5 543 63.546 0.100647 -3.52278 63.546000 Cu 0.782332 0.0257404 0.5 550 63.546 0.511262 -3.48642 63.546000 Cu 0.821083 0.00645943 0.25 534 63.546 4.75628 -3.35737 63.546000 Cu 0.942195 0.00421892 0.25 535 63.546 0.590658 -3.52034 63.546000 Cu 0.821083 0.00645943 0.75 537 63.546 4.75628 -3.35737 63.546000 Cu 0.942195 0.00421892 0.75 539 63.546 0.590658 -3.52034 63.546000 Cu 0.897194 0.0211837 1.70081e-19 546 63.546 0.0975837 -3.52084 63.546000 Cu 0.897194 0.0211837 0.5 547 63.546 0.0975837 -3.52084 63.546000 Cu 0.049405 0.0482631 1 579 63.546 0.0100688 -3.53891 63.546000 Cu 0.00493769 0.0655171 0.25 583 63.546 0.00563326 -3.53932 63.546000 Cu 0.17218 0.0438074 1.70081e-19 588 63.546 0.0558683 -3.53352 63.546000 Cu 0.17218 0.0438074 0.5 589 63.546 0.0558683 -3.53352 63.546000 Cu 0.126094 0.0612323 0.25 590 63.546 0.0141446 -3.53757 63.546000 Cu 0.049405 0.0482631 0.5 592 63.546 0.0100688 -3.53891 63.546000 Cu 0.00493769 0.0655171 0.75 593 63.546 0.00563326 -3.53932 63.546000 Cu 0.126094 0.0612323 0.75 594 63.546 0.0141446 -3.53757 63.546000 Cu 0.292311 0.0400718 3.82342e-16 587 63.546 0.0417543 -3.52757 63.546000 Cu 0.246525 0.0574303 0.25 591 63.546 0.00295469 -3.53795 63.546000 Cu 0.366168 0.0540192 0.25 598 63.546 0.00937081 -3.5377 63.546000 Cu 0.292311 0.0400718 0.5 600 63.546 0.0417543 -3.52757 63.546000 Cu 0.246525 0.0574303 0.75 601 63.546 0.00295469 -3.53795 63.546000 Cu 0.366168 0.0540192 0.75 602 63.546 0.00937081 -3.5377 63.546000 Cu 0.409441 0.036662 7.38151e-17 596 63.546 0.0532816 -3.52556 63.546000 Cu 0.409441 0.036662 0.5 597 63.546 0.0532816 -3.52556 63.546000 Cu 0.485528 0.0505532 0.25 599 63.546 0.0152171 -3.53574 63.546000 Cu 0.485528 0.0505532 0.75 605 63.546 0.0152171 -3.53574 63.546000 Cu 0.562535 0.0638765 1.74503e-16 629 63.546 0.00846058 -3.53823 63.546000 Cu 0.441632 0.067618 1.33854e-16 630 63.546 0.00466786 -3.53918 63.546000 Cu 0.441632 0.067618 0.5 631 63.546 0.00466786 -3.53918 63.546000 Cu 0.562535 0.0638765 0.5 637 63.546 0.00846058 -3.53823 63.546000 Cu 0.733114 0.0427471 0.25 544 63.546 0.0723585 -3.53401 63.546000 Cu 0.733114 0.0427471 0.75 551 63.546 0.0723585 -3.53401 63.546000 Cu 0.685598 0.059756 3.40162e-19 574 63.546 0.0222695 -3.53855 63.546000 Cu 0.685598 0.059756 0.5 575 63.546 0.0222695 -3.53855 63.546000 Cu 0.607423 0.0470641 0.25 603 63.546 0.0323508 -3.53384 63.546000 Cu 0.607423 0.0470641 0.75 606 63.546 0.0323508 -3.53384 63.546000 Cu 0.854807 0.0391256 0.25 548 63.546 0.0582723 -3.53395 63.546000 Cu 0.97287 0.034956 0.25 549 63.546 0.0223688 -3.53719 63.546000 Cu 0.854807 0.0391256 0.75 552 63.546 0.0582723 -3.53395 63.546000 Cu 0.97287 0.034956 0.75 559 63.546 0.0223688 -3.53719 63.546000 Cu 0.807862 0.0560955 8.91224e-17 573 63.546 0.00101411 -3.53974 63.546000 Cu 0.92945 0.052375 4.43571e-16 580 63.546 0.0156109 -3.53882 63.546000 Cu 0.92945 0.052375 0.5 581 63.546 0.0156109 -3.53882 63.546000 Cu 0.807862 0.0560955 0.5 584 63.546 0.00101411 -3.53974 63.546000 Cu 0.0806539 0.0786051 2.80633e-16 613 63.546 0.00488088 -3.53868 63.546000 Cu 0.0347149 0.0957868 0.25 617 63.546 0.00117166 -3.53964 63.546000 Cu 0.155697 0.0919912 0.25 624 63.546 0.000708357 -3.53947 63.546000 Cu 0.0806539 0.0786051 0.5 626 63.546 0.00488088 -3.53868 63.546000 Cu 0.0347149 0.0957868 0.75 627 63.546 0.00117166 -3.53964 63.546000 Cu 0.155697 0.0919912 0.75 628 63.546 0.000708357 -3.53947 63.546000 Cu 0.32123 0.0711561 6.48008e-17 621 63.546 0.0020309 -3.5391 63.546000 Cu 0.201036 0.0747279 9.01429e-18 622 63.546 0.00149923 -3.53892 63.546000 Cu 0.201036 0.0747279 0.5 623 63.546 0.00149923 -3.53892 63.546000 Cu 0.27613 0.0882909 0.25 625 63.546 0.000730274 -3.53956 63.546000 Cu 0.396807 0.0846631 0.25 632 63.546 0.00196204 -3.53966 63.546000 Cu 0.32123 0.0711561 0.5 634 63.546 0.0020309 -3.5391 63.546000 Cu 0.27613 0.0882909 0.75 635 63.546 0.000730274 -3.53956 63.546000 Cu 0.396807 0.0846631 0.75 636 63.546 0.00196204 -3.53966 63.546000 Cu 0.351742 0.101735 0 655 63.546 0.000907265 -3.53984 63.546000 Cu 0.351742 0.101735 0.5 668 63.546 0.000907265 -3.53984 63.546000 Cu 0.517966 0.0809105 0.25 633 63.546 0.00242936 -3.5397 63.546000 Cu 0.517966 0.0809105 0.75 638 63.546 0.00242936 -3.5397 63.546000 Cu 0.594531 0.0940247 1.70081e-19 663 63.546 0.00126614 -3.53986 63.546000 Cu 0.472933 0.0979515 1 664 63.546 0.000642443 -3.5399 63.546000 Cu 0.472933 0.0979515 0.5 665 63.546 0.000642443 -3.5399 63.546000 Cu 0.594531 0.0940247 0.5 671 63.546 0.00126614 -3.53986 63.546000 Cu 0.639781 0.0768711 0.25 576 63.546 0.00527548 -3.53966 63.546000 Cu 0.76141 0.0730929 0.25 577 63.546 0.000951786 -3.53987 63.546000 Cu 0.639781 0.0768711 0.75 578 63.546 0.00527548 -3.53966 63.546000 Cu 0.76141 0.0730929 0.75 585 63.546 0.000951786 -3.53987 63.546000 Cu 0.715801 0.0901788 1.14805e-16 608 63.546 0.000197487 -3.53992 63.546000 Cu 0.715801 0.0901788 0.5 609 63.546 0.000197487 -3.53992 63.546000 Cu 0.883286 0.0693708 0.25 582 63.546 0.000490583 -3.53984 63.546000 Cu 0.883286 0.0693708 0.75 586 63.546 0.000490583 -3.53984 63.546000 Cu 0.837288 0.086387 1.70081e-19 607 63.546 0.000366456 -3.53993 63.546000 Cu 0.959009 0.0825806 0 614 63.546 0.000405156 -3.5398 63.546000 Cu 0.959009 0.0825806 0.5 615 63.546 0.000405156 -3.5398 63.546000 Cu 0.91317 0.0996484 0.25 616 63.546 0.000149131 -3.53992 63.546000 Cu 0.837288 0.086387 0.5 618 63.546 0.000366456 -3.53993 63.546000 Cu 0.91317 0.0996484 0.75 620 63.546 0.000149131 -3.53992 63.546000 Cu 0.110064 0.109163 4.8354e-16 647 63.546 0.000117404 -3.53979 63.546000 Cu 0.0644006 0.126293 0.25 651 63.546 4.523e-05 -3.53987 63.546000 Cu 0.185492 0.12256 0.25 658 63.546 9.57965e-05 -3.53991 63.546000 Cu 0.110064 0.109163 0.5 660 63.546 0.000117404 -3.53979 63.546000 Cu 0.0644006 0.126293 0.75 661 63.546 4.523e-05 -3.53987 63.546000 Cu 0.185492 0.12256 0.75 662 63.546 9.57965e-05 -3.53991 63.546000 Cu 0.230947 0.105441 8.14177e-16 656 63.546 0.000303597 -3.53982 63.546000 Cu 0.230947 0.105441 0.5 657 63.546 0.000303597 -3.53982 63.546000 Cu 0.306545 0.118829 0.25 659 63.546 0.000389837 -3.53994 63.546000 Cu 0.306545 0.118829 0.75 669 63.546 0.000389837 -3.53994 63.546000 Cu 0.382423 0.132127 2.57843e-16 689 63.546 9.6277e-05 -3.53997 63.546000 Cu 0.261157 0.13592 2.13451e-16 690 63.546 0.000168995 -3.53996 63.546000 Cu 0.261157 0.13592 0.5 691 63.546 0.000168995 -3.53996 63.546000 Cu 0.382423 0.132127 0.5 701 63.546 9.6277e-05 -3.53997 63.546000 Cu 0.427735 0.115032 0.25 666 63.546 0.000216911 -3.53996 63.546000 Cu 0.549172 0.111152 0.25 667 63.546 0.00025854 -3.53992 63.546000 Cu 0.427735 0.115032 0.75 670 63.546 0.000216911 -3.53996 63.546000 Cu 0.549172 0.111152 0.75 672 63.546 0.00025854 -3.53992 63.546000 Cu 0.503782 0.128275 3.17031e-16 697 63.546 4.75715e-05 -3.53994 63.546000 Cu 0.503782 0.128275 0.5 698 63.546 4.75715e-05 -3.53994 63.546000 Cu 0.670489 0.107307 0.25 610 63.546 2.01234e-05 -3.53994 63.546000 Cu 0.791745 0.103473 0.25 611 63.546 7.88563e-05 -3.53994 63.546000 Cu 0.670489 0.107307 0.75 612 63.546 2.01234e-05 -3.53994 63.546000 Cu 0.791745 0.103473 0.75 619 63.546 7.88563e-05 -3.53994 63.546000 Cu 0.625092 0.124426 3.3608e-16 639 63.546 2.87048e-05 -3.53994 63.546000 Cu 0.746351 0.120593 2.91689e-16 641 63.546 2.3019e-05 -3.53993 63.546000 Cu 0.746351 0.120593 0.5 642 63.546 2.3019e-05 -3.53993 63.546000 Cu 0.625092 0.124426 0.5 645 63.546 2.87048e-05 -3.53994 63.546000 Cu 0.700891 0.137719 0.25 643 63.546 6.05738e-06 -3.53992 63.546000 Cu 0.700891 0.137719 0.75 646 63.546 6.05738e-06 -3.53992 63.546000 Cu 0.867572 0.116759 2.61244e-16 640 63.546 5.38206e-05 -3.53992 63.546000 Cu 0.82211 0.133895 0.25 644 63.546 6.95669e-06 -3.53991 63.546000 Cu 0.988914 0.112925 2.17533e-16 648 63.546 0.000408676 -3.53984 63.546000 Cu 0.988914 0.112925 0.5 649 63.546 0.000408676 -3.53984 63.546000 Cu 0.943294 0.13006 0.25 650 63.546 0.000230141 -3.53987 63.546000 Cu 0.867572 0.116759 0.5 652 63.546 5.38206e-05 -3.53992 63.546000 Cu 0.82211 0.133895 0.75 653 63.546 6.95669e-06 -3.53991 63.546000 Cu 0.943294 0.13006 0.75 654 63.546 0.000230141 -3.53987 63.546000 Cu 0.139983 0.139665 3.81491e-16 681 63.546 6.77192e-05 -3.53992 63.546000 Cu 0.0188923 0.143428 4.59218e-16 682 63.546 3.06844e-05 -3.53988 63.546000 Cu 0.0188923 0.143428 0.5 683 63.546 3.06844e-05 -3.53988 63.546000 Cu 0.0946028 0.156785 0.25 685 63.546 2.17565e-05 -3.53992 63.546000 Cu 0.139983 0.139665 0.5 694 63.546 6.77192e-05 -3.53992 63.546000 Cu 0.0946028 0.156785 0.75 695 63.546 2.17565e-05 -3.53992 63.546000 Cu 0.170383 0.170117 1.29432e-16 715 63.546 2.89587e-05 -3.53996 63.546000 Cu 0.170383 0.170117 0.5 728 63.546 2.89587e-05 -3.53996 63.546000 Cu 0.215736 0.153014 0.25 692 63.546 8.80812e-05 -3.53995 63.546000 Cu 0.337023 0.149221 0.25 693 63.546 3.99871e-05 -3.53996 63.546000 Cu 0.215736 0.153014 0.75 696 63.546 8.80812e-05 -3.53995 63.546000 Cu 0.337023 0.149221 0.75 702 63.546 3.99871e-05 -3.53996 63.546000 Cu 0.291613 0.166319 3.40162e-19 724 63.546 1.63393e-05 -3.53996 63.546000 Cu 0.291613 0.166319 0.5 725 63.546 1.63393e-05 -3.53996 63.546000 Cu 0.458358 0.145388 0.25 699 63.546 1.30939e-05 -3.53995 63.546000 Cu 0.579669 0.141547 0.25 700 63.546 5.21567e-05 -3.53994 63.546000 Cu 0.458358 0.145388 0.75 703 63.546 1.30939e-05 -3.53995 63.546000 Cu 0.579669 0.141547 0.75 704 63.546 5.21567e-05 -3.53994 63.546000 Cu 0.412915 0.162497 1.31473e-16 723 63.546 9.86415e-06 -3.53995 63.546000 Cu 0.534206 0.158662 2.63625e-16 731 63.546 5.88679e-05 -3.53994 63.546000 Cu 0.534206 0.158662 0.5 732 63.546 5.88679e-05 -3.53994 63.546000 Cu 0.412915 0.162497 0.5 735 63.546 9.86415e-06 -3.53995 63.546000 Cu 0.655414 0.154849 1.02049e-18 673 63.546 3.86892e-06 -3.53992 63.546000 Cu 0.776637 0.151023 1 675 63.546 8.33523e-06 -3.53992 63.546000 Cu 0.776637 0.151023 0.5 676 63.546 8.33523e-06 -3.53992 63.546000 Cu 0.731161 0.168147 0.25 677 63.546 2.13235e-05 -3.53992 63.546000 Cu 0.655414 0.154849 0.5 679 63.546 3.86892e-06 -3.53992 63.546000 Cu 0.731161 0.168147 0.75 680 63.546 2.13235e-05 -3.53992 63.546000 Cu 0.609924 0.171972 0.25 734 63.546 9.84352e-06 -3.53993 63.546000 Cu 0.609924 0.171972 0.75 738 63.546 9.84352e-06 -3.53993 63.546000 Cu 0.897843 0.147207 1.70081e-17 674 63.546 9.1194e-05 -3.53988 63.546000 Cu 0.852364 0.164341 0.25 678 63.546 2.84575e-05 -3.5399 63.546000 Cu 0.973502 0.160563 0.25 684 63.546 1.94379e-05 -3.53991 63.546000 Cu 0.897843 0.147207 0.5 686 63.546 9.1194e-05 -3.53988 63.546000 Cu 0.852364 0.164341 0.75 687 63.546 2.84575e-05 -3.5399 63.546000 Cu 0.973502 0.160563 0.75 688 63.546 1.94379e-05 -3.53991 63.546000 Cu 0.0492129 0.173904 2.75191e-16 716 63.546 2.87586e-05 -3.53994 63.546000 Cu 0.0492129 0.173904 0.5 717 63.546 2.87586e-05 -3.53994 63.546000 Cu 0.00376392 0.191014 0.25 718 63.546 2.85422e-05 -3.53995 63.546000 Cu 0.124983 0.187219 0.25 719 63.546 4.47704e-06 -3.53996 63.546000 Cu 0.00376392 0.191014 0.75 722 63.546 2.85422e-05 -3.53995 63.546000 Cu 0.124983 0.187219 0.75 729 63.546 4.47704e-06 -3.53996 63.546000 Cu 0.079558 0.20432 1 750 63.546 3.01007e-06 -3.53996 63.546000 Cu 0.079558 0.20432 0.5 751 63.546 3.01007e-06 -3.53996 63.546000 Cu 0.246208 0.183421 0.25 726 63.546 5.00959e-06 -3.53996 63.546000 Cu 0.367466 0.17961 0.25 727 63.546 9.10362e-06 -3.53995 63.546000 Cu 0.246208 0.183421 0.75 730 63.546 5.00959e-06 -3.53996 63.546000 Cu 0.367466 0.17961 0.75 736 63.546 9.10362e-06 -3.53995 63.546000 Cu 0.200774 0.200523 0 749 63.546 1.67546e-06 -3.53996 63.546000 Cu 0.322 0.196721 3.7894e-16 758 63.546 4.2682e-06 -3.53995 63.546000 Cu 0.322 0.196721 0.5 759 63.546 4.2682e-06 -3.53995 63.546000 Cu 0.200774 0.200523 0.5 762 63.546 1.67546e-06 -3.53996 63.546000 Cu 0.488729 0.175781 0.25 733 63.546 3.28484e-05 -3.53993 63.546000 Cu 0.488729 0.175781 0.75 737 63.546 3.28484e-05 -3.53993 63.546000 Cu 0.443248 0.192904 9.76264e-17 757 63.546 4.18755e-06 -3.53993 63.546000 Cu 0.564467 0.189093 2.09199e-17 765 63.546 5.76379e-06 -3.53994 63.546000 Cu 0.564467 0.189093 0.5 766 63.546 5.76379e-06 -3.53994 63.546000 Cu 0.519009 0.206208 0.25 767 63.546 5.94141e-07 -3.53994 63.546000 Cu 0.443248 0.192904 0.5 768 63.546 4.18755e-06 -3.53993 63.546000 Cu 0.519009 0.206208 0.75 770 63.546 5.94141e-07 -3.53994 63.546000 Cu 0.685695 0.185272 1.83857e-16 705 63.546 2.15829e-05 -3.53993 63.546000 Cu 0.640244 0.202396 0.25 706 63.546 1.52955e-05 -3.53993 63.546000 Cu 0.76142 0.198595 0.25 710 63.546 1.39039e-06 -3.53993 63.546000 Cu 0.685695 0.185272 0.5 712 63.546 2.15829e-05 -3.53993 63.546000 Cu 0.640244 0.202396 0.75 713 63.546 1.52955e-05 -3.53993 63.546000 Cu 0.76142 0.198595 0.75 714 63.546 1.39039e-06 -3.53993 63.546000 Cu 0.928051 0.177681 1 707 63.546 4.34778e-06 -3.53993 63.546000 Cu 0.80687 0.181469 5.83717e-16 708 63.546 6.06947e-06 -3.53992 63.546000 Cu 0.80687 0.181469 0.5 709 63.546 6.06947e-06 -3.53992 63.546000 Cu 0.88259 0.194795 0.25 711 63.546 7.34745e-06 -3.53994 63.546000 Cu 0.928051 0.177681 0.5 720 63.546 4.34778e-06 -3.53993 63.546000 Cu 0.88259 0.194795 0.75 721 63.546 7.34745e-06 -3.53994 63.546000 Cu 0.0341385 0.22143 0.25 752 63.546 8.14157e-06 -3.53995 63.546000 Cu 0.155333 0.21763 0.25 753 63.546 2.3712e-06 -3.53995 63.546000 Cu 0.0341385 0.22143 0.75 756 63.546 8.14157e-06 -3.53995 63.546000 Cu 0.155333 0.21763 0.75 763 63.546 2.3712e-06 -3.53995 63.546000 Cu 0.109887 0.234745 3.34889e-16 784 63.546 3.00948e-06 -3.53994 63.546000 Cu 0.109887 0.234745 0.5 785 63.546 3.00948e-06 -3.53994 63.546000 Cu 0.276543 0.213829 0.25 760 63.546 8.64524e-07 -3.53995 63.546000 Cu 0.397771 0.210023 0.25 761 63.546 2.21331e-06 -3.53994 63.546000 Cu 0.276543 0.213829 0.75 764 63.546 8.64524e-07 -3.53995 63.546000 Cu 0.397771 0.210023 0.75 769 63.546 2.21331e-06 -3.53994 63.546000 Cu 0.231094 0.230939 1.73653e-16 783 63.546 1.03791e-06 -3.53995 63.546000 Cu 0.35231 0.227138 1 792 63.546 4.65301e-06 -3.53994 63.546000 Cu 0.35231 0.227138 0.5 793 63.546 4.65301e-06 -3.53994 63.546000 Cu 0.231094 0.230939 0.5 796 63.546 1.03791e-06 -3.53995 63.546000 Cu 0.473557 0.223323 5.10923e-16 791 63.546 8.66102e-06 -3.53994 63.546000 Cu 0.428089 0.240438 0.25 795 63.546 1.40449e-05 -3.53994 63.546000 Cu 0.594769 0.219516 1 799 63.546 5.55985e-06 -3.53993 63.546000 Cu 0.594769 0.219516 0.5 800 63.546 5.55985e-06 -3.53993 63.546000 Cu 0.549297 0.236637 0.25 801 63.546 1.25092e-06 -3.53993 63.546000 Cu 0.473557 0.223323 0.5 802 63.546 8.66102e-06 -3.53994 63.546000 Cu 0.428089 0.240438 0.75 803 63.546 1.40449e-05 -3.53994 63.546000 Cu 0.549297 0.236637 0.75 804 63.546 1.25092e-06 -3.53993 63.546000 Cu 0.715969 0.215717 1.73482e-17 739 63.546 2.17857e-06 -3.53993 63.546000 Cu 0.670495 0.232834 0.25 740 63.546 7.96654e-07 -3.53994 63.546000 Cu 0.791709 0.229032 0.25 744 63.546 1.35671e-06 -3.53994 63.546000 Cu 0.715969 0.215717 0.5 746 63.546 2.17857e-06 -3.53993 63.546000 Cu 0.670495 0.232834 0.75 747 63.546 7.96654e-07 -3.53994 63.546000 Cu 0.791709 0.229032 0.75 748 63.546 1.35671e-06 -3.53994 63.546000 Cu 0.958336 0.208123 2.66687e-16 741 63.546 1.89274e-05 -3.53995 63.546000 Cu 0.837169 0.211915 6.32531e-16 742 63.546 3.58253e-06 -3.53994 63.546000 Cu 0.837169 0.211915 0.5 743 63.546 3.58253e-06 -3.53994 63.546000 Cu 0.91292 0.225237 0.25 745 63.546 1.06286e-05 -3.53995 63.546000 Cu 0.958336 0.208123 0.5 754 63.546 1.89274e-05 -3.53995 63.546000 Cu 0.91292 0.225237 0.75 755 63.546 1.06286e-05 -3.53995 63.546000 Cu 0.988681 0.238547 3.25365e-16 775 63.546 6.41402e-06 -3.53994 63.546000 Cu 0.988681 0.238547 0.5 788 63.546 6.41402e-06 -3.53994 63.546000 Cu 0.0643971 0.251862 0.25 786 63.546 4.38507e-06 -3.53994 63.546000 Cu 0.185635 0.248054 0.25 787 63.546 2.53954e-06 -3.53994 63.546000 Cu 0.0643971 0.251862 0.75 790 63.546 4.38507e-06 -3.53994 63.546000 Cu 0.185635 0.248054 0.75 797 63.546 2.53954e-06 -3.53994 63.546000 Cu 0.0188799 0.268975 3.5717e-18 809 63.546 2.87608e-06 -3.53994 63.546000 Cu 0.140132 0.265167 1.53413e-16 818 63.546 2.74267e-06 -3.53994 63.546000 Cu 0.140132 0.265167 0.5 819 63.546 2.74267e-06 -3.53994 63.546000 Cu 0.0188799 0.268975 0.5 822 63.546 2.87608e-06 -3.53994 63.546000 Cu 0.306845 0.24425 0.25 794 63.546 2.87821e-06 -3.53994 63.546000 Cu 0.306845 0.24425 0.75 798 63.546 2.87821e-06 -3.53994 63.546000 Cu 0.261363 0.261365 1.35044e-16 817 63.546 3.23886e-06 -3.53994 63.546000 Cu 0.382589 0.257555 1.70081e-19 826 63.546 1.07312e-05 -3.53993 63.546000 Cu 0.382589 0.257555 0.5 827 63.546 1.07312e-05 -3.53993 63.546000 Cu 0.337059 0.274676 0.25 828 63.546 5.04446e-06 -3.53992 63.546000 Cu 0.261363 0.261365 0.5 830 63.546 3.23886e-06 -3.53994 63.546000 Cu 0.337059 0.274676 0.75 832 63.546 5.04446e-06 -3.53992 63.546000 Cu 0.503798 0.253755 8.16388e-17 825 63.546 1.70627e-06 -3.53993 63.546000 Cu 0.458269 0.270872 0.25 829 63.546 2.42418e-06 -3.53992 63.546000 Cu 0.579505 0.267066 0.25 833 63.546 2.72759e-06 -3.53993 63.546000 Cu 0.503798 0.253755 0.5 834 63.546 1.70627e-06 -3.53993 63.546000 Cu 0.458269 0.270872 0.75 835 63.546 2.42418e-06 -3.53992 63.546000 Cu 0.579505 0.267066 0.75 836 63.546 2.72759e-06 -3.53993 63.546000 Cu 0.746228 0.246148 5.23339e-16 771 63.546 4.28078e-07 -3.53994 63.546000 Cu 0.625019 0.249951 2.43726e-16 772 63.546 1.46595e-06 -3.53994 63.546000 Cu 0.625019 0.249951 0.5 773 63.546 1.46595e-06 -3.53994 63.546000 Cu 0.700734 0.263265 0.25 774 63.546 2.1129e-06 -3.53993 63.546000 Cu 0.746228 0.246148 0.5 780 63.546 4.28078e-07 -3.53994 63.546000 Cu 0.700734 0.263265 0.75 781 63.546 2.1129e-06 -3.53993 63.546000 Cu 0.86744 0.242348 1.96954e-16 776 63.546 1.19413e-06 -3.53994 63.546000 Cu 0.86744 0.242348 0.5 777 63.546 1.19413e-06 -3.53994 63.546000 Cu 0.821949 0.259463 0.25 778 63.546 5.74808e-07 -3.53994 63.546000 Cu 0.943162 0.255661 0.25 779 63.546 5.9215e-07 -3.53993 63.546000 Cu 0.821949 0.259463 0.75 782 63.546 5.74808e-07 -3.53994 63.546000 Cu 0.943162 0.255661 0.75 789 63.546 5.9215e-07 -3.53993 63.546000 Cu 0.897655 0.272779 4.66872e-16 810 63.546 1.73844e-06 -3.53993 63.546000 Cu 0.897655 0.272779 0.5 811 63.546 1.73844e-06 -3.53993 63.546000 Cu 0.094619 0.282281 0.25 820 63.546 9.73052e-06 -3.53993 63.546000 Cu 0.094619 0.282281 0.75 824 63.546 9.73052e-06 -3.53993 63.546000 Cu 0.0490837 0.299399 2.48488e-16 843 63.546 2.50637e-05 -3.53992 63.546000 Cu 0.170292 0.2956 2.34712e-16 852 63.546 1.85072e-05 -3.53991 63.546000 Cu 0.170292 0.2956 0.5 853 63.546 1.85072e-05 -3.53991 63.546000 Cu 0.0490837 0.299399 0.5 856 63.546 2.50637e-05 -3.53992 63.546000 Cu 0.215838 0.278479 0.25 821 63.546 6.75098e-06 -3.53993 63.546000 Cu 0.215838 0.278479 0.75 831 63.546 6.75098e-06 -3.53993 63.546000 Cu 0.291484 0.2918 2.71619e-16 851 63.546 6.045e-06 -3.5399 63.546000 Cu 0.245867 0.308933 0.25 855 63.546 1.33636e-05 -3.53986 63.546000 Cu 0.36709 0.305122 0.25 862 63.546 8.0375e-06 -3.53988 63.546000 Cu 0.291484 0.2918 0.5 864 63.546 6.045e-06 -3.5399 63.546000 Cu 0.245867 0.308933 0.75 865 63.546 1.33636e-05 -3.53986 63.546000 Cu 0.36709 0.305122 0.75 866 63.546 8.0375e-06 -3.53988 63.546000 Cu 0.53395 0.284184 4.60239e-16 859 63.546 4.63997e-06 -3.53991 63.546000 Cu 0.412712 0.287994 4.44421e-16 860 63.546 4.77022e-06 -3.53991 63.546000 Cu 0.412712 0.287994 0.5 861 63.546 4.77022e-06 -3.53991 63.546000 Cu 0.488357 0.301311 0.25 863 63.546 8.06274e-06 -3.53989 63.546000 Cu 0.53395 0.284184 0.5 868 63.546 4.63997e-06 -3.53991 63.546000 Cu 0.488357 0.301311 0.75 869 63.546 8.06274e-06 -3.53989 63.546000 Cu 0.776438 0.276578 3.3625e-16 805 63.546 3.07982e-06 -3.53993 63.546000 Cu 0.655193 0.28038 3.73838e-16 806 63.546 2.13471e-06 -3.53993 63.546000 Cu 0.655193 0.28038 0.5 807 63.546 2.13471e-06 -3.53993 63.546000 Cu 0.730879 0.293692 0.25 808 63.546 4.22677e-06 -3.53992 63.546000 Cu 0.776438 0.276578 0.5 814 63.546 3.07982e-06 -3.53993 63.546000 Cu 0.730879 0.293692 0.75 815 63.546 4.22677e-06 -3.53992 63.546000 Cu 0.609613 0.297501 0.25 867 63.546 3.74098e-06 -3.53991 63.546000 Cu 0.609613 0.297501 0.75 870 63.546 3.74098e-06 -3.53991 63.546000 Cu 0.852129 0.289895 0.25 812 63.546 6.22641e-06 -3.53993 63.546000 Cu 0.973376 0.28609 0.25 813 63.546 1.61742e-06 -3.53994 63.546000 Cu 0.852129 0.289895 0.75 816 63.546 6.22641e-06 -3.53993 63.546000 Cu 0.973376 0.28609 0.75 823 63.546 1.61742e-06 -3.53994 63.546000 Cu 0.806552 0.307008 7.92577e-17 837 63.546 5.77014e-06 -3.53993 63.546000 Cu 0.927838 0.303202 1.98825e-16 844 63.546 8.19375e-06 -3.53994 63.546000 Cu 0.927838 0.303202 0.5 845 63.546 8.19375e-06 -3.53994 63.546000 Cu 0.806552 0.307008 0.5 848 63.546 5.77014e-06 -3.53993 63.546000 Cu 0.00349383 0.316519 0.25 847 63.546 3.70099e-05 -3.53991 63.546000 Cu 0.124684 0.312728 0.25 854 63.546 2.24278e-05 -3.53988 63.546000 Cu 0.00349383 0.316519 0.75 857 63.546 3.70099e-05 -3.53991 63.546000 Cu 0.124684 0.312728 0.75 858 63.546 2.24278e-05 -3.53988 63.546000 Cu 0.0790319 0.329865 4.74526e-17 877 63.546 2.3394e-05 -3.53985 63.546000 Cu 0.15447 0.343226 0.25 888 63.546 9.24192e-05 -3.53981 63.546000 Cu 0.0790319 0.329865 0.5 890 63.546 2.3394e-05 -3.53985 63.546000 Cu 0.15447 0.343226 0.75 892 63.546 9.24192e-05 -3.53981 63.546000 Cu 0.321406 0.322259 1.30112e-16 885 63.546 5.90833e-06 -3.53984 63.546000 Cu 0.200183 0.326075 1.70081e-19 886 63.546 2.36011e-05 -3.53983 63.546000 Cu 0.200183 0.326075 0.5 887 63.546 2.36011e-05 -3.53983 63.546000 Cu 0.275704 0.339405 0.25 889 63.546 9.1937e-06 -3.53983 63.546000 Cu 0.396945 0.335575 0.25 896 63.546 1.15595e-05 -3.53983 63.546000 Cu 0.321406 0.322259 0.5 898 63.546 5.90833e-06 -3.53984 63.546000 Cu 0.275704 0.339405 0.75 899 63.546 9.1937e-06 -3.53983 63.546000 Cu 0.396945 0.335575 0.75 900 63.546 1.15595e-05 -3.53983 63.546000 Cu 0.563985 0.314626 1.24839e-16 893 63.546 1.38833e-05 -3.53989 63.546000 Cu 0.442669 0.318439 9.28641e-17 894 63.546 7.5687e-06 -3.53986 63.546000 Cu 0.442669 0.318439 0.5 895 63.546 7.5687e-06 -3.53986 63.546000 Cu 0.518248 0.331746 0.25 897 63.546 1.02293e-05 -3.53986 63.546000 Cu 0.563985 0.314626 0.5 901 63.546 1.38833e-05 -3.53989 63.546000 Cu 0.518248 0.331746 0.75 902 63.546 1.02293e-05 -3.53986 63.546000 Cu 0.685286 0.310811 1.91171e-16 838 63.546 7.89204e-06 -3.53991 63.546000 Cu 0.685286 0.310811 0.5 839 63.546 7.89204e-06 -3.53991 63.546000 Cu 0.639614 0.32793 0.25 840 63.546 1.12421e-05 -3.53989 63.546000 Cu 0.760941 0.324122 0.25 841 63.546 1.25905e-05 -3.53992 63.546000 Cu 0.639614 0.32793 0.75 842 63.546 1.12421e-05 -3.53989 63.546000 Cu 0.760941 0.324122 0.75 849 63.546 1.25905e-05 -3.53992 63.546000 Cu 0.715242 0.34123 1.82327e-16 872 63.546 6.88765e-06 -3.53991 63.546000 Cu 0.715242 0.34123 0.5 873 63.546 6.88765e-06 -3.53991 63.546000 Cu 0.882254 0.320312 0.25 846 63.546 3.94863e-05 -3.53993 63.546000 Cu 0.882254 0.320312 0.75 850 63.546 3.94863e-05 -3.53993 63.546000 Cu 0.836617 0.337421 5.37456e-17 871 63.546 0.000127635 -3.53992 63.546000 Cu 0.957853 0.333644 1 878 63.546 5.13714e-05 -3.53989 63.546000 Cu 0.957853 0.333644 0.5 879 63.546 5.13714e-05 -3.53989 63.546000 Cu 0.836617 0.337421 0.5 882 63.546 0.000127635 -3.53992 63.546000 Cu 0.0332938 0.347003 0.25 881 63.546 3.20784e-05 -3.53982 63.546000 Cu 0.0332938 0.347003 0.75 891 63.546 3.20784e-05 -3.53982 63.546000 Cu 0.108604 0.360366 1.41677e-16 911 63.546 0.000118715 -3.53976 63.546000 Cu 0.0626306 0.377512 0.25 915 63.546 0.000298821 -3.53971 63.546000 Cu 0.183976 0.373678 0.25 922 63.546 2.12782e-05 -3.53973 63.546000 Cu 0.108604 0.360366 0.5 924 63.546 0.000118715 -3.53976 63.546000 Cu 0.0626306 0.377512 0.75 925 63.546 0.000298821 -3.53971 63.546000 Cu 0.183976 0.373678 0.75 926 63.546 2.12782e-05 -3.53973 63.546000 Cu 0.351246 0.352723 1.70081e-19 919 63.546 4.72609e-05 -3.53981 63.546000 Cu 0.229944 0.356548 3.64143e-16 920 63.546 4.93754e-05 -3.5398 63.546000 Cu 0.229944 0.356548 0.5 921 63.546 4.93754e-05 -3.5398 63.546000 Cu 0.30537 0.369858 0.25 923 63.546 6.03345e-05 -3.53976 63.546000 Cu 0.351246 0.352723 0.5 932 63.546 4.72609e-05 -3.53981 63.546000 Cu 0.30537 0.369858 0.75 933 63.546 6.03345e-05 -3.53976 63.546000 Cu 0.593844 0.345044 3.05125e-16 927 63.546 1.74506e-05 -3.53987 63.546000 Cu 0.593844 0.345044 0.5 935 63.546 1.74506e-05 -3.53987 63.546000 Cu 0.472516 0.348878 2.55291e-16 928 63.546 1.03172e-05 -3.53983 63.546000 Cu 0.472516 0.348878 0.5 929 63.546 1.03172e-05 -3.53983 63.546000 Cu 0.426771 0.366022 0.25 930 63.546 0.000108523 -3.53978 63.546000 Cu 0.548092 0.36217 0.25 931 63.546 4.89722e-05 -3.53982 63.546000 Cu 0.426771 0.366022 0.75 934 63.546 0.000108523 -3.53978 63.546000 Cu 0.548092 0.36217 0.75 936 63.546 4.89722e-05 -3.53982 63.546000 Cu 0.50223 0.379297 2.69238e-16 961 63.546 0.000162956 -3.53973 63.546000 Cu 0.50223 0.379297 0.5 962 63.546 0.000162956 -3.53973 63.546000 Cu 0.669477 0.35833 0.25 874 63.546 2.58235e-05 -3.53991 63.546000 Cu 0.790872 0.354525 0.25 875 63.546 0.000232959 -3.53991 63.546000 Cu 0.669477 0.35833 0.75 876 63.546 2.58235e-05 -3.53991 63.546000 Cu 0.790872 0.354525 0.75 883 63.546 0.000232959 -3.53991 63.546000 Cu 0.623691 0.375427 0 903 63.546 0.00018135 -3.53987 63.546000 Cu 0.745043 0.37163 1.13954e-17 905 63.546 0.000368783 -3.5399 63.546000 Cu 0.745043 0.37163 0.5 906 63.546 0.000368783 -3.5399 63.546000 Cu 0.623691 0.375427 0.5 909 63.546 0.00018135 -3.53987 63.546000 Cu 0.912115 0.350768 0.25 880 63.546 7.62723e-05 -3.53988 63.546000 Cu 0.912115 0.350768 0.75 884 63.546 7.62723e-05 -3.53988 63.546000 Cu 0.866228 0.367885 3.40162e-19 904 63.546 8.90489e-05 -3.53984 63.546000 Cu 0.987425 0.364144 2.42365e-16 912 63.546 8.03223e-05 -3.53979 63.546000 Cu 0.987425 0.364144 0.5 913 63.546 8.03223e-05 -3.53979 63.546000 Cu 0.866228 0.367885 0.5 916 63.546 8.90489e-05 -3.53984 63.546000 Cu 0.137901 0.390817 1.94572e-16 945 63.546 0.000254345 -3.53967 63.546000 Cu 0.0163293 0.394634 5.93582e-17 946 63.546 0.000372375 -3.53954 63.546000 Cu 0.0163293 0.394634 0.5 947 63.546 0.000372375 -3.53954 63.546000 Cu 0.0914176 0.407907 0.25 949 63.546 0.00017722 -3.53957 63.546000 Cu 0.137901 0.390817 0.5 958 63.546 0.000254345 -3.53967 63.546000 Cu 0.0914176 0.407907 0.75 959 63.546 0.00017722 -3.53957 63.546000 Cu 0.380743 0.383143 2.83695e-16 953 63.546 2.28392e-05 -3.53971 63.546000 Cu 0.259308 0.386979 1.64978e-17 954 63.546 1.22275e-05 -3.53975 63.546000 Cu 0.259308 0.386979 0.5 955 63.546 1.22275e-05 -3.53975 63.546000 Cu 0.213191 0.404092 0.25 956 63.546 0.00023756 -3.53973 63.546000 Cu 0.334647 0.400264 0.25 957 63.546 6.38599e-05 -3.5397 63.546000 Cu 0.213191 0.404092 0.75 960 63.546 0.00023756 -3.53973 63.546000 Cu 0.380743 0.383143 0.5 965 63.546 2.28392e-05 -3.53971 63.546000 Cu 0.334647 0.400264 0.75 966 63.546 6.38599e-05 -3.5397 63.546000 Cu 0.456158 0.396405 0.25 963 63.546 0.000335798 -3.53969 63.546000 Cu 0.577793 0.392513 0.25 964 63.546 0.000511954 -3.53984 63.546000 Cu 0.456158 0.396405 0.75 967 63.546 0.000335798 -3.53969 63.546000 Cu 0.577793 0.392513 0.75 968 63.546 0.000511954 -3.53984 63.546000 Cu 0.410123 0.413514 3.06146e-17 987 63.546 0.00103972 -3.53956 63.546000 Cu 0.531935 0.409581 2.93219e-16 995 63.546 0.00141053 -3.53985 63.546000 Cu 0.531935 0.409581 0.5 996 63.546 0.00141053 -3.53985 63.546000 Cu 0.410123 0.413514 0.5 999 63.546 0.00103972 -3.53956 63.546000 Cu 0.69905 0.38872 0.25 907 63.546 0.000538871 -3.53985 63.546000 Cu 0.69905 0.38872 0.75 910 63.546 0.000538871 -3.53985 63.546000 Cu 0.653111 0.405824 1.70421e-16 937 63.546 0.000674883 -3.53986 63.546000 Cu 0.773965 0.402114 2.43726e-16 939 63.546 0.000368396 -3.53971 63.546000 Cu 0.773965 0.402114 0.5 940 63.546 0.000368396 -3.53971 63.546000 Cu 0.653111 0.405824 0.5 943 63.546 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63.546000 Cu 0.218847 0.481706 1.23139e-16 1042 63.546 0.527295 -3.48135 63.546000 Cu 0.347542 0.476805 2.87437e-16 1048 63.546 0.106175 -3.52229 63.546000 Cu 0.471721 0.473712 0.5 13 63.546 0.0397307 -3.53406 63.546000 Cu 0.592584 0.470882 0.5 15 63.546 0.054299 -3.52756 63.546000 Cu 0.592584 0.470882 1.29602e-16 26 63.546 0.054299 -3.52756 63.546000 Cu 0.517187 0.456964 0.25 1031 63.546 0.0152836 -3.53671 63.546000 Cu 0.517187 0.456964 0.75 1034 63.546 0.0152836 -3.53671 63.546000 Cu 0.471721 0.473712 1.12253e-16 1047 63.546 0.0397307 -3.53406 63.546000 Cu 0.636756 0.453519 0.25 970 63.546 0.0101471 -3.53822 63.546000 Cu 0.756626 0.450131 0.25 974 63.546 0.00298747 -3.53769 63.546000 Cu 0.636756 0.453519 0.75 977 63.546 0.0101471 -3.53822 63.546000 Cu 0.756626 0.450131 0.75 978 63.546 0.00298747 -3.53769 63.546000 Cu 0.70977 0.467452 1 1003 63.546 0.0438383 -3.52648 63.546000 Cu 0.780977 0.481206 0.25 1008 63.546 0.430624 -3.48329 63.546000 Cu 0.70977 0.467452 0.5 1010 63.546 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-3.33896 63.546000 Cu 0.369596 0.505506 4.11936e-16 10 63.546 5.68693 -3.47746 63.546000 Cu 0.369596 0.505506 0.5 11 63.546 5.68693 -3.47746 63.546000 Cu 0.297299 0.492621 0.75 520 63.546 4.69513 -3.449 63.546000 Cu 0.297299 0.492621 0.25 529 63.546 4.69513 -3.449 63.546000 Cu 0.546593 0.487647 0.75 3 63.546 0.133678 -3.52369 63.546000 Cu 0.422622 0.489886 0.75 7 63.546 0.0393163 -3.53075 63.546000 Cu 0.4953 0.503521 9.23539e-17 9 63.546 0.34406 -3.52649 63.546000 Cu 0.546593 0.487647 0.25 14 63.546 0.133678 -3.52369 63.546000 Cu 0.4953 0.503521 0.5 18 63.546 0.34406 -3.52649 63.546000 Cu 0.422622 0.489886 0.25 528 63.546 0.0393163 -3.53075 63.546000 Cu 0.665789 0.485783 0.25 1004 63.546 0.157757 -3.50705 63.546000 Cu 0.665789 0.485783 0.75 1011 63.546 0.157757 -3.50705 63.546000 Cu 0.740172 0.500762 1.72632e-16 1035 63.546 4.83271 -3.31348 63.546000 Cu 0.61728 0.503067 2.5308e-16 1036 63.546 0.410862 -3.51046 63.546000 Cu 0.61728 0.503067 0.5 1037 63.546 0.410862 -3.51046 63.546000 Cu 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3.08697e-16 29 63.546 9.24546 -3.39796 63.546000 Cu 0.348789 0.52868 1.59026e-16 37 63.546 5.02212 -3.518 63.546000 Cu 0.348789 0.52868 0.5 38 63.546 5.02212 -3.518 63.546000 Cu 0.2769 0.543379 0.25 39 63.546 0.252304 -3.51767 63.546000 Cu 0.226477 0.527855 0.5 40 63.546 9.24546 -3.39796 63.546000 Cu 0.2769 0.543379 0.75 42 63.546 0.252304 -3.51767 63.546000 Cu 0.397372 0.546037 0.25 44 63.546 0.23147 -3.52941 63.546000 Cu 0.397372 0.546037 0.75 51 63.546 0.23147 -3.52941 63.546000 Cu 0.436009 0.518465 0.25 12 63.546 5.64124 -3.46622 63.546000 Cu 0.436009 0.518465 0.75 19 63.546 5.64124 -3.46622 63.546000 Cu 0.555566 0.519005 0.25 16 63.546 0.522568 -3.51506 63.546000 Cu 0.555566 0.519005 0.75 20 63.546 0.522568 -3.51506 63.546000 Cu 0.479003 0.534195 7.09237e-17 43 63.546 0.6006 -3.47792 63.546000 Cu 0.598375 0.535841 2.48828e-16 46 63.546 0.191553 -3.47843 63.546000 Cu 0.598375 0.535841 0.5 47 63.546 0.191553 -3.47843 63.546000 Cu 0.521889 0.550595 0.25 48 63.546 0.185065 -3.51509 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0.5 66 63.546 0.222472 -3.52053 63.546000 Cu 0.198438 0.556079 1.36065e-16 61 63.546 0.031287 -3.53859 63.546000 Cu 0.0761075 0.552694 4.07174e-16 62 63.546 0.162758 -3.53483 63.546000 Cu 0.0761075 0.552694 0.5 63 63.546 0.162758 -3.53483 63.546000 Cu 0.122259 0.569423 0.25 65 63.546 0.0159478 -3.538 63.546000 Cu 0.198438 0.556079 0.5 73 63.546 0.031287 -3.53859 63.546000 Cu 0.122259 0.569423 0.75 74 63.546 0.0159478 -3.538 63.546000 Cu 0.044912 0.582322 3.91866e-16 94 63.546 0.0110463 -3.53914 63.546000 Cu 0.044912 0.582322 0.5 95 63.546 0.0110463 -3.53914 63.546000 Cu 0.321846 0.560066 2.16003e-16 69 63.546 0.0448986 -3.53428 63.546000 Cu 0.321846 0.560066 0.5 70 63.546 0.0448986 -3.53428 63.546000 Cu 0.244067 0.573104 0.25 71 63.546 0.00420451 -3.53956 63.546000 Cu 0.365918 0.576983 0.25 72 63.546 0.0101955 -3.53741 63.546000 Cu 0.244067 0.573104 0.75 75 63.546 0.00420451 -3.53956 63.546000 Cu 0.365918 0.576983 0.75 76 63.546 0.0101955 -3.53741 63.546000 Cu 0.442449 0.563292 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63.546 0.00600722 -3.53813 63.546000 Cu 0.880565 0.561146 0.25 57 63.546 0.0177842 -3.53617 63.546000 Cu 0.998908 0.565118 0.25 64 63.546 0.0724442 -3.53173 63.546000 Cu 0.880565 0.561146 0.75 67 63.546 0.0177842 -3.53617 63.546000 Cu 0.998908 0.565118 0.75 68 63.546 0.0724442 -3.53173 63.546000 Cu 0.923972 0.578563 1.54093e-16 85 63.546 0.00749786 -3.53949 63.546000 Cu 0.923972 0.578563 0.5 98 63.546 0.00749786 -3.53949 63.546000 Cu 0.167201 0.586396 2.42195e-16 93 63.546 0.00285695 -3.5393 63.546000 Cu 0.0901578 0.599497 0.25 97 63.546 0.00295849 -3.53971 63.546000 Cu 0.167201 0.586396 0.5 105 63.546 0.00285695 -3.5393 63.546000 Cu 0.0901578 0.599497 0.75 106 63.546 0.00295849 -3.53971 63.546000 Cu 0.134948 0.61666 1.38276e-16 125 63.546 0.000950872 -3.53981 63.546000 Cu 0.0138919 0.61285 2.44916e-16 126 63.546 2.42269e-05 -3.53974 63.546000 Cu 0.0138919 0.61285 0.5 127 63.546 2.42269e-05 -3.53974 63.546000 Cu 0.134948 0.61666 0.5 137 63.546 0.000950872 -3.53981 63.546000 Cu 0.288585 0.590189 1.59876e-16 101 63.546 0.000667143 -3.53963 63.546000 Cu 0.288585 0.590189 0.5 102 63.546 0.000667143 -3.53963 63.546000 Cu 0.211741 0.603465 0.25 103 63.546 0.000481986 -3.53969 63.546000 Cu 0.332857 0.607328 0.25 104 63.546 0.00017446 -3.53985 63.546000 Cu 0.211741 0.603465 0.75 107 63.546 0.000481986 -3.53969 63.546000 Cu 0.332857 0.607328 0.75 108 63.546 0.00017446 -3.53985 63.546000 Cu 0.256271 0.620578 5.90181e-17 133 63.546 7.82059e-05 -3.53987 63.546000 Cu 0.256271 0.620578 0.5 134 63.546 7.82059e-05 -3.53987 63.546000 Cu 0.409617 0.594086 4.11256e-16 109 63.546 0.0025936 -3.53937 63.546000 Cu 0.530523 0.597759 3.13629e-16 111 63.546 0.00246938 -3.53961 63.546000 Cu 0.530523 0.597759 0.5 112 63.546 0.00246938 -3.53961 63.546000 Cu 0.454072 0.61116 0.25 113 63.546 0.000612317 -3.53957 63.546000 Cu 0.574929 0.614906 0.25 114 63.546 0.000613537 -3.5397 63.546000 Cu 0.409617 0.594086 0.5 115 63.546 0.0025936 -3.53937 63.546000 Cu 0.454072 0.61116 0.75 116 63.546 0.000612317 -3.53957 63.546000 Cu 0.574929 0.614906 0.75 123 63.546 0.000613537 -3.5397 63.546000 Cu 0.728038 0.588106 0.25 88 63.546 0.00106829 -3.53847 63.546000 Cu 0.728038 0.588106 0.75 92 63.546 0.00106829 -3.53847 63.546000 Cu 0.651718 0.601637 3.39822e-16 110 63.546 0.00295271 -3.53905 63.546000 Cu 0.772164 0.605333 2.3216e-16 118 63.546 0.000532161 -3.53941 63.546000 Cu 0.772164 0.605333 0.5 119 63.546 0.000532161 -3.53941 63.546000 Cu 0.695929 0.618763 0.25 120 63.546 0.00106298 -3.53961 63.546000 Cu 0.651718 0.601637 0.5 122 63.546 0.00295271 -3.53905 63.546000 Cu 0.695929 0.618763 0.75 124 63.546 0.00106298 -3.53961 63.546000 Cu 0.8481 0.591861 0.25 89 63.546 0.0025838 -3.53926 63.546000 Cu 0.969016 0.595709 0.25 96 63.546 0.000188978 -3.53981 63.546000 Cu 0.8481 0.591861 0.75 99 63.546 0.0025838 -3.53926 63.546000 Cu 0.969016 0.595709 0.75 100 63.546 0.000188978 -3.53981 63.546000 Cu 0.892874 0.609056 1.70081e-19 117 63.546 0.000287644 -3.53966 63.546000 Cu 0.892874 0.609056 0.5 130 63.546 0.000287644 -3.53966 63.546000 Cu 0.0586318 0.629998 0.25 129 63.546 5.0003e-05 -3.53978 63.546000 Cu 0.179712 0.63382 0.25 135 63.546 0.000386475 -3.53984 63.546000 Cu 0.0586318 0.629998 0.75 138 63.546 5.0003e-05 -3.53978 63.546000 Cu 0.179712 0.63382 0.75 139 63.546 0.000386475 -3.53984 63.546000 Cu 0.103461 0.647152 1 157 63.546 8.66757e-05 -3.5398 63.546000 Cu 0.103461 0.647152 0.5 170 63.546 8.66757e-05 -3.5398 63.546000 Cu 0.300938 0.637712 0.25 136 63.546 5.58383e-05 -3.53986 63.546000 Cu 0.300938 0.637712 0.75 140 63.546 5.58383e-05 -3.53986 63.546000 Cu 0.377487 0.624441 1.17866e-16 141 63.546 3.79378e-05 -3.53983 63.546000 Cu 0.377487 0.624441 0.5 147 63.546 3.79378e-05 -3.53983 63.546000 Cu 0.224543 0.650991 1.88109e-16 166 63.546 0.000171709 -3.53984 63.546000 Cu 0.224543 0.650991 0.5 167 63.546 0.000171709 -3.53984 63.546000 Cu 0.345753 0.654857 2.08519e-16 165 63.546 5.6556e-05 -3.53987 63.546000 Cu 0.345753 0.654857 0.5 173 63.546 5.6556e-05 -3.53987 63.546000 Cu 0.498565 0.628273 5.8848e-17 143 63.546 0.000217803 -3.53973 63.546000 Cu 0.498565 0.628273 0.5 144 63.546 0.000217803 -3.53973 63.546000 Cu 0.422149 0.641575 0.25 145 63.546 4.42686e-05 -3.53986 63.546000 Cu 0.543224 0.645406 0.25 146 63.546 0.000156676 -3.53982 63.546000 Cu 0.422149 0.641575 0.75 148 63.546 4.42686e-05 -3.53986 63.546000 Cu 0.543224 0.645406 0.75 155 63.546 0.000156676 -3.53982 63.546000 Cu 0.619433 0.63205 2.76381e-16 142 63.546 0.000307425 -3.5398 63.546000 Cu 0.740498 0.63587 1.70081e-19 150 63.546 0.000369202 -3.53973 63.546000 Cu 0.740498 0.63587 0.5 151 63.546 0.000369202 -3.53973 63.546000 Cu 0.664206 0.649186 0.25 152 63.546 0.000149354 -3.53984 63.546000 Cu 0.785344 0.652974 0.25 153 63.546 8.88417e-05 -3.53983 63.546000 Cu 0.619433 0.63205 0.5 154 63.546 0.000307425 -3.5398 63.546000 Cu 0.664206 0.649186 0.75 156 63.546 0.000149354 -3.53984 63.546000 Cu 0.785344 0.652974 0.75 163 63.546 8.88417e-05 -3.53983 63.546000 Cu 0.816712 0.622472 0.25 121 63.546 6.07002e-05 -3.5396 63.546000 Cu 0.937605 0.62621 0.25 128 63.546 9.32793e-05 -3.53971 63.546000 Cu 0.816712 0.622472 0.75 131 63.546 6.07002e-05 -3.5396 63.546000 Cu 0.937605 0.62621 0.75 132 63.546 9.32793e-05 -3.53971 63.546000 Cu 0.861444 0.639601 1 149 63.546 6.75125e-05 -3.53974 63.546000 Cu 0.982447 0.643354 1.70081e-19 158 63.546 6.91264e-05 -3.53978 63.546000 Cu 0.982447 0.643354 0.5 159 63.546 6.91264e-05 -3.53978 63.546000 Cu 0.861444 0.639601 0.5 162 63.546 6.75125e-05 -3.53974 63.546000 Cu 0.0273808 0.66051 0.25 161 63.546 5.24183e-05 -3.5398 63.546000 Cu 0.148417 0.664319 0.25 168 63.546 7.77633e-05 -3.53983 63.546000 Cu 0.0273808 0.66051 0.75 171 63.546 5.24183e-05 -3.5398 63.546000 Cu 0.148417 0.664319 0.75 172 63.546 7.77633e-05 -3.53983 63.546000 Cu 0.0724609 0.677671 3.08697e-16 189 63.546 3.36267e-05 -3.53984 63.546000 Cu 0.19354 0.681486 2.67197e-16 198 63.546 4.01285e-05 -3.53986 63.546000 Cu 0.19354 0.681486 0.5 199 63.546 4.01285e-05 -3.53986 63.546000 Cu 0.0724609 0.677671 0.5 202 63.546 3.36267e-05 -3.53984 63.546000 Cu 0.269537 0.668156 0.25 169 63.546 9.02441e-05 -3.53985 63.546000 Cu 0.269537 0.668156 0.75 174 63.546 9.02441e-05 -3.53985 63.546000 Cu 0.39071 0.672011 0.25 178 63.546 0.000103363 -3.53989 63.546000 Cu 0.39071 0.672011 0.75 180 63.546 0.000103363 -3.53989 63.546000 Cu 0.314669 0.685318 1.75183e-16 197 63.546 8.37801e-05 -3.53989 63.546000 Cu 0.314669 0.685318 0.5 206 63.546 8.37801e-05 -3.53989 63.546000 Cu 0.588112 0.662536 2.88287e-16 175 63.546 0.000146632 -3.53988 63.546000 Cu 0.466926 0.658713 3.39992e-16 176 63.546 8.51386e-05 -3.53988 63.546000 Cu 0.466926 0.658713 0.5 177 63.546 8.51386e-05 -3.53988 63.546000 Cu 0.511965 0.675841 0.25 179 63.546 4.71225e-05 -3.53992 63.546000 Cu 0.588112 0.662536 0.5 186 63.546 0.000146632 -3.53988 63.546000 Cu 0.511965 0.675841 0.75 187 63.546 4.71225e-05 -3.53992 63.546000 Cu 0.435911 0.689143 1.17866e-16 210 63.546 3.33765e-05 -3.53992 63.546000 Cu 0.435911 0.689143 0.5 211 63.546 3.33765e-05 -3.53992 63.546000 Cu 0.709268 0.666312 2.37603e-16 182 63.546 1.07545e-05 -3.53988 63.546000 Cu 0.709268 0.666312 0.5 183 63.546 1.07545e-05 -3.53988 63.546000 Cu 0.633242 0.67965 0.25 184 63.546 3.49741e-05 -3.53991 63.546000 Cu 0.754418 0.683444 0.25 185 63.546 2.41507e-05 -3.53988 63.546000 Cu 0.633242 0.67965 0.75 188 63.546 3.49741e-05 -3.53991 63.546000 Cu 0.754418 0.683444 0.75 195 63.546 2.41507e-05 -3.53988 63.546000 Cu 0.90641 0.656732 0.25 160 63.546 3.06145e-05 -3.53981 63.546000 Cu 0.90641 0.656732 0.75 164 63.546 3.06145e-05 -3.53981 63.546000 Cu 0.830393 0.670091 2.15492e-16 181 63.546 2.32273e-05 -3.53986 63.546000 Cu 0.951431 0.673881 4.57858e-16 190 63.546 3.04426e-05 -3.53984 63.546000 Cu 0.951431 0.673881 0.5 191 63.546 3.04426e-05 -3.53984 63.546000 Cu 0.875501 0.687231 0.25 192 63.546 1.55316e-05 -3.53988 63.546000 Cu 0.830393 0.670091 0.5 194 63.546 2.32273e-05 -3.53986 63.546000 Cu 0.875501 0.687231 0.75 196 63.546 1.55316e-05 -3.53988 63.546000 Cu 0.117669 0.694824 0.25 200 63.546 2.63478e-05 -3.53989 63.546000 Cu 0.117669 0.694824 0.75 204 63.546 2.63478e-05 -3.53989 63.546000 Cu 0.0418616 0.708167 2.92539e-16 221 63.546 2.22216e-05 -3.53992 63.546000 Cu 0.162983 0.711961 1.99505e-16 230 63.546 2.07585e-05 -3.53992 63.546000 Cu 0.162983 0.711961 0.5 231 63.546 2.07585e-05 -3.53992 63.546000 Cu 0.0418616 0.708167 0.5 234 63.546 2.22216e-05 -3.53992 63.546000 Cu 0.238788 0.698637 0.25 201 63.546 3.9283e-05 -3.53991 63.546000 Cu 0.359987 0.702452 0.25 205 63.546 1.91644e-05 -3.53993 63.546000 Cu 0.238788 0.698637 0.75 207 63.546 3.9283e-05 -3.53991 63.546000 Cu 0.359987 0.702452 0.75 208 63.546 1.91644e-05 -3.53993 63.546000 Cu 0.284161 0.715764 3.07166e-16 229 63.546 1.01321e-05 -3.53993 63.546000 Cu 0.284161 0.715764 0.5 238 63.546 1.01321e-05 -3.53993 63.546000 Cu 0.557195 0.69296 2.76381e-16 209 63.546 1.01361e-05 -3.53993 63.546000 Cu 0.481226 0.706262 0.25 212 63.546 1.70648e-05 -3.53994 63.546000 Cu 0.557195 0.69296 0.5 218 63.546 1.01361e-05 -3.53993 63.546000 Cu 0.481226 0.706262 0.75 219 63.546 1.70648e-05 -3.53994 63.546000 Cu 0.526579 0.723383 1 241 63.546 1.49379e-05 -3.53994 63.546000 Cu 0.405377 0.719572 1 242 63.546 5.2361e-06 -3.53993 63.546000 Cu 0.405377 0.719572 0.5 243 63.546 5.2361e-06 -3.53993 63.546000 Cu 0.526579 0.723383 0.5 250 63.546 1.49379e-05 -3.53994 63.546000 Cu 0.799606 0.700577 1.61237e-16 213 63.546 4.53154e-05 -3.53991 63.546000 Cu 0.678426 0.696771 3.26215e-16 214 63.546 1.40268e-05 -3.53992 63.546000 Cu 0.678426 0.696771 0.5 215 63.546 1.40268e-05 -3.53992 63.546000 Cu 0.602468 0.710081 0.25 216 63.546 1.0304e-05 -3.53994 63.546000 Cu 0.723679 0.713892 0.25 217 63.546 1.25295e-05 -3.53994 63.546000 Cu 0.602468 0.710081 0.75 220 63.546 1.0304e-05 -3.53994 63.546000 Cu 0.799606 0.700577 0.5 226 63.546 4.53154e-05 -3.53991 63.546000 Cu 0.723679 0.713892 0.75 227 63.546 1.25295e-05 -3.53994 63.546000 Cu 0.996595 0.691029 0.25 193 63.546 2.51904e-05 -3.53988 63.546000 Cu 0.996595 0.691029 0.75 203 63.546 2.51904e-05 -3.53988 63.546000 Cu 0.920725 0.704365 2.14812e-16 222 63.546 1.21588e-05 -3.53991 63.546000 Cu 0.920725 0.704365 0.5 223 63.546 1.21588e-05 -3.53991 63.546000 Cu 0.844883 0.717699 0.25 224 63.546 2.64241e-05 -3.53994 63.546000 Cu 0.966039 0.721492 0.25 225 63.546 1.08285e-05 -3.53993 63.546000 Cu 0.844883 0.717699 0.75 228 63.546 2.64241e-05 -3.53994 63.546000 Cu 0.966039 0.721492 0.75 235 63.546 1.08285e-05 -3.53993 63.546000 Cu 0.087215 0.725289 0.25 232 63.546 1.15914e-05 -3.53994 63.546000 Cu 0.087215 0.725289 0.75 236 63.546 1.15914e-05 -3.53994 63.546000 Cu 0.0114462 0.73861 2.00695e-17 253 63.546 5.16986e-06 -3.53994 63.546000 Cu 0.132659 0.7424 1.86579e-16 262 63.546 4.1928e-06 -3.53994 63.546000 Cu 0.132659 0.7424 0.5 263 63.546 4.1928e-06 -3.53994 63.546000 Cu 0.0569143 0.755722 0.25 264 63.546 6.43416e-06 -3.53994 63.546000 Cu 0.0114462 0.73861 0.5 266 63.546 5.16986e-06 -3.53994 63.546000 Cu 0.0569143 0.755722 0.75 268 63.546 6.43416e-06 -3.53994 63.546000 Cu 0.208405 0.729082 0.25 233 63.546 1.88411e-06 -3.53993 63.546000 Cu 0.329596 0.732885 0.25 237 63.546 3.83315e-06 -3.53993 63.546000 Cu 0.208405 0.729082 0.75 239 63.546 1.88411e-06 -3.53993 63.546000 Cu 0.329596 0.732885 0.75 240 63.546 3.83315e-06 -3.53993 63.546000 Cu 0.25385 0.746203 8.8272e-17 261 63.546 8.84868e-07 -3.53993 63.546000 Cu 0.25385 0.746203 0.5 270 63.546 8.84868e-07 -3.53993 63.546000 Cu 0.375036 0.750012 2.66006e-16 274 63.546 4.7394e-06 -3.53993 63.546000 Cu 0.375036 0.750012 0.5 275 63.546 4.7394e-06 -3.53993 63.546000 Cu 0.450787 0.736697 0.25 244 63.546 4.66157e-06 -3.53993 63.546000 Cu 0.571995 0.740507 0.25 248 63.546 1.00091e-05 -3.53993 63.546000 Cu 0.450787 0.736697 0.75 251 63.546 4.66157e-06 -3.53993 63.546000 Cu 0.571995 0.740507 0.75 252 63.546 1.00091e-05 -3.53993 63.546000 Cu 0.496255 0.753819 3.76899e-16 273 63.546 2.18527e-06 -3.53993 63.546000 Cu 0.496255 0.753819 0.5 282 63.546 2.18527e-06 -3.53993 63.546000 Cu 0.769028 0.731008 4.24012e-16 245 63.546 7.0414e-06 -3.53995 63.546000 Cu 0.647803 0.727199 1.98825e-16 246 63.546 1.17297e-05 -3.53994 63.546000 Cu 0.647803 0.727199 0.5 247 63.546 1.17297e-05 -3.53994 63.546000 Cu 0.693224 0.744315 0.25 249 63.546 5.93537e-06 -3.53994 63.546000 Cu 0.769028 0.731008 0.5 258 63.546 7.0414e-06 -3.53995 63.546000 Cu 0.693224 0.744315 0.75 259 63.546 5.93537e-06 -3.53994 63.546000 Cu 0.617484 0.757625 1.09532e-16 278 63.546 5.24306e-07 -3.53993 63.546000 Cu 0.617484 0.757625 0.5 279 63.546 5.24306e-07 -3.53993 63.546000 Cu 0.890242 0.734814 2.43896e-16 254 63.546 1.27629e-05 -3.53995 63.546000 Cu 0.890242 0.734814 0.5 255 63.546 1.27629e-05 -3.53995 63.546000 Cu 0.814449 0.748123 0.25 256 63.546 3.96234e-06 -3.53995 63.546000 Cu 0.935685 0.751925 0.25 257 63.546 1.83593e-06 -3.53995 63.546000 Cu 0.814449 0.748123 0.75 260 63.546 3.96234e-06 -3.53995 63.546000 Cu 0.935685 0.751925 0.75 267 63.546 1.83593e-06 -3.53995 63.546000 Cu 0.178089 0.759519 0.25 265 63.546 2.49803e-06 -3.53994 63.546000 Cu 0.178089 0.759519 0.75 271 63.546 2.49803e-06 -3.53994 63.546000 Cu 0.102336 0.77284 4.44591e-16 294 63.546 9.31995e-06 -3.53995 63.546000 Cu 0.102336 0.77284 0.5 295 63.546 9.31995e-06 -3.53995 63.546000 Cu 0.0265474 0.786148 0.25 296 63.546 5.38273e-06 -3.53995 63.546000 Cu 0.147778 0.789948 0.25 297 63.546 7.06441e-06 -3.53996 63.546000 Cu 0.0265474 0.786148 0.75 300 63.546 5.38273e-06 -3.53995 63.546000 Cu 0.147778 0.789948 0.75 305 63.546 7.06441e-06 -3.53996 63.546000 Cu 0.299289 0.763326 0.25 269 63.546 8.12161e-06 -3.53994 63.546000 Cu 0.299289 0.763326 0.75 272 63.546 8.12161e-06 -3.53994 63.546000 Cu 0.22353 0.776636 1.63278e-16 293 63.546 6.38646e-06 -3.53995 63.546000 Cu 0.344779 0.780436 7.38151e-17 301 63.546 5.53571e-06 -3.53995 63.546000 Cu 0.344779 0.780436 0.5 302 63.546 5.53571e-06 -3.53995 63.546000 Cu 0.22353 0.776636 0.5 304 63.546 6.38646e-06 -3.53995 63.546000 Cu 0.42053 0.767131 0.25 276 63.546 2.22049e-06 -3.53994 63.546000 Cu 0.541759 0.770936 0.25 280 63.546 3.30868e-06 -3.53994 63.546000 Cu 0.42053 0.767131 0.75 283 63.546 2.22049e-06 -3.53994 63.546000 Cu 0.541759 0.770936 0.75 284 63.546 3.30868e-06 -3.53994 63.546000 Cu 0.46601 0.784246 1.72632e-16 307 63.546 8.09948e-06 -3.53994 63.546000 Cu 0.587213 0.788056 9.30342e-17 310 63.546 1.08646e-06 -3.53993 63.546000 Cu 0.587213 0.788056 0.5 311 63.546 1.08646e-06 -3.53993 63.546000 Cu 0.46601 0.784246 0.5 314 63.546 8.09948e-06 -3.53994 63.546000 Cu 0.738691 0.761432 5.23169e-16 277 63.546 2.29548e-06 -3.53994 63.546000 Cu 0.662967 0.774746 0.25 281 63.546 2.42979e-06 -3.53993 63.546000 Cu 0.784173 0.778548 0.25 288 63.546 3.2612e-06 -3.53994 63.546000 Cu 0.738691 0.761432 0.5 290 63.546 2.29548e-06 -3.53994 63.546000 Cu 0.662967 0.774746 0.75 291 63.546 2.42979e-06 -3.53993 63.546000 Cu 0.784173 0.778548 0.75 292 63.546 3.2612e-06 -3.53994 63.546000 Cu 0.708433 0.791866 3.91186e-18 309 63.546 7.18461e-06 -3.53993 63.546000 Cu 0.708433 0.791866 0.5 322 63.546 7.18461e-06 -3.53993 63.546000 Cu 0.981139 0.769036 3.43053e-16 285 63.546 2.35964e-06 -3.53995 63.546000 Cu 0.859918 0.765234 2.55802e-16 286 63.546 1.86272e-06 -3.53995 63.546000 Cu 0.859918 0.765234 0.5 287 63.546 1.86272e-06 -3.53995 63.546000 Cu 0.90536 0.782348 0.25 289 63.546 3.04841e-06 -3.53994 63.546000 Cu 0.981139 0.769036 0.5 298 63.546 2.35964e-06 -3.53995 63.546000 Cu 0.90536 0.782348 0.75 299 63.546 3.04841e-06 -3.53994 63.546000 Cu 0.193201 0.807048 3.9969e-17 325 63.546 2.05083e-05 -3.53996 63.546000 Cu 0.0719792 0.803251 1.70081e-19 326 63.546 1.67936e-05 -3.53996 63.546000 Cu 0.0719792 0.803251 0.5 327 63.546 1.67936e-05 -3.53996 63.546000 Cu 0.117343 0.820359 0.25 329 63.546 3.07223e-05 -3.53994 63.546000 Cu 0.193201 0.807048 0.5 337 63.546 2.05083e-05 -3.53996 63.546000 Cu 0.117343 0.820359 0.75 338 63.546 3.07223e-05 -3.53994 63.546000 Cu 0.269005 0.79374 0.25 303 63.546 1.5597e-05 -3.53995 63.546000 Cu 0.269005 0.79374 0.75 306 63.546 1.5597e-05 -3.53995 63.546000 Cu 0.390207 0.797549 0.25 308 63.546 3.3973e-06 -3.53995 63.546000 Cu 0.390207 0.797549 0.75 315 63.546 3.3973e-06 -3.53995 63.546000 Cu 0.314378 0.810853 9.55854e-17 333 63.546 3.49673e-06 -3.53995 63.546000 Cu 0.314378 0.810853 0.5 334 63.546 3.49673e-06 -3.53995 63.546000 Cu 0.238505 0.824159 0.25 335 63.546 8.13069e-06 -3.53995 63.546000 Cu 0.238505 0.824159 0.75 339 63.546 8.13069e-06 -3.53995 63.546000 Cu 0.511431 0.801366 0.25 312 63.546 5.59046e-06 -3.53994 63.546000 Cu 0.511431 0.801366 0.75 316 63.546 5.59046e-06 -3.53994 63.546000 Cu 0.4356 0.814666 1.71271e-16 341 63.546 2.85722e-06 -3.53994 63.546000 Cu 0.556853 0.818488 2.45937e-16 343 63.546 8.35371e-06 -3.53993 63.546000 Cu 0.556853 0.818488 0.5 344 63.546 8.35371e-06 -3.53993 63.546000 Cu 0.4356 0.814666 0.5 347 63.546 2.85722e-06 -3.53994 63.546000 Cu 0.632653 0.805178 0.25 313 63.546 4.26871e-06 -3.53992 63.546000 Cu 0.753857 0.808994 0.25 320 63.546 8.58496e-06 -3.53992 63.546000 Cu 0.632653 0.805178 0.75 323 63.546 4.26871e-06 -3.53992 63.546000 Cu 0.753857 0.808994 0.75 324 63.546 8.58496e-06 -3.53992 63.546000 Cu 0.678072 0.82231 5.62627e-16 342 63.546 4.48144e-06 -3.53991 63.546000 Cu 0.799275 0.826127 7.75909e-16 350 63.546 1.86625e-05 -3.53991 63.546000 Cu 0.799275 0.826127 0.5 351 63.546 1.86625e-05 -3.53991 63.546000 Cu 0.678072 0.82231 0.5 354 63.546 4.48144e-06 -3.53991 63.546000 Cu 0.950775 0.799463 8.26593e-17 317 63.546 7.99051e-06 -3.53995 63.546000 Cu 0.829608 0.795669 3.67375e-17 318 63.546 1.99812e-06 -3.53993 63.546000 Cu 0.829608 0.795669 0.5 319 63.546 1.99812e-06 -3.53993 63.546000 Cu 0.875027 0.812793 0.25 321 63.546 6.2341e-06 -3.53992 63.546000 Cu 0.996189 0.816573 0.25 328 63.546 3.04499e-05 -3.53993 63.546000 Cu 0.950775 0.799463 0.5 330 63.546 7.99051e-06 -3.53995 63.546000 Cu 0.875027 0.812793 0.75 331 63.546 6.2341e-06 -3.53992 63.546000 Cu 0.996189 0.816573 0.75 332 63.546 3.04499e-05 -3.53993 63.546000 Cu 0.162616 0.837478 3.72477e-17 357 63.546 3.02729e-05 -3.53993 63.546000 Cu 0.0414984 0.833695 1 358 63.546 3.58899e-05 -3.53991 63.546000 Cu 0.0414984 0.833695 0.5 359 63.546 3.58899e-05 -3.53991 63.546000 Cu 0.0867815 0.850824 0.25 361 63.546 5.95274e-05 -3.53989 63.546000 Cu 0.162616 0.837478 0.5 369 63.546 3.02729e-05 -3.53993 63.546000 Cu 0.0867815 0.850824 0.75 370 63.546 5.95274e-05 -3.53989 63.546000 Cu 0.359739 0.827966 0.25 336 63.546 5.78044e-06 -3.53995 63.546000 Cu 0.359739 0.827966 0.75 340 63.546 5.78044e-06 -3.53995 63.546000 Cu 0.283827 0.841269 1.82667e-16 365 63.546 1.99577e-05 -3.53994 63.546000 Cu 0.283827 0.841269 0.5 366 63.546 1.99577e-05 -3.53994 63.546000 Cu 0.207931 0.854592 0.25 367 63.546 6.57065e-05 -3.53992 63.546000 Cu 0.329196 0.858377 0.25 368 63.546 1.68338e-05 -3.53994 63.546000 Cu 0.207931 0.854592 0.75 371 63.546 6.57065e-05 -3.53992 63.546000 Cu 0.329196 0.858377 0.75 372 63.546 1.68338e-05 -3.53994 63.546000 Cu 0.481011 0.831785 0.25 345 63.546 7.36521e-06 -3.53994 63.546000 Cu 0.481011 0.831785 0.75 348 63.546 7.36521e-06 -3.53994 63.546000 Cu 0.405116 0.845075 1.33513e-16 373 63.546 1.59687e-05 -3.53995 63.546000 Cu 0.526387 0.848908 2.19574e-16 375 63.546 1.22002e-05 -3.53994 63.546000 Cu 0.526387 0.848908 0.5 376 63.546 1.22002e-05 -3.53994 63.546000 Cu 0.405116 0.845075 0.5 379 63.546 1.59687e-05 -3.53995 63.546000 Cu 0.602256 0.835616 0.25 346 63.546 8.99448e-06 -3.53993 63.546000 Cu 0.723481 0.839447 0.25 352 63.546 1.92391e-05 -3.53991 63.546000 Cu 0.602256 0.835616 0.75 355 63.546 8.99448e-06 -3.53993 63.546000 Cu 0.723481 0.839447 0.75 356 63.546 1.92391e-05 -3.53991 63.546000 Cu 0.647635 0.852743 1 374 63.546 7.91496e-06 -3.53993 63.546000 Cu 0.768892 0.856584 1 382 63.546 7.21063e-05 -3.53989 63.546000 Cu 0.768892 0.856584 0.5 383 63.546 7.21063e-05 -3.53989 63.546000 Cu 0.647635 0.852743 0.5 386 63.546 7.91496e-06 -3.53993 63.546000 Cu 0.920423 0.82992 1 349 63.546 1.77816e-05 -3.5399 63.546000 Cu 0.84467 0.843265 0.25 353 63.546 3.70861e-05 -3.53989 63.546000 Cu 0.965739 0.847061 0.25 360 63.546 2.35728e-05 -3.53987 63.546000 Cu 0.920423 0.82992 0.5 362 63.546 1.77816e-05 -3.5399 63.546000 Cu 0.84467 0.843265 0.75 363 63.546 3.70861e-05 -3.53989 63.546000 Cu 0.965739 0.847061 0.75 364 63.546 2.35728e-05 -3.53987 63.546000 Cu 0.889999 0.860413 0 381 63.546 3.14747e-05 -3.53988 63.546000 Cu 0.889999 0.860413 0.5 394 63.546 3.14747e-05 -3.53988 63.546000 Cu 0.132143 0.867954 3.94758e-16 389 63.546 5.32435e-05 -3.53988 63.546000 Cu 0.0110739 0.864207 3.90336e-16 390 63.546 6.03715e-05 -3.53986 63.546000 Cu 0.0110739 0.864207 0.5 391 63.546 6.03715e-05 -3.53986 63.546000 Cu 0.056487 0.881343 0.25 393 63.546 0.000115423 -3.53987 63.546000 Cu 0.177606 0.885071 0.25 399 63.546 4.33978e-05 -3.53989 63.546000 Cu 0.132143 0.867954 0.5 401 63.546 5.32435e-05 -3.53988 63.546000 Cu 0.056487 0.881343 0.75 402 63.546 0.000115423 -3.53987 63.546000 Cu 0.177606 0.885071 0.75 403 63.546 4.33978e-05 -3.53989 63.546000 Cu 0.2533 0.871696 5.58035e-16 397 63.546 0.000166407 -3.53993 63.546000 Cu 0.2533 0.871696 0.5 398 63.546 0.000166407 -3.53993 63.546000 Cu 0.298644 0.888783 0.25 400 63.546 0.000757595 -3.53992 63.546000 Cu 0.298644 0.888783 0.75 404 63.546 0.000757595 -3.53992 63.546000 Cu 0.374554 0.875488 2.27908e-17 405 63.546 4.23365e-05 -3.53995 63.546000 Cu 0.374554 0.875488 0.5 411 63.546 4.23365e-05 -3.53995 63.546000 Cu 0.450444 0.862185 0.25 377 63.546 4.16164e-05 -3.53996 63.546000 Cu 0.450444 0.862185 0.75 380 63.546 4.16164e-05 -3.53996 63.546000 Cu 0.571732 0.866027 0.25 378 63.546 2.69856e-05 -3.53995 63.546000 Cu 0.571732 0.866027 0.75 387 63.546 2.69856e-05 -3.53995 63.546000 Cu 0.495704 0.879293 2.38113e-16 407 63.546 0.000147583 -3.53995 63.546000 Cu 0.495704 0.879293 0.5 408 63.546 0.000147583 -3.53995 63.546000 Cu 0.419739 0.892616 0.25 409 63.546 0.000151796 -3.53992 63.546000 Cu 0.540851 0.896398 0.25 410 63.546 0.00047138 -3.53991 63.546000 Cu 0.419739 0.892616 0.75 412 63.546 0.000151796 -3.53992 63.546000 Cu 0.540851 0.896398 0.75 419 63.546 0.00047138 -3.53991 63.546000 Cu 0.693 0.869867 0.25 384 63.546 2.90826e-05 -3.53994 63.546000 Cu 0.693 0.869867 0.75 388 63.546 2.90826e-05 -3.53994 63.546000 Cu 0.61701 0.883146 7.34579e-16 406 63.546 4.66841e-05 -3.53995 63.546000 Cu 0.738294 0.886997 4.16358e-16 414 63.546 7.23697e-05 -3.53993 63.546000 Cu 0.738294 0.886997 0.5 415 63.546 7.23697e-05 -3.53993 63.546000 Cu 0.61701 0.883146 0.5 418 63.546 4.66841e-05 -3.53995 63.546000 Cu 0.814243 0.87374 0.25 385 63.546 0.000226553 -3.53985 63.546000 Cu 0.935331 0.877561 0.25 392 63.546 4.88937e-05 -3.53988 63.546000 Cu 0.814243 0.87374 0.75 395 63.546 0.000226553 -3.53985 63.546000 Cu 0.935331 0.877561 0.75 396 63.546 4.88937e-05 -3.53988 63.546000 Cu 0.859603 0.890909 1 413 63.546 0.00087523 -3.53981 63.546000 Cu 0.980807 0.894693 6.13992e-16 422 63.546 9.63164e-05 -3.53989 63.546000 Cu 0.980807 0.894693 0.5 423 63.546 9.63164e-05 -3.53989 63.546000 Cu 0.859603 0.890909 0.5 426 63.546 0.00087523 -3.53981 63.546000 Cu 0.102072 0.898468 1.83687e-16 421 63.546 0.000207886 -3.53984 63.546000 Cu 0.0265524 0.911805 0.25 425 63.546 0.000345642 -3.53989 63.546000 Cu 0.147762 0.915616 0.25 432 63.546 0.00318003 -3.53918 63.546000 Cu 0.102072 0.898468 0.5 434 63.546 0.000207886 -3.53984 63.546000 Cu 0.0265524 0.911805 0.75 435 63.546 0.000345642 -3.53989 63.546000 Cu 0.147762 0.915616 0.75 436 63.546 0.00318003 -3.53918 63.546000 Cu 0.0726023 0.928906 1 453 63.546 0.0106362 -3.53902 63.546000 Cu 0.0726023 0.928906 0.5 466 63.546 0.0106362 -3.53902 63.546000 Cu 0.343562 0.905886 2.68047e-16 429 63.546 0.00240448 -3.53961 63.546000 Cu 0.223034 0.902185 2.90498e-16 430 63.546 0.000726522 -3.53975 63.546000 Cu 0.223034 0.902185 0.5 431 63.546 0.000726522 -3.53975 63.546000 Cu 0.267866 0.919389 0.25 433 63.546 0.00109041 -3.53912 63.546000 Cu 0.343562 0.905886 0.5 437 63.546 0.00240448 -3.53961 63.546000 Cu 0.267866 0.919389 0.75 438 63.546 0.00109041 -3.53912 63.546000 Cu 0.388288 0.922937 0.25 442 63.546 0.0102804 -3.53873 63.546000 Cu 0.388288 0.922937 0.75 444 63.546 0.0102804 -3.53873 63.546000 Cu 0.585973 0.913464 9.81367e-17 439 63.546 0.00243616 -3.53985 63.546000 Cu 0.464868 0.909748 4.38979e-16 440 63.546 0.00137651 -3.53988 63.546000 Cu 0.464868 0.909748 0.5 441 63.546 0.00137651 -3.53988 63.546000 Cu 0.510196 0.926863 0.25 443 63.546 0.0106067 -3.5392 63.546000 Cu 0.585973 0.913464 0.5 450 63.546 0.00243616 -3.53985 63.546000 Cu 0.510196 0.926863 0.75 451 63.546 0.0106067 -3.5392 63.546000 Cu 0.662266 0.900262 0.25 416 63.546 0.000277435 -3.53994 63.546000 Cu 0.783479 0.904131 0.25 417 63.546 0.000454982 -3.53988 63.546000 Cu 0.662266 0.900262 0.75 420 63.546 0.000277435 -3.53994 63.546000 Cu 0.783479 0.904131 0.75 427 63.546 0.000454982 -3.53988 63.546000 Cu 0.707254 0.917408 2.13111e-16 446 63.546 0.00144248 -3.53989 63.546000 Cu 0.707254 0.917408 0.5 447 63.546 0.00144248 -3.53989 63.546000 Cu 0.630443 0.930562 0.25 448 63.546 0.0111029 -3.53847 63.546000 Cu 0.630443 0.930562 0.75 452 63.546 0.0111029 -3.53847 63.546000 Cu 0.90524 0.908061 0.25 424 63.546 0.00283128 -3.53963 63.546000 Cu 0.90524 0.908061 0.75 428 63.546 0.00283128 -3.53963 63.546000 Cu 0.82888 0.921194 5.52082e-16 445 63.546 0.00222675 -3.53956 63.546000 Cu 0.951376 0.925202 6.92229e-17 454 63.546 0.0100095 -3.53887 63.546000 Cu 0.951376 0.925202 0.5 455 63.546 0.0100095 -3.53887 63.546000 Cu 0.82888 0.921194 0.5 458 63.546 0.00222675 -3.53956 63.546000 Cu 0.192518 0.932984 1 462 63.546 0.00511502 -3.53827 63.546000 Cu 0.192518 0.932984 0.5 463 63.546 0.00511502 -3.53827 63.546000 Cu 0.116664 0.94635 0.25 464 63.546 0.01743 -3.53686 63.546000 Cu 0.116664 0.94635 0.75 468 63.546 0.01743 -3.53686 63.546000 Cu 0.0417463 0.960372 3.30297e-16 485 63.546 0.214915 -3.51846 63.546000 Cu 0.160952 0.963563 1.48821e-16 494 63.546 0.223179 -3.52432 63.546000 Cu 0.160952 0.963563 0.5 495 63.546 0.223179 -3.52432 63.546000 Cu 0.0417463 0.960372 0.5 498 63.546 0.214915 -3.51846 63.546000 Cu 0.312734 0.936576 0 461 63.546 0.00471581 -3.53844 63.546000 Cu 0.237724 0.950362 0.25 465 63.546 0.0383138 -3.53775 63.546000 Cu 0.358638 0.953555 0.25 469 63.546 0.0650902 -3.53199 63.546000 Cu 0.312734 0.936576 0.5 470 63.546 0.00471581 -3.53844 63.546000 Cu 0.237724 0.950362 0.75 471 63.546 0.0383138 -3.53775 63.546000 Cu 0.358638 0.953555 0.75 472 63.546 0.0650902 -3.53199 63.546000 Cu 0.554544 0.944211 6.95631e-17 473 63.546 0.0535285 -3.53782 63.546000 Cu 0.433348 0.93982 2.38794e-16 474 63.546 0.0467824 -3.53793 63.546000 Cu 0.433348 0.93982 0.5 475 63.546 0.0467824 -3.53793 63.546000 Cu 0.47562 0.956912 0.25 476 63.546 0.182935 -3.51801 63.546000 Cu 0.554544 0.944211 0.5 482 63.546 0.0535285 -3.53782 63.546000 Cu 0.47562 0.956912 0.75 483 63.546 0.182935 -3.51801 63.546000 Cu 0.752669 0.934474 0.25 449 63.546 0.00585274 -3.53959 63.546000 Cu 0.752669 0.934474 0.75 459 63.546 0.00585274 -3.53959 63.546000 Cu 0.799331 0.951457 1.53753e-16 477 63.546 0.0371564 -3.53796 63.546000 Cu 0.675352 0.947457 1.60726e-16 478 63.546 0.0485218 -3.53519 63.546000 Cu 0.675352 0.947457 0.5 479 63.546 0.0485218 -3.53519 63.546000 Cu 0.600549 0.96145 0.25 480 63.546 0.233595 -3.52837 63.546000 Cu 0.721167 0.96408 0.25 481 63.546 0.276678 -3.51829 63.546000 Cu 0.600549 0.96145 0.75 484 63.546 0.233595 -3.52837 63.546000 Cu 0.799331 0.951457 0.5 490 63.546 0.0371564 -3.53796 63.546000 Cu 0.721167 0.96408 0.75 491 63.546 0.276678 -3.51829 63.546000 Cu 0.874814 0.938142 0.25 456 63.546 0.0134255 -3.53823 63.546000 Cu 0.998377 0.942344 0.25 457 63.546 0.074845 -3.52953 63.546000 Cu 0.874814 0.938142 0.75 460 63.546 0.0134255 -3.53823 63.546000 Cu 0.998377 0.942344 0.75 467 63.546 0.074845 -3.52953 63.546000 Cu 0.92213 0.954814 4.88642e-16 486 63.546 0.175385 -3.5329 63.546000 Cu 0.92213 0.954814 0.5 487 63.546 0.175385 -3.5329 63.546000 Cu 0.0892159 0.978524 0.25 496 63.546 1.89423 -3.50834 63.546000 Cu 0.0892159 0.978524 0.75 500 63.546 1.89423 -3.50834 63.546000 Cu 0.000438887 0.988878 1 517 63.546 3.54381 -3.48202 63.546000 Cu 0.161632 0.994405 3.42373e-16 525 63.546 9.6878 -3.33493 63.546000 Cu 0.161632 0.994405 0.5 526 63.546 9.6878 -3.33493 63.546000 Cu 0.000438887 0.988878 0.5 527 63.546 3.54381 -3.48202 63.546000 Cu 0.286634 0.967305 1.20757e-16 493 63.546 0.596138 -3.47638 63.546000 Cu 0.211964 0.979365 0.25 497 63.546 9.4309 -3.40225 63.546000 Cu 0.32189 0.987433 0.25 501 63.546 2.16279 -3.35463 63.546000 Cu 0.286634 0.967305 0.5 502 63.546 0.596138 -3.47638 63.546000 Cu 0.211964 0.979365 0.75 503 63.546 9.4309 -3.40225 63.546000 Cu 0.32189 0.987433 0.75 504 63.546 2.16279 -3.35463 63.546000 Cu 0.399864 0.971626 1 506 63.546 0.20145 -3.48284 63.546000 Cu 0.399864 0.971626 0.5 507 63.546 0.20145 -3.48284 63.546000 Cu 0.519387 0.973286 1 505 63.546 0.59898 -3.48247 63.546000 Cu 0.443715 0.988437 0.25 508 63.546 0.514712 -3.51866 63.546000 Cu 0.563502 0.988979 0.25 512 63.546 5.65583 -3.46845 63.546000 Cu 0.519387 0.973286 0.5 514 63.546 0.59898 -3.48247 63.546000 Cu 0.443715 0.988437 0.75 515 63.546 0.514712 -3.51866 63.546000 Cu 0.563502 0.988979 0.75 516 63.546 5.65583 -3.46845 63.546000 Cu 0.772626 0.979512 1 509 63.546 9.18972 -3.39697 63.546000 Cu 0.650318 0.978767 3.00193e-16 510 63.546 5.02932 -3.51421 63.546000 Cu 0.650318 0.978767 0.5 511 63.546 5.02932 -3.51421 63.546000 Cu 0.723003 0.994391 0.25 513 63.546 9.46979 -3.3305 63.546000 Cu 0.772626 0.979512 0.5 521 63.546 9.18972 -3.39697 63.546000 Cu 0.723003 0.994391 0.75 522 63.546 9.46979 -3.3305 63.546000 Cu 0.848916 0.968054 0.25 488 63.546 0.76035 -3.47546 63.546000 Cu 0.961675 0.972491 0.25 489 63.546 0.469761 -3.47465 63.546000 Cu 0.848916 0.968054 0.75 492 63.546 0.76035 -3.47546 63.546000 Cu 0.961675 0.972491 0.75 499 63.546 0.469761 -3.47465 63.546000 Cu 0.880487 0.987871 2.53591e-16 518 63.546 2.61313 -3.38794 63.546000 Cu 0.880487 0.987871 0.5 519 63.546 2.61313 -3.38794