Number of particles = 1180 A = 1 Angstrom (basic length-scale) H0(1,1) = 30.9764 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 124.134 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61494 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 0.0110673 0.0266096 1.11931e-16 602 63.546 0.024417 -3.54539 63.546000 Cu 0.025065 0.00600245 1.22728e-16 605 63.546 0.076313 -3.53106 63.546000 Cu 0.104924 0.00903716 1.38684e-16 606 63.546 0.262735 -3.53286 63.546000 Cu 0.0586107 0.017612 0.5 607 63.546 0.120304 -3.56827 63.546000 Cu 0.151224 0.00263577 0.5 608 63.546 0.875236 -3.32619 63.546000 Cu 0.0444886 0.0383087 0.5 616 63.546 0.0315466 -3.55687 63.546000 Cu 0.0915113 0.0298735 9.96942e-17 618 63.546 0.0365776 -3.5465 63.546000 Cu 0.172425 0.0340654 9.54953e-17 619 63.546 0.0562337 -3.49797 63.546000 Cu 0.138302 0.0222434 0.5 620 63.546 0.112871 -3.47369 63.546000 Cu 0.124878 0.0422575 0.5 621 63.546 0.0187375 -3.51493 63.546000 Cu 0.185992 0.0142078 9.11764e-18 622 63.546 0.211196 -3.4606 63.546000 Cu 0.268251 0.0160941 1.21529e-16 623 63.546 0.0524067 -3.54 63.546000 Cu 0.234373 0.00511442 0.5 624 63.546 0.0400982 -3.49238 63.546000 Cu 0.22034 0.0253031 0.5 625 63.546 0.0141104 -3.51546 63.546000 Cu 0.316102 0.00683489 0.5 627 63.546 0.313713 -3.57953 63.546000 Cu 0.206363 0.0455099 0.5 643 63.546 0.00522427 -3.52528 63.546000 Cu 0.254118 0.0366397 1.22608e-16 645 63.546 0.0179404 -3.54507 63.546000 Cu 0.334613 0.0400293 1.21888e-16 646 63.546 0.0217076 -3.54496 63.546000 Cu 0.301635 0.0277929 0.5 647 63.546 0.0807727 -3.56485 63.546000 Cu 0.287464 0.0484021 0.5 648 63.546 0.0229792 -3.55233 63.546000 Cu 0.348301 0.0193823 8.38583e-17 649 63.546 0.12619 -3.54093 63.546000 Cu 0.394782 0.0124874 0.5 651 63.546 0.403355 -3.40078 63.546000 Cu 0.381569 0.0322651 0.5 652 63.546 0.0570201 -3.49366 63.546000 Cu 0.429136 0.0242733 1.22848e-16 650 63.546 0.132949 -3.47804 63.546000 Cu 0.442802 0.00459639 5.96246e-17 653 63.546 0.506914 -3.4194 63.546000 Cu 0.525065 0.00600245 1.84752e-16 654 63.546 0.076313 -3.53106 63.546000 Cu 0.477247 0.015423 0.5 655 63.546 0.024977 -3.50668 63.546000 Cu 0.415438 0.0441791 8.4818e-17 679 63.546 0.0362694 -3.50695 63.546000 Cu 0.496931 0.0470411 0 680 63.546 0.00675317 -3.54281 63.546000 Cu 0.463268 0.0355815 0.5 681 63.546 0.0110368 -3.5219 63.546000 Cu 0.511067 0.0266096 0 683 63.546 0.024417 -3.54539 63.546000 Cu 0.591511 0.0298735 1.46722e-16 684 63.546 0.0365776 -3.5465 63.546000 Cu 0.558611 0.017612 0.5 685 63.546 0.120304 -3.56827 63.546000 Cu 0.544489 0.0383087 0.5 686 63.546 0.0315466 -3.55687 63.546000 Cu 0.604924 0.00903716 2.99922e-17 687 63.546 0.262735 -3.53286 63.546000 Cu 0.685992 0.0142078 2.11985e-16 688 63.546 0.211196 -3.4606 63.546000 Cu 0.651224 0.00263577 0.5 689 63.546 0.875236 -3.32619 63.546000 Cu 0.638302 0.0222434 0.5 690 63.546 0.112871 -3.47369 63.546000 Cu 0.734373 0.00511442 0.5 691 63.546 0.0400982 -3.49238 63.546000 Cu 0.624878 0.0422575 0.5 724 63.546 0.0187375 -3.51493 63.546000 Cu 0.672425 0.0340654 9.2736e-17 726 63.546 0.0562337 -3.49797 63.546000 Cu 0.754118 0.0366397 2.45456e-16 727 63.546 0.0179404 -3.54507 63.546000 Cu 0.72034 0.0253031 0.5 728 63.546 0.0141104 -3.51546 63.546000 Cu 0.706363 0.0455099 0.5 729 63.546 0.00522427 -3.52528 63.546000 Cu 0.768251 0.0160941 3.13119e-17 730 63.546 0.0524067 -3.54 63.546000 Cu 0.787464 0.0484021 0.5 773 63.546 0.0229792 -3.55233 63.546000 Cu 0.801635 0.0277929 0.5 733 63.546 0.0807727 -3.56485 63.546000 Cu 0.942802 0.00459639 3.17918e-16 596 63.546 0.506914 -3.4194 63.546000 Cu 0.894782 0.0124874 0.5 597 63.546 0.403355 -3.40078 63.546000 Cu 0.915438 0.0441791 9.2736e-17 598 63.546 0.0362694 -3.50695 63.546000 Cu 0.881569 0.0322651 0.5 599 63.546 0.0570201 -3.49366 63.546000 Cu 0.929136 0.0242733 1.43363e-16 601 63.546 0.132949 -3.47804 63.546000 Cu 0.977247 0.015423 0.5 603 63.546 0.024977 -3.50668 63.546000 Cu 0.963268 0.0355815 0.5 604 63.546 0.0110368 -3.5219 63.546000 Cu 0.996931 0.0470411 9.06965e-17 614 63.546 0.00675317 -3.54281 63.546000 Cu 0.848301 0.0193823 1.70476e-16 731 63.546 0.12619 -3.54093 63.546000 Cu 0.816102 0.00683489 0.5 732 63.546 0.313713 -3.57953 63.546000 Cu 0.834613 0.0400293 6.51431e-17 775 63.546 0.0217076 -3.54496 63.546000 Cu 0.0776446 0.0503554 0 615 63.546 0.00684754 -3.54309 63.546000 Cu 0.0302347 0.0587853 0.5 617 63.546 0.00794954 -3.54663 63.546000 Cu 0.048973 0.0910094 1.37604e-16 634 63.546 0.000312313 -3.53657 63.546000 Cu 0.0158083 0.0791503 0.5 635 63.546 0.00180699 -3.54059 63.546000 Cu 0.0633991 0.0707083 8.99767e-17 637 63.546 0.00149497 -3.53906 63.546000 Cu 0.144303 0.0742492 8.00193e-17 638 63.546 0.00339596 -3.52596 63.546000 Cu 0.110903 0.0624162 0.5 639 63.546 0.00364139 -3.52691 63.546000 Cu 0.0966136 0.0826318 0.5 640 63.546 0.000744553 -3.53104 63.546000 Cu 0.15856 0.0541058 2.14504e-16 641 63.546 0.014341 -3.517 63.546000 Cu 0.192096 0.0657312 0.5 644 63.546 0.00154504 -3.52942 63.546000 Cu 0.129886 0.0944504 8.39782e-17 667 63.546 0.000763723 -3.5298 63.546000 Cu 0.177655 0.0859699 0.5 669 63.546 0.000431268 -3.53172 63.546000 Cu 0.00131437 0.0994551 0.5 636 63.546 0.00038758 -3.53718 63.546000 Cu 0.239888 0.0570609 1.64837e-16 642 63.546 0.00544675 -3.54121 63.546000 Cu 0.210911 0.0977088 1.19969e-19 668 63.546 0.00039731 -3.53601 63.546000 Cu 0.225429 0.0774043 0 671 63.546 0.00146887 -3.5381 63.546000 Cu 0.306204 0.0807829 6.03444e-17 672 63.546 0.00148201 -3.53803 63.546000 Cu 0.273092 0.0688474 0.5 673 63.546 0.00633374 -3.54417 63.546000 Cu 0.258609 0.0892026 0.5 674 63.546 0.00184553 -3.53928 63.546000 Cu 0.320567 0.0604494 9.48954e-17 675 63.546 0.00521391 -3.54082 63.546000 Cu 0.367881 0.0523319 0.5 677 63.546 0.0100282 -3.51988 63.546000 Cu 0.353744 0.0725061 0.5 678 63.546 0.00189399 -3.52866 63.546000 Cu 0.339367 0.0927283 0.5 712 63.546 0.000398041 -3.53193 63.546000 Cu 0.387037 0.0843911 0 714 63.546 0.00247344 -3.52768 63.546000 Cu 0.401372 0.0642408 5.48258e-17 676 63.546 0.00960518 -3.52058 63.546000 Cu 0.449152 0.0557564 0.5 682 63.546 0.00436933 -3.527 63.546000 Cu 0.468098 0.0876684 0 715 63.546 0.000287947 -3.53595 63.546000 Cu 0.434804 0.0759534 0.5 716 63.546 0.00158528 -3.52983 63.546000 Cu 0.420337 0.0961679 0.5 717 63.546 0.000548112 -3.53156 63.546000 Cu 0.482582 0.0673809 1.72875e-16 718 63.546 0.00152283 -3.53859 63.546000 Cu 0.563399 0.0707083 7.01818e-17 719 63.546 0.00149497 -3.53906 63.546000 Cu 0.530235 0.0587853 0.5 720 63.546 0.00794954 -3.54663 63.546000 Cu 0.515808 0.0791503 0.5 721 63.546 0.00180699 -3.54059 63.546000 Cu 0.577645 0.0503554 8.28985e-17 722 63.546 0.00684754 -3.54309 63.546000 Cu 0.501314 0.0994551 0.5 761 63.546 0.00038758 -3.53718 63.546000 Cu 0.548973 0.0910094 2.13185e-16 763 63.546 0.000312313 -3.53657 63.546000 Cu 0.596614 0.0826318 0.5 765 63.546 0.000744553 -3.53104 63.546000 Cu 0.65856 0.0541058 0 723 63.546 0.014341 -3.517 63.546000 Cu 0.610903 0.0624162 0.5 725 63.546 0.00364139 -3.52691 63.546000 Cu 0.629886 0.0944504 3.02082e-16 764 63.546 0.000763723 -3.5298 63.546000 Cu 0.644303 0.0742492 9.21361e-17 767 63.546 0.00339596 -3.52596 63.546000 Cu 0.725429 0.0774043 2.26141e-16 768 63.546 0.00146887 -3.5381 63.546000 Cu 0.692096 0.0657312 0.5 769 63.546 0.00154504 -3.52942 63.546000 Cu 0.677655 0.0859699 0.5 770 63.546 0.000431268 -3.53172 63.546000 Cu 0.739888 0.0570609 1.06652e-16 771 63.546 0.00544675 -3.54121 63.546000 Cu 0.773092 0.0688474 0.5 774 63.546 0.00633374 -3.54417 63.546000 Cu 0.710911 0.0977088 8.04991e-17 812 63.546 0.00039731 -3.53601 63.546000 Cu 0.758609 0.0892026 0.5 814 63.546 0.00184553 -3.53928 63.546000 Cu 0.867881 0.0523319 0.5 600 63.546 0.0100282 -3.51988 63.546000 Cu 0.887037 0.0843911 0 609 63.546 0.00247344 -3.52768 63.546000 Cu 0.901372 0.0642408 8.74573e-17 610 63.546 0.00960518 -3.52058 63.546000 Cu 0.982582 0.0673809 1.83432e-16 611 63.546 0.00152283 -3.53859 63.546000 Cu 0.949152 0.0557564 0.5 612 63.546 0.00436933 -3.527 63.546000 Cu 0.934804 0.0759534 0.5 613 63.546 0.00158528 -3.52983 63.546000 Cu 0.920337 0.0961679 0.5 631 63.546 0.000548112 -3.53156 63.546000 Cu 0.968098 0.0876684 0 633 63.546 0.000287947 -3.53595 63.546000 Cu 0.820567 0.0604494 1.19969e-19 772 63.546 0.00521391 -3.54082 63.546000 Cu 0.806204 0.0807829 1.05933e-16 816 63.546 0.00148201 -3.53803 63.546000 Cu 0.853744 0.0725061 0.5 817 63.546 0.00189399 -3.52866 63.546000 Cu 0.839367 0.0927283 0.5 818 63.546 0.000398041 -3.53193 63.546000 Cu 0.0204475 0.131563 9.30959e-17 660 63.546 0.00031025 -3.53543 63.546000 Cu 0.0345612 0.111288 2.21463e-16 663 63.546 0.000172109 -3.53541 63.546000 Cu 0.115515 0.114684 1.60638e-16 664 63.546 0.000326366 -3.53224 63.546000 Cu 0.0821925 0.102868 0.5 665 63.546 0.000193056 -3.53266 63.546000 Cu 0.0679324 0.123123 0.5 666 63.546 0.000305072 -3.53398 63.546000 Cu 0.163189 0.106216 0.5 670 63.546 0.000157947 -3.53264 63.546000 Cu 0.054116 0.143394 0.5 700 63.546 0.000147709 -3.53484 63.546000 Cu 0.101488 0.134943 7.49806e-17 702 63.546 0.00030375 -3.53425 63.546000 Cu 0.182567 0.138283 2.39938e-19 703 63.546 0.000251297 -3.53588 63.546000 Cu 0.148963 0.126477 0.5 704 63.546 0.000301647 -3.5341 63.546000 Cu 0.135212 0.146755 0.5 705 63.546 9.18767e-05 -3.53518 63.546000 Cu 0.196528 0.117995 1.38804e-16 706 63.546 0.00032865 -3.53542 63.546000 Cu 0.27746 0.121374 1.90751e-17 707 63.546 0.000396724 -3.53614 63.546000 Cu 0.244145 0.109515 0.5 708 63.546 0.000669211 -3.53719 63.546000 Cu 0.229979 0.129815 0.5 709 63.546 0.000463725 -3.53657 63.546000 Cu 0.291759 0.101082 2.66331e-17 710 63.546 0.000521132 -3.53632 63.546000 Cu 0.372622 0.104593 2.06347e-16 711 63.546 0.000717105 -3.53079 63.546000 Cu 0.324999 0.112975 0.5 713 63.546 0.000246506 -3.53348 63.546000 Cu 0.263594 0.141667 1.5404e-16 751 63.546 0.000206303 -3.53597 63.546000 Cu 0.344628 0.145094 7.09016e-17 752 63.546 0.000171549 -3.53458 63.546000 Cu 0.310946 0.133242 0.5 753 63.546 0.000314025 -3.53473 63.546000 Cu 0.358397 0.12483 4.97871e-17 755 63.546 0.00047203 -3.53289 63.546000 Cu 0.391983 0.136653 0.5 758 63.546 0.000283759 -3.53419 63.546000 Cu 0.439429 0.128199 1.60998e-16 756 63.546 0.000310451 -3.53486 63.546000 Cu 0.405967 0.1164 0.5 757 63.546 0.000355379 -3.53278 63.546000 Cu 0.45363 0.107934 1.1733e-16 759 63.546 0.000125809 -3.5349 63.546000 Cu 0.534561 0.111288 1.51641e-16 760 63.546 0.000172109 -3.53541 63.546000 Cu 0.48697 0.119736 0.5 762 63.546 0.000284608 -3.53591 63.546000 Cu 0.582193 0.102868 0.5 766 63.546 0.000193056 -3.53266 63.546000 Cu 0.425719 0.148473 1.99628e-16 800 63.546 6.74809e-05 -3.53532 63.546000 Cu 0.473052 0.140014 0.5 802 63.546 0.000202944 -3.53564 63.546000 Cu 0.520448 0.131563 0 804 63.546 0.00031025 -3.53543 63.546000 Cu 0.567932 0.123123 0.5 806 63.546 0.000305072 -3.53398 63.546000 Cu 0.554116 0.143394 0.5 807 63.546 0.000147709 -3.53484 63.546000 Cu 0.601488 0.134943 4.78676e-17 805 63.546 0.00030375 -3.53425 63.546000 Cu 0.615515 0.114684 0 808 63.546 0.000326366 -3.53224 63.546000 Cu 0.696528 0.117995 9.15363e-17 809 63.546 0.00032865 -3.53542 63.546000 Cu 0.663189 0.106216 0.5 810 63.546 0.000157947 -3.53264 63.546000 Cu 0.648963 0.126477 0.5 811 63.546 0.000301647 -3.5341 63.546000 Cu 0.791759 0.101082 0 813 63.546 0.000521132 -3.53632 63.546000 Cu 0.744145 0.109515 0.5 815 63.546 0.000669211 -3.53719 63.546000 Cu 0.635212 0.146755 0.5 852 63.546 9.18767e-05 -3.53518 63.546000 Cu 0.682567 0.138283 2.05147e-17 854 63.546 0.000251297 -3.53588 63.546000 Cu 0.763594 0.141667 1.44323e-16 855 63.546 0.000206303 -3.53597 63.546000 Cu 0.729979 0.129815 0.5 856 63.546 0.000463725 -3.53657 63.546000 Cu 0.77746 0.121374 0 858 63.546 0.000396724 -3.53614 63.546000 Cu 0.858397 0.12483 1.52001e-16 628 63.546 0.00047203 -3.53289 63.546000 Cu 0.872622 0.104593 0 629 63.546 0.000717105 -3.53079 63.546000 Cu 0.95363 0.107934 0 630 63.546 0.000125809 -3.5349 63.546000 Cu 0.905967 0.1164 0.5 632 63.546 0.000355379 -3.53278 63.546000 Cu 0.925719 0.148473 2.79048e-16 656 63.546 6.74809e-05 -3.53532 63.546000 Cu 0.891983 0.136653 0.5 657 63.546 0.000283759 -3.53419 63.546000 Cu 0.939429 0.128199 2.24102e-16 659 63.546 0.000310451 -3.53486 63.546000 Cu 0.98697 0.119736 0.5 661 63.546 0.000284608 -3.53591 63.546000 Cu 0.973052 0.140014 0.5 662 63.546 0.000202944 -3.53564 63.546000 Cu 0.824999 0.112975 0.5 859 63.546 0.000246506 -3.53348 63.546000 Cu 0.810946 0.133242 0.5 860 63.546 0.000314025 -3.53473 63.546000 Cu 0.844628 0.145094 0 902 63.546 0.000171549 -3.53458 63.546000 Cu 0.00680977 0.151844 1.1613e-16 698 63.546 3.42197e-05 -3.53536 63.546000 Cu 0.0879092 0.155219 1.32566e-16 699 63.546 1.97974e-05 -3.53485 63.546000 Cu 0.0406231 0.163676 0.5 701 63.546 2.15573e-06 -3.53499 63.546000 Cu 0.0609029 0.195799 1.64717e-16 740 63.546 1.12304e-06 -3.53469 63.546000 Cu 0.0271251 0.183963 0.5 741 63.546 1.64155e-06 -3.53477 63.546000 Cu 0.0744304 0.175507 8.67375e-17 743 63.546 6.16683e-06 -3.5349 63.546000 Cu 0.15552 0.178875 1.10851e-16 744 63.546 1.17888e-05 -3.53528 63.546000 Cu 0.121729 0.167044 0.5 745 63.546 5.4973e-06 -3.53518 63.546000 Cu 0.108213 0.187339 0.5 746 63.546 2.051e-06 -3.53492 63.546000 Cu 0.169016 0.158577 4.12693e-17 747 63.546 2.56868e-05 -3.5357 63.546000 Cu 0.141983 0.199175 8.8777e-18 788 63.546 3.26013e-06 -3.53511 63.546000 Cu 0.189287 0.190716 0.5 790 63.546 8.26526e-06 -3.53525 63.546000 Cu 0.250085 0.161964 1.22128e-16 748 63.546 1.51405e-05 -3.53563 63.546000 Cu 0.216299 0.150114 0.5 749 63.546 0.000106674 -3.53614 63.546000 Cu 0.202813 0.170415 0.5 750 63.546 2.67038e-05 -3.53563 63.546000 Cu 0.297344 0.153526 0.5 754 63.546 3.04608e-05 -3.53515 63.546000 Cu 0.236586 0.182263 9.33358e-17 792 63.546 6.17481e-06 -3.53522 63.546000 Cu 0.317651 0.185664 1.21169e-16 793 63.546 9.5275e-06 -3.53452 63.546000 Cu 0.283873 0.173818 0.5 794 63.546 6.63753e-06 -3.53494 63.546000 Cu 0.27035 0.194112 0.5 795 63.546 1.79574e-06 -3.53488 63.546000 Cu 0.331149 0.165375 1.25727e-16 796 63.546 2.06547e-05 -3.5347 63.546000 Cu 0.378425 0.156928 0.5 798 63.546 2.83451e-05 -3.5349 63.546000 Cu 0.364947 0.177213 0.5 799 63.546 1.26963e-05 -3.53446 63.546000 Cu 0.351426 0.197502 0.5 840 63.546 5.01162e-06 -3.53469 63.546000 Cu 0.398731 0.189044 2.89125e-16 842 63.546 1.32957e-06 -3.53458 63.546000 Cu 0.41224 0.168757 1.1733e-16 797 63.546 3.21409e-06 -3.53491 63.546000 Cu 0.50681 0.151844 1.9339e-16 801 63.546 3.42197e-05 -3.53536 63.546000 Cu 0.459525 0.160298 0.5 803 63.546 3.40373e-06 -3.53535 63.546000 Cu 0.479818 0.192418 9.47754e-17 843 63.546 1.74988e-06 -3.53472 63.546000 Cu 0.446035 0.180586 0.5 844 63.546 2.25818e-06 -3.5348 63.546000 Cu 0.493335 0.172129 1.06532e-16 846 63.546 3.6999e-06 -3.535 63.546000 Cu 0.57443 0.175507 1.40484e-16 847 63.546 6.16683e-06 -3.5349 63.546000 Cu 0.540623 0.163676 0.5 848 63.546 2.15573e-06 -3.53499 63.546000 Cu 0.527125 0.183963 0.5 849 63.546 1.64155e-06 -3.53477 63.546000 Cu 0.587909 0.155219 1.28607e-16 850 63.546 1.97974e-05 -3.53485 63.546000 Cu 0.560903 0.195799 0 890 63.546 1.12304e-06 -3.53469 63.546000 Cu 0.669016 0.158577 1.1649e-16 851 63.546 2.56868e-05 -3.5357 63.546000 Cu 0.621729 0.167044 0.5 853 63.546 5.4973e-06 -3.53518 63.546000 Cu 0.716299 0.150114 0.5 857 63.546 0.000106674 -3.53614 63.546000 Cu 0.641983 0.199175 1.85832e-16 891 63.546 3.26013e-06 -3.53511 63.546000 Cu 0.608213 0.187339 0.5 892 63.546 2.051e-06 -3.53492 63.546000 Cu 0.65552 0.178875 1.70116e-16 894 63.546 1.17888e-05 -3.53528 63.546000 Cu 0.736586 0.182263 2.33819e-16 895 63.546 6.17481e-06 -3.53522 63.546000 Cu 0.702813 0.170415 0.5 896 63.546 2.67038e-05 -3.53563 63.546000 Cu 0.689287 0.190716 0.5 897 63.546 8.26526e-06 -3.53525 63.546000 Cu 0.750085 0.161964 9.70549e-17 898 63.546 1.51405e-05 -3.53563 63.546000 Cu 0.797344 0.153526 0.5 900 63.546 3.04608e-05 -3.53515 63.546000 Cu 0.783873 0.173818 0.5 901 63.546 6.63753e-06 -3.53494 63.546000 Cu 0.77035 0.194112 0.5 942 63.546 1.79574e-06 -3.53488 63.546000 Cu 0.878425 0.156928 0.5 658 63.546 2.83451e-05 -3.5349 63.546000 Cu 0.898731 0.189044 1.45762e-16 692 63.546 1.32957e-06 -3.53458 63.546000 Cu 0.864947 0.177213 0.5 693 63.546 1.26963e-05 -3.53446 63.546000 Cu 0.91224 0.168757 8.64976e-17 694 63.546 3.21409e-06 -3.53491 63.546000 Cu 0.993335 0.172129 1.1697e-16 695 63.546 3.6999e-06 -3.535 63.546000 Cu 0.959525 0.160298 0.5 696 63.546 3.40373e-06 -3.53535 63.546000 Cu 0.946035 0.180586 0.5 697 63.546 2.25818e-06 -3.5348 63.546000 Cu 0.979818 0.192418 2.44017e-16 739 63.546 1.74988e-06 -3.53472 63.546000 Cu 0.831149 0.165375 2.41018e-16 899 63.546 2.06547e-05 -3.5347 63.546000 Cu 0.817651 0.185664 3.851e-17 944 63.546 9.5275e-06 -3.53452 63.546000 Cu 0.851426 0.197502 0.5 945 63.546 5.01162e-06 -3.53469 63.546000 Cu 0.0135963 0.204255 0.5 742 63.546 1.14842e-06 -3.53468 63.546000 Cu 0.0338367 0.236398 1.01614e-16 781 63.546 5.21452e-07 -3.53523 63.546000 Cu 6.65297e-05 0.224553 0.5 782 63.546 1.3396e-06 -3.53511 63.546000 Cu 0.0473705 0.216095 9.96942e-17 784 63.546 9.86132e-07 -3.53491 63.546000 Cu 0.128448 0.219476 1.48641e-16 785 63.546 6.03017e-07 -3.53506 63.546000 Cu 0.0946758 0.207636 0.5 786 63.546 7.51635e-07 -3.53491 63.546000 Cu 0.0811427 0.227936 0.5 787 63.546 3.23518e-07 -3.53507 63.546000 Cu 0.175751 0.211017 0.5 791 63.546 2.43268e-06 -3.53515 63.546000 Cu 0.067604 0.248241 0.5 828 63.546 7.98358e-07 -3.53522 63.546000 Cu 0.114912 0.239778 9.30959e-17 830 63.546 5.4628e-07 -3.53499 63.546000 Cu 0.195992 0.243159 1.79354e-16 831 63.546 1.47537e-06 -3.5347 63.546000 Cu 0.162218 0.231318 0.5 832 63.546 1.07492e-06 -3.53483 63.546000 Cu 0.223051 0.202562 1.85232e-16 789 63.546 1.58778e-06 -3.5351 63.546000 Cu 0.20952 0.222862 7.80998e-17 834 63.546 8.19944e-07 -3.53485 63.546000 Cu 0.290598 0.226252 2.51575e-16 835 63.546 1.64291e-06 -3.53473 63.546000 Cu 0.25682 0.214409 0.5 836 63.546 9.27959e-07 -3.53487 63.546000 Cu 0.243295 0.234705 0.5 837 63.546 3.26364e-07 -3.5346 63.546000 Cu 0.304122 0.205957 3.31714e-16 838 63.546 4.53387e-06 -3.53484 63.546000 Cu 0.385208 0.209337 1.51761e-16 839 63.546 8.63698e-07 -3.53497 63.546000 Cu 0.337902 0.217797 0.5 841 63.546 2.50485e-06 -3.53492 63.546000 Cu 0.277078 0.246547 3.25956e-16 878 63.546 6.4285e-08 -3.53461 63.546000 Cu 0.32438 0.238093 0.5 880 63.546 9.99974e-07 -3.5347 63.546000 Cu 0.371684 0.229635 2.45696e-16 882 63.546 8.0301e-07 -3.53496 63.546000 Cu 0.35816 0.249933 1.22608e-16 879 63.546 5.37152e-07 -3.53469 63.546000 Cu 0.432513 0.200876 0.5 845 63.546 1.98946e-06 -3.5348 63.546000 Cu 0.452764 0.233014 4.15092e-17 883 63.546 1.10404e-06 -3.53521 63.546000 Cu 0.418989 0.221173 0.5 884 63.546 1.30553e-06 -3.53509 63.546000 Cu 0.405461 0.241475 0.5 885 63.546 8.85209e-07 -3.53497 63.546000 Cu 0.466293 0.212712 2.07786e-16 886 63.546 2.89712e-06 -3.53491 63.546000 Cu 0.54737 0.216095 1.48042e-16 887 63.546 9.86132e-07 -3.53491 63.546000 Cu 0.513596 0.204255 0.5 888 63.546 1.14842e-06 -3.53468 63.546000 Cu 0.500067 0.224553 0.5 889 63.546 1.3396e-06 -3.53511 63.546000 Cu 0.594676 0.207636 0.5 893 63.546 7.51635e-07 -3.53491 63.546000 Cu 0.486533 0.244859 0.5 930 63.546 2.2559e-07 -3.53524 63.546000 Cu 0.533837 0.236398 1.98669e-16 932 63.546 5.21452e-07 -3.53523 63.546000 Cu 0.581143 0.227936 0.5 934 63.546 3.23518e-07 -3.53507 63.546000 Cu 0.567604 0.248241 0.5 935 63.546 7.98358e-07 -3.53522 63.546000 Cu 0.614912 0.239778 1.5476e-16 933 63.546 5.4628e-07 -3.53499 63.546000 Cu 0.628448 0.219476 1.51401e-16 936 63.546 6.03017e-07 -3.53506 63.546000 Cu 0.70952 0.222862 1.10371e-16 937 63.546 8.19944e-07 -3.53485 63.546000 Cu 0.675751 0.211017 0.5 938 63.546 2.43268e-06 -3.53515 63.546000 Cu 0.662218 0.231318 0.5 939 63.546 1.07492e-06 -3.53483 63.546000 Cu 0.723051 0.202562 2.61292e-16 940 63.546 1.58778e-06 -3.5351 63.546000 Cu 0.75682 0.214409 0.5 943 63.546 9.27959e-07 -3.53487 63.546000 Cu 0.695992 0.243159 2.46656e-16 981 63.546 1.47537e-06 -3.5347 63.546000 Cu 0.777078 0.246547 8.8897e-17 982 63.546 6.4285e-08 -3.53461 63.546000 Cu 0.743295 0.234705 0.5 983 63.546 3.26364e-07 -3.5346 63.546000 Cu 0.790598 0.226252 6.46632e-17 985 63.546 1.64291e-06 -3.53473 63.546000 Cu 0.871684 0.229635 4.79876e-19 734 63.546 8.0301e-07 -3.53496 63.546000 Cu 0.885208 0.209337 1.48402e-16 735 63.546 8.63698e-07 -3.53497 63.546000 Cu 0.966293 0.212712 2.49655e-16 736 63.546 2.89712e-06 -3.53491 63.546000 Cu 0.932513 0.200876 0.5 737 63.546 1.98946e-06 -3.5348 63.546000 Cu 0.918989 0.221173 0.5 738 63.546 1.30553e-06 -3.53509 63.546000 Cu 0.905461 0.241475 0.5 778 63.546 8.85209e-07 -3.53497 63.546000 Cu 0.952764 0.233014 9.42956e-17 780 63.546 1.10404e-06 -3.53521 63.546000 Cu 0.986533 0.244859 0.5 783 63.546 2.2559e-07 -3.53524 63.546000 Cu 0.804122 0.205957 3.59907e-19 941 63.546 4.53387e-06 -3.53484 63.546000 Cu 0.837902 0.217797 0.5 986 63.546 2.50485e-06 -3.53492 63.546000 Cu 0.82438 0.238093 0.5 987 63.546 9.99974e-07 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63.546000 Cu 0.412175 0.293918 8.56578e-17 969 63.546 5.20544e-06 -3.53453 63.546000 Cu 0.493242 0.297318 8.69775e-17 970 63.546 1.69649e-05 -3.53538 63.546000 Cu 0.459473 0.285469 0.5 971 63.546 2.70241e-06 -3.53487 63.546000 Cu 0.506766 0.277012 3.78982e-16 973 63.546 5.82459e-06 -3.53516 63.546000 Cu 0.587838 0.280388 9.06965e-17 974 63.546 5.918e-06 -3.53535 63.546000 Cu 0.554065 0.268549 0.5 975 63.546 4.20271e-06 -3.53536 63.546000 Cu 0.540536 0.288857 0.5 976 63.546 1.63427e-05 -3.53554 63.546000 Cu 0.601373 0.260082 1.1433e-16 977 63.546 1.26332e-06 -3.53531 63.546000 Cu 0.682464 0.263457 1.38684e-16 978 63.546 2.98935e-06 -3.53493 63.546000 Cu 0.648684 0.251618 0.5 979 63.546 1.69806e-06 -3.53499 63.546000 Cu 0.63515 0.27192 0.5 980 63.546 2.40881e-06 -3.53516 63.546000 Cu 0.729773 0.255 0.5 984 63.546 1.02844e-06 -3.53472 63.546000 Cu 0.621622 0.292219 0.5 1020 63.546 5.09283e-06 -3.53468 63.546000 Cu 0.668936 0.283753 1.69876e-16 1022 63.546 9.49475e-06 -3.53451 63.546000 Cu 0.750025 0.287139 5.62654e-17 1023 63.546 1.68261e-06 -3.53504 63.546000 Cu 0.716249 0.275296 0.5 1024 63.546 5.32862e-06 -3.53473 63.546000 Cu 0.702721 0.295589 0.5 1025 63.546 1.91032e-05 -3.53454 63.546000 Cu 0.763556 0.266842 1.27767e-16 1026 63.546 9.08146e-07 -3.5348 63.546000 Cu 0.797329 0.278686 0.5 1029 63.546 4.82983e-07 -3.53515 63.546000 Cu 0.783793 0.298987 0.5 1069 63.546 6.34459e-06 -3.53554 63.546000 Cu 0.939233 0.253319 1.23088e-16 777 63.546 7.86337e-07 -3.53492 63.546000 Cu 0.891934 0.261775 0.5 779 63.546 6.09618e-07 -3.53472 63.546000 Cu 0.912175 0.293918 1.5584e-16 819 63.546 5.20544e-06 -3.53453 63.546000 Cu 0.878403 0.282075 0.5 820 63.546 1.00356e-06 -3.53485 63.546000 Cu 0.925705 0.273621 2.43537e-16 822 63.546 8.67763e-07 -3.53471 63.546000 Cu 0.973001 0.265165 0.5 824 63.546 1.63346e-06 -3.53488 63.546000 Cu 0.959473 0.285469 0.5 825 63.546 2.70241e-06 -3.53487 63.546000 Cu 0.993242 0.297318 2.46176e-16 866 63.546 1.69649e-05 -3.53538 63.546000 Cu 0.844632 0.270231 1.90511e-16 1027 63.546 2.06961e-07 -3.53492 63.546000 Cu 0.810858 0.258389 0.5 1028 63.546 4.4025e-07 -3.5347 63.546000 Cu 0.831098 0.290531 2.64411e-16 1071 63.546 1.28951e-06 -3.53519 63.546000 Cu 0.0743118 0.300693 1.18169e-16 867 63.546 1.76101e-05 -3.53522 63.546000 Cu 0.0270167 0.309164 0.5 869 63.546 5.7554e-05 -3.53559 63.546000 Cu 0.0472128 0.341295 1.85952e-16 909 63.546 0.000101685 -3.53585 63.546000 Cu 0.0134813 0.32947 0.5 910 63.546 0.000170304 -3.5357 63.546000 Cu 0.0607932 0.320994 1.62798e-16 912 63.546 4.17773e-05 -3.53484 63.546000 Cu 0.141897 0.32433 1.31006e-16 913 63.546 0.000136459 -3.53398 63.546000 Cu 0.108102 0.312513 0.5 914 63.546 1.06732e-05 -3.53414 63.546000 Cu 0.0945636 0.332802 0.5 915 63.546 4.27768e-05 -3.53401 63.546000 Cu 0.155414 0.304044 9.30959e-17 916 63.546 4.20019e-05 -3.53416 63.546000 Cu 0.189203 0.315882 0.5 919 63.546 4.2328e-05 -3.53484 63.546000 Cu 0.128339 0.344616 1.69756e-16 957 63.546 0.000305086 -3.53282 63.546000 Cu 0.175654 0.336177 0.5 959 63.546 5.57357e-05 -3.53438 63.546000 Cu 0.236496 0.307438 1.87032e-16 917 63.546 2.91017e-06 -3.53548 63.546000 Cu 0.209358 0.348048 1.23088e-16 958 63.546 0.000158197 -3.53606 63.546000 Cu 0.222955 0.32774 3.59907e-19 961 63.546 2.76061e-05 -3.53574 63.546000 Cu 0.304 0.331119 1.12891e-16 962 63.546 3.62837e-05 -3.53512 63.546000 Cu 0.270256 0.319288 0.5 963 63.546 4.94219e-05 -3.53576 63.546000 Cu 0.256664 0.339593 0.5 964 63.546 0.000178296 -3.53629 63.546000 Cu 0.317563 0.310827 6.15441e-17 965 63.546 1.29344e-05 -3.53501 63.546000 Cu 0.398657 0.314205 1.23088e-16 966 63.546 3.00513e-05 -3.53366 63.546000 Cu 0.36487 0.302369 0.5 967 63.546 7.73131e-06 -3.53443 63.546000 Cu 0.351343 0.322652 0.5 968 63.546 3.74753e-05 -3.53391 63.546000 Cu 0.337767 0.342925 0.5 1008 63.546 0.000134502 -3.53315 63.546000 Cu 0.385125 0.334476 1.22848e-16 1010 63.546 0.000164121 -3.53274 63.546000 Cu 0.445954 0.305766 0.5 972 63.546 6.17577e-06 -3.53459 63.546000 Cu 0.466183 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0.32433 1.34125e-16 1063 63.546 0.000136459 -3.53398 63.546000 Cu 0.722955 0.32774 0 1064 63.546 2.76061e-05 -3.53574 63.546000 Cu 0.689203 0.315882 0.5 1065 63.546 4.2328e-05 -3.53484 63.546000 Cu 0.675654 0.336177 0.5 1066 63.546 5.57357e-05 -3.53438 63.546000 Cu 0.736496 0.307438 1.33885e-16 1067 63.546 2.91017e-06 -3.53548 63.546000 Cu 0.770256 0.319288 0.5 1070 63.546 4.94219e-05 -3.53576 63.546000 Cu 0.709358 0.348048 9.47754e-17 1106 63.546 0.000158197 -3.53606 63.546000 Cu 0.756664 0.339593 0.5 1108 63.546 0.000178296 -3.53629 63.546000 Cu 0.999889 0.349786 0.5 911 63.546 0.000556438 -3.53782 63.546000 Cu 0.86487 0.302369 0.5 821 63.546 7.73131e-06 -3.53443 63.546000 Cu 0.885125 0.334476 1.68796e-16 861 63.546 0.000164121 -3.53274 63.546000 Cu 0.898657 0.314205 1.77674e-16 862 63.546 3.00513e-05 -3.53366 63.546000 Cu 0.979732 0.317619 6.41834e-17 863 63.546 4.295e-05 -3.53518 63.546000 Cu 0.945954 0.305766 0.5 864 63.546 6.17577e-06 -3.53459 63.546000 Cu 0.932442 0.32605 0.5 865 63.546 3.32164e-05 -3.53386 63.546000 Cu 0.918889 0.346327 0.5 906 63.546 0.000163483 -3.53323 63.546000 Cu 0.966183 0.337917 2.91285e-16 908 63.546 0.000107012 -3.53551 63.546000 Cu 0.817563 0.310827 2.55894e-16 1068 63.546 1.29344e-05 -3.53501 63.546000 Cu 0.804 0.331119 6.87422e-17 1110 63.546 3.62837e-05 -3.53512 63.546000 Cu 0.851343 0.322652 0.5 1111 63.546 3.74753e-05 -3.53391 63.546000 Cu 0.837767 0.342925 0.5 1112 63.546 0.000134502 -3.53315 63.546000 Cu 0.0203057 0.381951 6.25038e-17 950 63.546 0.00140816 -3.53961 63.546000 Cu 0.0336734 0.361613 2.16664e-16 953 63.546 0.000432167 -3.53754 63.546000 Cu 0.114871 0.364888 1.22968e-16 954 63.546 0.00103224 -3.53085 63.546000 Cu 0.0810021 0.353091 0.5 955 63.546 0.000179967 -3.53402 63.546000 Cu 0.0675823 0.373375 0.5 956 63.546 0.000560718 -3.53264 63.546000 Cu 0.162113 0.356469 0.5 960 63.546 0.000195845 -3.53329 63.546000 Cu 0.0543056 0.393645 0.5 996 63.546 0.00186381 -3.53151 63.546000 Cu 0.101604 0.385127 1.25487e-16 998 63.546 0.00381797 -3.52685 63.546000 Cu 0.182706 0.388712 2.24342e-16 999 63.546 0.00206967 -3.53958 63.546000 Cu 0.148794 0.376751 0.5 1000 63.546 0.000664455 -3.5318 63.546000 Cu 0.135682 0.397001 0.5 1001 63.546 0.00336446 -3.52655 63.546000 Cu 0.195923 0.36837 1.99988e-16 1002 63.546 0.000589255 -3.53759 63.546000 Cu 0.276985 0.371709 1.29207e-16 1003 63.546 0.000533704 -3.53709 63.546000 Cu 0.243117 0.359909 0.5 1004 63.546 0.000714075 -3.53854 63.546000 Cu 0.229769 0.380254 0.5 1005 63.546 0.00255132 -3.54161 63.546000 Cu 0.290412 0.35141 6.87422e-17 1006 63.546 0.000173644 -3.53575 63.546000 Cu 0.371595 0.354727 8.07391e-17 1007 63.546 0.000811213 -3.53089 63.546000 Cu 0.324277 0.363182 0.5 1009 63.546 0.000534788 -3.53203 63.546000 Cu 0.263705 0.392028 3.4683e-16 1047 63.546 0.00196272 -3.53983 63.546000 Cu 0.345135 0.39512 8.70974e-17 1048 63.546 0.0111619 -3.51963 63.546000 Cu 0.310989 0.383418 0.5 1049 63.546 0.00166371 -3.53033 63.546000 Cu 0.35827 0.37495 1.23448e-16 1051 63.546 0.00301816 -3.52706 63.546000 Cu 0.39229 0.386834 0.5 1054 63.546 0.00280909 -3.52808 63.546000 Cu 0.439323 0.378556 2.46176e-16 1052 63.546 0.00145553 -3.53834 63.546000 Cu 0.405479 0.366593 0.5 1053 63.546 0.000650642 -3.53148 63.546000 Cu 0.452651 0.358228 1.62078e-16 1055 63.546 0.000438528 -3.53671 63.546000 Cu 0.533673 0.361613 2.42337e-16 1056 63.546 0.000432167 -3.53754 63.546000 Cu 0.486436 0.370129 0.5 1058 63.546 0.00188159 -3.54055 63.546000 Cu 0.581002 0.353091 0.5 1062 63.546 0.000179967 -3.53402 63.546000 Cu 0.426148 0.398926 1.39524e-16 1094 63.546 0.00547084 -3.54138 63.546000 Cu 0.473131 0.390522 0.5 1096 63.546 0.00684878 -3.54579 63.546000 Cu 0.520306 0.381951 2.36699e-16 1098 63.546 0.00140816 -3.53961 63.546000 Cu 0.567582 0.373375 0.5 1100 63.546 0.000560718 -3.53264 63.546000 Cu 0.554306 0.393645 0.5 1101 63.546 0.00186381 -3.53151 63.546000 Cu 0.601604 0.385127 1.49841e-16 1099 63.546 0.00381797 -3.52685 63.546000 Cu 0.614871 0.364888 6.03444e-17 1102 63.546 0.00103224 -3.53085 63.546000 Cu 0.695923 0.36837 1.5332e-16 1103 63.546 0.000589255 -3.53759 63.546000 Cu 0.662113 0.356469 0.5 1104 63.546 0.000195845 -3.53329 63.546000 Cu 0.648794 0.376751 0.5 1105 63.546 0.000664455 -3.5318 63.546000 Cu 0.790412 0.35141 1.19969e-19 1107 63.546 0.000173644 -3.53575 63.546000 Cu 0.743117 0.359909 0.5 1109 63.546 0.000714075 -3.53854 63.546000 Cu 0.635682 0.397001 0.5 1135 63.546 0.00336446 -3.52655 63.546000 Cu 0.682706 0.388712 1.02933e-16 1137 63.546 0.00206967 -3.53958 63.546000 Cu 0.763705 0.392028 1.27407e-16 1138 63.546 0.00196272 -3.53983 63.546000 Cu 0.729769 0.380254 0.5 1139 63.546 0.00255132 -3.54161 63.546000 Cu 0.776985 0.371709 1.26927e-16 1141 63.546 0.000533704 -3.53709 63.546000 Cu 0.85827 0.37495 6.05843e-17 903 63.546 0.00301816 -3.52706 63.546000 Cu 0.871595 0.354727 2.29381e-16 904 63.546 0.000811213 -3.53089 63.546000 Cu 0.952651 0.358228 1.48761e-16 905 63.546 0.000438528 -3.53671 63.546000 Cu 0.905479 0.366593 0.5 907 63.546 0.000650642 -3.53148 63.546000 Cu 0.926148 0.398926 5.19465e-17 946 63.546 0.00547084 -3.54138 63.546000 Cu 0.89229 0.386834 0.5 947 63.546 0.00280909 -3.52808 63.546000 Cu 0.939323 0.378556 1.09052e-16 949 63.546 0.00145553 -3.53834 63.546000 Cu 0.986436 0.370129 0.5 951 63.546 0.00188159 -3.54055 63.546000 Cu 0.973131 0.390522 0.5 952 63.546 0.00684878 -3.54579 63.546000 Cu 0.824277 0.363182 0.5 1142 63.546 0.000534788 -3.53203 63.546000 Cu 0.810989 0.383418 0.5 1143 63.546 0.00166371 -3.53033 63.546000 Cu 0.845135 0.39512 1.04613e-16 1167 63.546 0.0111619 -3.51963 63.546000 Cu 0.00697274 0.402333 6.53831e-17 994 63.546 0.00549753 -3.54351 63.546000 Cu 0.0884633 0.405299 3.1024e-16 995 63.546 0.0152846 -3.5169 63.546000 Cu 0.0409868 0.413898 0.5 997 63.546 0.00548993 -3.52649 63.546000 Cu 0.0619577 0.445184 1.36765e-16 1036 63.546 0.230661 -3.45783 63.546000 Cu 0.0274192 0.434116 0.5 1037 63.546 0.0151 -3.51499 63.546000 Cu 0.0752287 0.425342 1.27887e-16 1039 63.546 0.0609459 -3.49544 63.546000 Cu 0.156236 0.429593 7.95394e-17 1040 63.546 0.043311 -3.54517 63.546000 Cu 0.12259 0.417165 0.5 1041 63.546 0.0205925 -3.5113 63.546000 Cu 0.10958 0.437156 0.5 1042 63.546 0.129548 -3.46758 63.546000 Cu 0.16953 0.409093 1.97829e-16 1043 63.546 0.0085219 -3.54272 63.546000 Cu 0.189298 0.441865 0.5 1084 63.546 0.135514 -3.56873 63.546000 Cu 0.250366 0.41239 7.19814e-19 1044 63.546 0.00783848 -3.54347 63.546000 Cu 0.216537 0.400651 0.5 1045 63.546 0.00960643 -3.54787 63.546000 Cu 0.203067 0.421153 0.5 1046 63.546 0.036684 -3.5573 63.546000 Cu 0.297808 0.403633 0.5 1050 63.546 0.00474577 -3.52682 63.546000 Cu 0.236732 0.432833 0 1086 63.546 0.026821 -3.545 63.546000 Cu 0.318753 0.435089 0 1087 63.546 0.148797 -3.47566 63.546000 Cu 0.284368 0.423815 0.5 1088 63.546 0.0118171 -3.52109 63.546000 Cu 0.270777 0.443976 0.5 1089 63.546 0.0260717 -3.50595 63.546000 Cu 0.332007 0.415184 2.43537e-17 1090 63.546 0.0425311 -3.50476 63.546000 Cu 0.379243 0.407029 0.5 1092 63.546 0.0127973 -3.51784 63.546000 Cu 0.366176 0.427098 0.5 1093 63.546 0.0676104 -3.48877 63.546000 Cu 0.353331 0.446859 0.5 1123 63.546 0.468168 -3.38656 63.546000 Cu 0.399634 0.440062 7.40208e-17 1125 63.546 0.143607 -3.53799 63.546000 Cu 0.412913 0.41938 6.1784e-17 1091 63.546 0.0246697 -3.54385 63.546000 Cu 0.506973 0.402333 6.5503e-17 1095 63.546 0.00549753 -3.54351 63.546000 Cu 0.459791 0.411003 0.5 1097 63.546 0.0244024 -3.55378 63.546000 Cu 0.479652 0.443358 7.76199e-17 1126 63.546 0.0578874 -3.54034 63.546000 Cu 0.446078 0.431642 0.5 1127 63.546 0.0873168 -3.5653 63.546000 Cu 0.493453 0.422785 2.10545e-16 1129 63.546 0.019348 -3.5463 63.546000 Cu 0.575229 0.425342 2.07546e-16 1130 63.546 0.0609459 -3.49544 63.546000 Cu 0.540987 0.413898 0.5 1131 63.546 0.00548993 -3.52649 63.546000 Cu 0.527419 0.434116 0.5 1132 63.546 0.0151 -3.51499 63.546000 Cu 0.588463 0.405299 1.58719e-16 1133 63.546 0.0152846 -3.5169 63.546000 Cu 0.561958 0.445184 3.4815e-16 1155 63.546 0.230661 -3.45783 63.546000 Cu 0.66953 0.409093 5.98645e-17 1134 63.546 0.0085219 -3.54272 63.546000 Cu 0.62259 0.417165 0.5 1136 63.546 0.0205925 -3.5113 63.546000 Cu 0.716537 0.400651 0.5 1140 63.546 0.00960643 -3.54787 63.546000 Cu 0.60958 0.437156 0.5 1157 63.546 0.129548 -3.46758 63.546000 Cu 0.656236 0.429593 3.06401e-16 1159 63.546 0.043311 -3.54517 63.546000 Cu 0.736732 0.432833 4.88273e-17 1160 63.546 0.026821 -3.545 63.546000 Cu 0.703067 0.421153 0.5 1161 63.546 0.036684 -3.5573 63.546000 Cu 0.689298 0.441865 0.5 1162 63.546 0.135514 -3.56873 63.546000 Cu 0.750366 0.41239 5.30263e-17 1163 63.546 0.00783848 -3.54347 63.546000 Cu 0.797808 0.403633 0.5 1165 63.546 0.00474577 -3.52682 63.546000 Cu 0.784368 0.423815 0.5 1166 63.546 0.0118171 -3.52109 63.546000 Cu 0.770777 0.443976 0.5 1179 63.546 0.0260717 -3.50595 63.546000 Cu 0.853331 0.446859 0.5 582 63.546 0.468168 -3.38656 63.546000 Cu 0.818753 0.435089 1.23448e-16 594 63.546 0.148797 -3.47566 63.546000 Cu 0.879243 0.407029 0.5 948 63.546 0.0127973 -3.51784 63.546000 Cu 0.899634 0.440062 5.99845e-19 988 63.546 0.143607 -3.53799 63.546000 Cu 0.866176 0.427098 0.5 989 63.546 0.0676104 -3.48877 63.546000 Cu 0.912913 0.41938 6.5743e-17 990 63.546 0.0246697 -3.54385 63.546000 Cu 0.993453 0.422785 3.59907e-19 991 63.546 0.019348 -3.5463 63.546000 Cu 0.959791 0.411003 0.5 992 63.546 0.0244024 -3.55378 63.546000 Cu 0.946078 0.431642 0.5 993 63.546 0.0873168 -3.5653 63.546000 Cu 0.979652 0.443358 1.28607e-16 1035 63.546 0.0578874 -3.54034 63.546000 Cu 0.832007 0.415184 1.57159e-16 1164 63.546 0.0425311 -3.50476 63.546000 Cu 0.143195 0.450459 2.57693e-16 1082 63.546 0.308708 -3.53034 63.546000 Cu 0.0137974 0.454316 0.5 1038 63.546 0.0428247 -3.49342 63.546000 Cu 0.0461412 0.484812 2.25062e-16 1075 63.546 2.38439 -3.38567 63.546000 Cu 0.00261616 0.474681 0.5 1076 63.546 0.475948 -3.50376 63.546000 Cu 0.0492046 0.464815 2.57213e-16 1078 63.546 1.01802 -3.39328 63.546000 Cu 0.132677 0.472789 2.21823e-16 1079 63.546 5.6965 -3.54639 63.546000 Cu 0.0970075 0.456722 0.5 1080 63.546 1.01685 -3.30174 63.546000 Cu 0.0845809 0.47525 0.5 1081 63.546 8.01388 -2.86399 63.546000 Cu 0.175337 0.463045 0.5 1085 63.546 0.627736 -3.61352 63.546000 Cu 0.0901716 0.493581 0.5 1113 63.546 6.48131 -3.01476 63.546000 Cu 0.137211 0.497779 9.47754e-17 1114 63.546 1.36447 -3.49859 63.546000 Cu 0.167711 0.4849 0.5 1116 63.546 2.67531 -3.75875 63.546000 Cu 0.00773102 0.49513 0.5 1077 63.546 0.139619 -3.4933 63.546000 Cu 0.216567 0.495222 3.59907e-19 1115 63.546 0.206987 -3.51293 63.546000 Cu 0.223088 0.453447 2.74729e-17 1083 63.546 0.0838224 -3.52999 63.546000 Cu 0.212972 0.474342 5.99845e-19 1117 63.546 0.256281 -3.53176 63.546000 Cu 0.295992 0.474559 0 1118 63.546 2.36434 -3.38484 63.546000 Cu 0.257666 0.464226 0.5 1119 63.546 0.127169 -3.49385 63.546000 Cu 0.252431 0.484684 0.5 1120 63.546 0.511787 -3.50291 63.546000 Cu 0.305445 0.454758 3.71904e-17 1121 63.546 0.562751 -3.4162 63.546000 Cu 0.387092 0.46159 2.86726e-17 1122 63.546 1.34122 -3.49713 63.546000 Cu 0.340137 0.465821 0.5 1124 63.546 6.41406 -3.01771 63.546000 Cu 0.299261 0.494563 5.26664e-17 1144 63.546 1.04443 -3.39231 63.546000 Cu 0.334415 0.484118 0.5 1146 63.546 8.087 -2.86161 63.546000 Cu 0.382675 0.486496 3.79102e-16 1147 63.546 5.75986 -3.55443 63.546000 Cu 0.431967 0.452646 0.5 1128 63.546 0.343792 -3.58287 63.546000 Cu 0.463091 0.485036 3.59907e-19 1148 63.546 0.247506 -3.53232 63.546000 Cu 0.417881 0.474452 0.5 1149 63.546 2.57884 -3.75579 63.546000 Cu 0.425398 0.496293 0.5 1150 63.546 0.658595 -3.6152 63.546000 Cu 0.466456 0.464161 1.30406e-16 1151 63.546 0.205267 -3.51535 63.546000 Cu 0.549205 0.464815 1.07972e-18 1152 63.546 1.01802 -3.39328 63.546000 Cu 0.513797 0.454316 0.5 1153 63.546 0.0428247 -3.49342 63.546000 Cu 0.502616 0.474681 0.5 1154 63.546 0.475948 -3.50376 63.546000 Cu 0.597007 0.456722 0.5 1158 63.546 1.01685 -3.30174 63.546000 Cu 0.507731 0.49513 0.5 1168 63.546 0.139619 -3.4933 63.546000 Cu 0.546141 0.484812 1 1169 63.546 2.38439 -3.38567 63.546000 Cu 0.584581 0.47525 0.5 1171 63.546 8.01388 -2.86399 63.546000 Cu 0.590172 0.493581 0.5 1172 63.546 6.48131 -3.01476 63.546000 Cu 0.643195 0.450459 3.19117e-17 1156 63.546 0.308708 -3.53034 63.546000 Cu 0.795992 0.474559 1.23088e-16 63 63.546 2.36434 -3.38484 63.546000 Cu 0.752431 0.484684 0.5 96 63.546 0.511787 -3.50291 63.546000 Cu 0.799261 0.494563 2.45456e-16 547 63.546 1.04443 -3.39231 63.546000 Cu 0.716567 0.495222 1.23088e-16 569 63.546 0.206987 -3.51293 63.546000 Cu 0.637211 0.497779 8.08591e-17 1170 63.546 1.36447 -3.49859 63.546000 Cu 0.632677 0.472789 0 1173 63.546 5.6965 -3.54639 63.546000 Cu 0.712972 0.474342 2.22782e-16 1174 63.546 0.256281 -3.53176 63.546000 Cu 0.675337 0.463045 0.5 1175 63.546 0.627736 -3.61352 63.546000 Cu 0.667711 0.4849 0.5 1176 63.546 2.67531 -3.75875 63.546000 Cu 0.723088 0.453447 5.48258e-17 1177 63.546 0.0838224 -3.52999 63.546000 Cu 0.757666 0.464226 0.5 1180 63.546 0.127169 -3.49385 63.546000 Cu 0.834415 0.484118 0.5 3 63.546 8.087 -2.86161 63.546000 Cu 0.840137 0.465821 0.5 14 63.546 6.41406 -3.01771 63.546000 Cu 0.882675 0.486496 2.45576e-16 1030 63.546 5.75986 -3.55443 63.546000 Cu 0.887092 0.46159 2.45816e-16 1031 63.546 1.34122 -3.49713 63.546000 Cu 0.966456 0.464161 5.62654e-17 1032 63.546 0.205267 -3.51535 63.546000 Cu 0.931967 0.452646 0.5 1033 63.546 0.343792 -3.58287 63.546000 Cu 0.917881 0.474452 0.5 1034 63.546 2.57884 -3.75579 63.546000 Cu 0.925398 0.496293 0.5 1073 63.546 0.658595 -3.6152 63.546000 Cu 0.963091 0.485036 3.68784e-16 1074 63.546 0.247506 -3.53232 63.546000 Cu 0.805445 0.454758 1.23328e-16 1178 63.546 0.562751 -3.4162 63.546000 Cu 0.055642 0.504605 7.19814e-19 1 63.546 0.562096 -3.41213 63.546000 Cu 0.103709 0.512504 0.5 2 63.546 0.471417 -3.38695 63.546000 Cu 0.0211498 0.515386 0.5 7 63.546 0.0271802 -3.50531 63.546000 Cu 0.069365 0.524255 0 9 63.546 0.142659 -3.47525 63.546000 Cu 0.0832877 0.544135 9.42956e-17 10 63.546 0.0381087 -3.5048 63.546000 Cu 0.117033 0.532245 0.5 11 63.546 0.0664333 -3.49091 63.546000 Cu 0.0353252 0.535531 0.5 12 63.546 0.011268 -3.51936 63.546000 Cu 0.00178418 0.546969 4.2469e-17 26 63.546 0.00791198 -3.54226 63.546000 Cu 0.150213 0.5193 7.27012e-17 97 63.546 0.145067 -3.54135 63.546000 Cu 0.182276 0.506724 0.5 98 63.546 0.345278 -3.5835 63.546000 Cu 0.164041 0.539979 4.79876e-19 139 63.546 0.0231234 -3.54541 63.546000 Cu 0.196858 0.527728 0.5 102 63.546 0.0858526 -3.56536 63.546000 Cu 0.312456 0.514182 3.59907e-19 60 63.546 0.22827 -3.4564 63.546000 Cu 0.347277 0.502649 0.5 61 63.546 1.04939 -3.30322 63.546000 Cu 0.264056 0.505056 0.5 62 63.546 0.0442506 -3.49236 63.546000 Cu 0.360198 0.522212 0.5 66 63.546 0.128944 -3.46899 63.546000 Cu 0.230186 0.516032 3.59907e-19 99 63.546 0.0542388 -3.53914 63.546000 Cu 0.24447 0.53658 0 100 63.546 0.0195882 -3.54481 63.546000 Cu 0.27814 0.525254 0.5 101 63.546 0.0147083 -3.51381 63.546000 Cu 0.326189 0.534023 3.59907e-19 103 63.546 0.0594421 -3.49578 63.546000 Cu 0.373862 0.542211 0.5 105 63.546 0.021541 -3.51337 63.546000 Cu 0.292378 0.545445 0.5 106 63.546 0.00483136 -3.5249 63.546000 Cu 0.211298 0.548351 0.5 141 63.546 0.022821 -3.55333 63.546000 Cu 0.393547 0.508905 1.19969e-19 1145 63.546 0.315261 -3.52959 63.546000 Cu 0.473336 0.505934 3.59907e-19 33 63.546 0.0840185 -3.52869 63.546000 Cu 0.555642 0.504605 4.79876e-19 34 63.546 0.562096 -3.41213 63.546000 Cu 0.569365 0.524255 5.74651e-17 35 63.546 0.142659 -3.47525 63.546000 Cu 0.52115 0.515386 0.5 37 63.546 0.0271802 -3.50531 63.546000 Cu 0.407038 0.529801 0 64 63.546 0.0405368 -3.54736 63.546000 Cu 0.43976 0.517515 0.5 65 63.546 0.135043 -3.56897 63.546000 Cu 0.487416 0.526548 3.59907e-19 67 63.546 0.0263208 -3.544 63.546000 Cu 0.501784 0.546969 0 68 63.546 0.00791198 -3.54226 63.546000 Cu 0.535325 0.535531 0.5 69 63.546 0.011268 -3.51936 63.546000 Cu 0.454152 0.538234 0.5 70 63.546 0.0342975 -3.55691 63.546000 Cu 0.583288 0.544135 0 71 63.546 0.0381087 -3.5048 63.546000 Cu 0.730186 0.516032 2.45336e-16 15 63.546 0.0542388 -3.53914 63.546000 Cu 0.764056 0.505056 0.5 16 63.546 0.0442506 -3.49236 63.546000 Cu 0.682276 0.506724 0.5 17 63.546 0.345278 -3.5835 63.546000 Cu 0.77814 0.525254 0.5 21 63.546 0.0147083 -3.51381 63.546000 Cu 0.603709 0.512504 0.5 36 63.546 0.471417 -3.38695 63.546000 Cu 0.650213 0.5193 5.29063e-17 38 63.546 0.145067 -3.54135 63.546000 Cu 0.664041 0.539979 2.96323e-17 39 63.546 0.0231234 -3.54541 63.546000 Cu 0.696858 0.527728 0.5 40 63.546 0.0858526 -3.56536 63.546000 Cu 0.617033 0.532245 0.5 41 63.546 0.0664333 -3.49091 63.546000 Cu 0.74447 0.53658 1.22368e-16 42 63.546 0.0195882 -3.54481 63.546000 Cu 0.792378 0.545445 0.5 44 63.546 0.00483136 -3.5249 63.546000 Cu 0.711298 0.548351 0.5 45 63.546 0.022821 -3.55333 63.546000 Cu 0.847277 0.502649 0.5 4 63.546 1.04939 -3.30322 63.546000 Cu 0.973336 0.505934 3.59907e-19 5 63.546 0.0840185 -3.52869 63.546000 Cu 0.987416 0.526548 1.37244e-16 6 63.546 0.0263208 -3.544 63.546000 Cu 0.93976 0.517515 0.5 8 63.546 0.135043 -3.56897 63.546000 Cu 0.812456 0.514182 2.45336e-16 18 63.546 0.22827 -3.4564 63.546000 Cu 0.826189 0.534023 2.45096e-16 19 63.546 0.0594421 -3.49578 63.546000 Cu 0.860198 0.522212 0.5 20 63.546 0.128944 -3.46899 63.546000 Cu 0.907038 0.529801 0 22 63.546 0.0405368 -3.54736 63.546000 Cu 0.954152 0.538234 0.5 24 63.546 0.0342975 -3.55691 63.546000 Cu 0.873862 0.542211 0.5 25 63.546 0.021541 -3.51337 63.546000 Cu 0.893547 0.508905 1.22728e-16 1072 63.546 0.315261 -3.52959 63.546000 Cu 0.130965 0.552294 0.5 13 63.546 0.0117887 -3.51888 63.546000 Cu 0.0164005 0.567274 3.59907e-19 27 63.546 0.00240264 -3.53768 63.546000 Cu 0.0497265 0.555679 0.5 28 63.546 0.00338092 -3.52596 63.546000 Cu 0.097591 0.564188 1.96749e-17 30 63.546 0.0112454 -3.51968 63.546000 Cu 0.112121 0.584337 0 31 63.546 0.00374757 -3.52786 63.546000 Cu 0.0642872 0.575861 0.5 32 63.546 0.00123645 -3.52893 63.546000 Cu 0.0310807 0.587559 2.39938e-19 54 63.546 0.000669033 -3.53556 63.546000 Cu 0.0789259 0.59608 0.5 56 63.546 0.0006441 -3.53192 63.546000 Cu 0.178361 0.560404 3.53908e-17 140 63.546 0.004991 -3.54068 63.546000 Cu 0.145313 0.572453 0.5 181 63.546 0.00210272 -3.52803 63.546000 Cu 0.192956 0.580728 7.05417e-17 182 63.546 0.00173136 -3.53816 63.546000 Cu 0.15993 0.592657 0.5 185 63.546 0.000354739 -3.53205 63.546000 Cu 0.340231 0.55405 8.38583e-17 104 63.546 0.0149255 -3.51626 63.546000 Cu 0.387944 0.562356 0.5 110 63.546 0.00382261 -3.52634 63.546000 Cu 0.258988 0.556998 5.45859e-17 142 63.546 0.0058066 -3.54148 63.546000 Cu 0.273661 0.577355 0 143 63.546 0.00150624 -3.5382 63.546000 Cu 0.306817 0.565678 0.5 144 63.546 0.00187174 -3.52884 63.546000 Cu 0.225933 0.568796 0.5 145 63.546 0.00613407 -3.54441 63.546000 Cu 0.35471 0.574191 1.08932e-16 146 63.546 0.00378426 -3.52548 63.546000 Cu 0.369461 0.594372 1.07372e-16 147 63.546 0.000735459 -3.52896 63.546000 Cu 0.321563 0.585912 0.5 149 63.546 0.000578477 -3.53197 63.546000 Cu 0.240704 0.589163 0.5 184 63.546 0.0011913 -3.53951 63.546000 Cu 0.288495 0.597667 2.23142e-17 186 63.546 0.000226856 -3.53643 63.546000 Cu 0.549726 0.555679 0.5 74 63.546 0.00338092 -3.52596 63.546000 Cu 0.421118 0.550289 7.51005e-17 107 63.546 0.00737906 -3.5434 63.546000 Cu 0.435591 0.570629 5.66253e-17 108 63.546 0.00144266 -3.53887 63.546000 Cu 0.468592 0.558714 0.5 109 63.546 0.00808704 -3.54758 63.546000 Cu 0.5164 0.567274 0 111 63.546 0.00240264 -3.53768 63.546000 Cu 0.531081 0.587559 0 112 63.546 0.000669033 -3.53556 63.546000 Cu 0.564287 0.575861 0.5 113 63.546 0.00123645 -3.52893 63.546000 Cu 0.483364 0.579046 0.5 114 63.546 0.00208524 -3.53987 63.546000 Cu 0.578926 0.59608 0.5 118 63.546 0.0006441 -3.53192 63.546000 Cu 0.402585 0.582541 0.5 148 63.546 0.000624413 -3.53056 63.546000 Cu 0.450287 0.59091 2.80727e-17 150 63.546 0.000353132 -3.53586 63.546000 Cu 0.49802 0.599349 0.5 152 63.546 0.000498563 -3.53673 63.546000 Cu 0.597591 0.564188 0 72 63.546 0.0112454 -3.51968 63.546000 Cu 0.758988 0.556998 3.43111e-17 43 63.546 0.0058066 -3.54148 63.546000 Cu 0.630965 0.552294 0.5 73 63.546 0.0117887 -3.51888 63.546000 Cu 0.678361 0.560404 1.81993e-16 75 63.546 0.004991 -3.54068 63.546000 Cu 0.692956 0.580728 3.89899e-17 76 63.546 0.00173136 -3.53816 63.546000 Cu 0.725933 0.568796 0.5 77 63.546 0.00613407 -3.54441 63.546000 Cu 0.645313 0.572453 0.5 78 63.546 0.00210272 -3.52803 63.546000 Cu 0.773661 0.577355 3.69504e-17 79 63.546 0.00150624 -3.5382 63.546000 Cu 0.788495 0.597667 8.66176e-17 80 63.546 0.000226856 -3.53643 63.546000 Cu 0.740704 0.589163 0.5 82 63.546 0.0011913 -3.53951 63.546000 Cu 0.612121 0.584337 1.84512e-16 115 63.546 0.00374757 -3.52786 63.546000 Cu 0.65993 0.592657 0.5 117 63.546 0.000354739 -3.53205 63.546000 Cu 0.99802 0.599349 0.5 57 63.546 0.000498563 -3.53673 63.546000 Cu 0.921118 0.550289 1.71556e-17 23 63.546 0.00737906 -3.5434 63.546000 Cu 0.968592 0.558714 0.5 29 63.546 0.00808704 -3.54758 63.546000 Cu 0.840231 0.55405 0 46 63.546 0.0149255 -3.51626 63.546000 Cu 0.85471 0.574191 6.77824e-17 47 63.546 0.00378426 -3.52548 63.546000 Cu 0.887944 0.562356 0.5 48 63.546 0.00382261 -3.52634 63.546000 Cu 0.806817 0.565678 0.5 49 63.546 0.00187174 -3.52884 63.546000 Cu 0.935591 0.570629 1.89071e-16 50 63.546 0.00144266 -3.53887 63.546000 Cu 0.950287 0.59091 5.51857e-18 51 63.546 0.000353132 -3.53586 63.546000 Cu 0.983364 0.579046 0.5 52 63.546 0.00208524 -3.53987 63.546000 Cu 0.902585 0.582541 0.5 53 63.546 0.000624413 -3.53056 63.546000 Cu 0.821563 0.585912 0.5 81 63.546 0.000578477 -3.53197 63.546000 Cu 0.869461 0.594372 1.75874e-16 83 63.546 0.000735459 -3.52896 63.546000 Cu 0.0458559 0.607829 0 55 63.546 0.000243851 -3.53503 63.546000 Cu 0.126861 0.604518 1.38444e-16 58 63.546 0.00107223 -3.53068 63.546000 Cu 0.0936752 0.616307 0.5 59 63.546 0.000493394 -3.53197 63.546000 Cu 0.0126928 0.619631 0.5 89 63.546 0.000440932 -3.53606 63.546000 Cu 0.0603367 0.628093 7.76199e-17 91 63.546 0.000447798 -3.53521 63.546000 Cu 0.0742471 0.648377 7.714e-17 92 63.546 0.000246228 -3.53523 63.546000 Cu 0.10789 0.636557 0.5 93 63.546 0.000410359 -3.53426 63.546000 Cu 0.0268422 0.63992 0.5 94 63.546 0.000338677 -3.53635 63.546000 Cu 0.141356 0.624754 8.70974e-17 223 63.546 0.000636178 -3.53218 63.546000 Cu 0.174589 0.612906 0.5 224 63.546 0.000315026 -3.53349 63.546000 Cu 0.188919 0.633197 0.5 228 63.546 0.000689364 -3.5356 63.546000 Cu 0.155339 0.645029 8.80572e-17 266 63.546 0.000425478 -3.53468 63.546000 Cu 0.207678 0.601013 1.35565e-16 183 63.546 0.000859364 -3.53634 63.546000 Cu 0.303113 0.617946 9.11764e-18 187 63.546 0.000246153 -3.53455 63.546000 Cu 0.336306 0.606151 0.5 188 63.546 0.000193333 -3.532 63.546000 Cu 0.255372 0.609474 0.5 189 63.546 0.00032492 -3.53719 63.546000 Cu 0.384097 0.614589 3.67105e-17 190 63.546 0.000294185 -3.53131 63.546000 Cu 0.398357 0.634844 1.84032e-16 191 63.546 0.000385706 -3.53468 63.546000 Cu 0.350798 0.62639 0.5 193 63.546 0.000407548 -3.53297 63.546000 Cu 0.222198 0.621322 2.34299e-16 225 63.546 0.000251291 -3.53678 63.546000 Cu 0.236351 0.641634 4.99071e-17 226 63.546 0.000448548 -3.53605 63.546000 Cu 0.269801 0.629765 0.5 227 63.546 0.000459395 -3.53599 63.546000 Cu 0.317325 0.638211 1.95549e-16 229 63.546 0.000449434 -3.53489 63.546000 Cu 0.364748 0.64667 0.5 231 63.546 0.00025604 -3.53593 63.546000 Cu 0.464998 0.611185 1.34725e-16 151 63.546 0.000272823 -3.5352 63.546000 Cu 0.417216 0.602769 0.5 153 63.546 0.000108614 -3.53153 63.546000 Cu 0.545856 0.607829 1.39644e-16 154 63.546 0.000243851 -3.53503 63.546000 Cu 0.560337 0.628093 1.40244e-16 155 63.546 0.000447798 -3.53521 63.546000 Cu 0.593675 0.616307 0.5 156 63.546 0.000493394 -3.53197 63.546000 Cu 0.512693 0.619631 0.5 157 63.546 0.000440932 -3.53606 63.546000 Cu 0.431789 0.623021 0.5 192 63.546 0.00045437 -3.53408 63.546000 Cu 0.479347 0.631464 2.26141e-16 194 63.546 0.000346403 -3.53595 63.546000 Cu 0.526842 0.63992 0.5 196 63.546 0.000338677 -3.53635 63.546000 Cu 0.445814 0.643306 0.5 197 63.546 0.00031424 -3.53578 63.546000 Cu 0.574247 0.648377 3.59907e-19 198 63.546 0.000246228 -3.53523 63.546000 Cu 0.626861 0.604518 1.11571e-16 116 63.546 0.00107223 -3.53068 63.546000 Cu 0.707678 0.601013 1.9315e-17 119 63.546 0.000859364 -3.53634 63.546000 Cu 0.722198 0.621322 3.4791e-17 120 63.546 0.000251291 -3.53678 63.546000 Cu 0.755372 0.609474 0.5 121 63.546 0.00032492 -3.53719 63.546000 Cu 0.674589 0.612906 0.5 122 63.546 0.000315026 -3.53349 63.546000 Cu 0.769801 0.629765 0.5 126 63.546 0.000459395 -3.53599 63.546000 Cu 0.641356 0.624754 1.24768e-17 158 63.546 0.000636178 -3.53218 63.546000 Cu 0.655339 0.645029 4.79876e-19 159 63.546 0.000425478 -3.53468 63.546000 Cu 0.688919 0.633197 0.5 160 63.546 0.000689364 -3.5356 63.546000 Cu 0.60789 0.636557 0.5 161 63.546 0.000410359 -3.53426 63.546000 Cu 0.736351 0.641634 5.97445e-17 162 63.546 0.000448548 -3.53605 63.546000 Cu 0.884097 0.614589 1.19489e-16 84 63.546 0.000294185 -3.53131 63.546000 Cu 0.917216 0.602769 0.5 85 63.546 0.000108614 -3.53153 63.546000 Cu 0.836306 0.606151 0.5 86 63.546 0.000193333 -3.532 63.546000 Cu 0.964998 0.611185 3.4791e-18 87 63.546 0.000272823 -3.5352 63.546000 Cu 0.979347 0.631464 1.05693e-16 88 63.546 0.000346403 -3.53595 63.546000 Cu 0.931789 0.623021 0.5 90 63.546 0.00045437 -3.53408 63.546000 Cu 0.803113 0.617946 1.03533e-16 123 63.546 0.000246153 -3.53455 63.546000 Cu 0.817325 0.638211 1.5428e-16 124 63.546 0.000449434 -3.53489 63.546000 Cu 0.850798 0.62639 0.5 125 63.546 0.000407548 -3.53297 63.546000 Cu 0.898357 0.634844 2.39938e-19 127 63.546 0.000385706 -3.53468 63.546000 Cu 0.945814 0.643306 0.5 129 63.546 0.00031424 -3.53578 63.546000 Cu 0.864748 0.64667 0.5 130 63.546 0.00025604 -3.53593 63.546000 Cu 0.121546 0.656841 0.5 95 63.546 6.81145e-05 -3.53473 63.546000 Cu 0.00665756 0.672051 2.63932e-17 132 63.546 1.13092e-05 -3.53464 63.546000 Cu 0.0404758 0.660209 0.5 133 63.546 5.04546e-05 -3.53475 63.546000 Cu 0.0877387 0.668673 1.07372e-16 135 63.546 1.33919e-05 -3.5349 63.546000 Cu 0.101242 0.688985 8.97368e-17 136 63.546 2.37663e-06 -3.53541 63.546000 Cu 0.13501 0.677144 0.5 137 63.546 1.51428e-05 -3.535 63.546000 Cu 0.0539456 0.680509 0.5 138 63.546 2.65778e-05 -3.53499 63.546000 Cu 0.0201663 0.692354 2.46176e-16 174 63.546 2.87961e-05 -3.53477 63.546000 Cu 0.168814 0.665315 1.43963e-17 267 63.546 2.7435e-05 -3.53444 63.546000 Cu 0.182299 0.68561 1.25368e-16 308 63.546 2.88782e-05 -3.53458 63.546000 Cu 0.148546 0.697458 0.5 311 63.546 2.10074e-05 -3.53518 63.546000 Cu 0.331001 0.65851 8.90169e-17 230 63.546 9.76701e-05 -3.5362 63.546000 Cu 0.283699 0.650062 0.5 232 63.546 0.00021261 -3.53571 63.546000 Cu 0.378284 0.66698 0.5 236 63.546 3.16723e-06 -3.53594 63.546000 Cu 0.202665 0.65349 0.5 268 63.546 0.000288448 -3.53467 63.546000 Cu 0.249943 0.661929 1.08932e-16 269 63.546 6.76975e-05 -3.53492 63.546000 Cu 0.263412 0.682219 7.64202e-17 270 63.546 8.23669e-06 -3.5347 63.546000 Cu 0.297214 0.670365 0.5 271 63.546 2.82593e-05 -3.53548 63.546000 Cu 0.216101 0.673774 0.5 272 63.546 4.57385e-05 -3.53423 63.546000 Cu 0.344502 0.678823 6.28637e-17 273 63.546 1.19733e-05 -3.53567 63.546000 Cu 0.358028 0.699139 0 274 63.546 2.16345e-06 -3.53555 63.546000 Cu 0.391798 0.687293 0.5 275 63.546 6.80435e-06 -3.53534 63.546000 Cu 0.310722 0.690671 0.5 276 63.546 1.33133e-05 -3.5353 63.546000 Cu 0.229618 0.694066 0.5 310 63.546 7.25064e-06 -3.53427 63.546000 Cu 0.493177 0.651758 6.59829e-17 195 63.546 0.000163659 -3.53542 63.546000 Cu 0.587739 0.668673 3.59907e-19 199 63.546 1.33919e-05 -3.5349 63.546000 Cu 0.540476 0.660209 0.5 201 63.546 5.04546e-05 -3.53475 63.546000 Cu 0.412086 0.655141 1.532e-16 233 63.546 8.17046e-05 -3.53609 63.546000 Cu 0.425568 0.675447 0 234 63.546 1.99954e-05 -3.53489 63.546000 Cu 0.459374 0.663601 0.5 235 63.546 1.10707e-05 -3.53517 63.546000 Cu 0.506658 0.672051 4.79876e-18 237 63.546 1.13092e-05 -3.53464 63.546000 Cu 0.520166 0.692354 1.71915e-16 238 63.546 2.87961e-05 -3.53477 63.546000 Cu 0.553946 0.680509 0.5 239 63.546 2.65778e-05 -3.53499 63.546000 Cu 0.472864 0.683899 0.5 240 63.546 8.95742e-06 -3.53448 63.546000 Cu 0.439104 0.695755 6.87422e-17 277 63.546 8.37112e-06 -3.53505 63.546000 Cu 0.749943 0.661929 1.24888e-16 163 63.546 6.76975e-05 -3.53492 63.546000 Cu 0.783699 0.650062 0.5 164 63.546 0.00021261 -3.53571 63.546000 Cu 0.702665 0.65349 0.5 165 63.546 0.000288448 -3.53467 63.546000 Cu 0.797214 0.670365 0.5 169 63.546 2.82593e-05 -3.53548 63.546000 Cu 0.621546 0.656841 0.5 200 63.546 6.81145e-05 -3.53473 63.546000 Cu 0.668814 0.665315 0 202 63.546 2.7435e-05 -3.53444 63.546000 Cu 0.682299 0.68561 0 203 63.546 2.88782e-05 -3.53458 63.546000 Cu 0.716101 0.673774 0.5 204 63.546 4.57385e-05 -3.53423 63.546000 Cu 0.63501 0.677144 0.5 205 63.546 1.51428e-05 -3.535 63.546000 Cu 0.763412 0.682219 9.00967e-17 206 63.546 8.23669e-06 -3.5347 63.546000 Cu 0.729618 0.694066 0.5 209 63.546 7.25064e-06 -3.53427 63.546000 Cu 0.601242 0.688985 2.17144e-17 241 63.546 2.37663e-06 -3.53541 63.546000 Cu 0.648546 0.697458 0.5 243 63.546 2.10074e-05 -3.53518 63.546000 Cu 0.912086 0.655141 1.77194e-16 128 63.546 8.17046e-05 -3.53609 63.546000 Cu 0.993177 0.651758 1.42283e-16 131 63.546 0.000163659 -3.53542 63.546000 Cu 0.959374 0.663601 0.5 134 63.546 1.10707e-05 -3.53517 63.546000 Cu 0.831001 0.65851 1.21169e-17 166 63.546 9.76701e-05 -3.5362 63.546000 Cu 0.844502 0.678823 1.40604e-16 167 63.546 1.19733e-05 -3.53567 63.546000 Cu 0.878284 0.66698 0.5 168 63.546 3.16723e-06 -3.53594 63.546000 Cu 0.925568 0.675447 0 170 63.546 1.99954e-05 -3.53489 63.546000 Cu 0.939104 0.695755 5.99845e-19 171 63.546 8.37112e-06 -3.53505 63.546000 Cu 0.972864 0.683899 0.5 172 63.546 8.95742e-06 -3.53448 63.546000 Cu 0.891798 0.687293 0.5 173 63.546 6.80435e-06 -3.53534 63.546000 Cu 0.810722 0.690671 0.5 208 63.546 1.33133e-05 -3.5353 63.546000 Cu 0.858028 0.699139 4.31888e-17 210 63.546 2.16345e-06 -3.53555 63.546000 Cu 0.0336982 0.712667 1.86792e-16 175 63.546 2.8416e-05 -3.53511 63.546000 Cu 0.0674687 0.700823 0.5 176 63.546 1.0338e-05 -3.53505 63.546000 Cu 0.114778 0.7093 4.45085e-17 178 63.546 5.79424e-06 -3.53529 63.546000 Cu 0.128316 0.729616 5.19465e-17 179 63.546 8.07793e-06 -3.53573 63.546000 Cu 0.0809992 0.72114 0.5 180 63.546 6.69455e-06 -3.53559 63.546000 Cu 0.0472284 0.732988 8.67375e-17 218 63.546 1.03554e-05 -3.53552 63.546000 Cu 0.09454 0.741459 0.5 220 63.546 4.91781e-06 -3.53531 63.546000 Cu 0.0134645 0.744841 0.5 221 63.546 1.77914e-06 -3.53497 63.546000 Cu 0.19586 0.705916 1.36405e-16 309 63.546 6.86659e-06 -3.53473 63.546000 Cu 0.162096 0.71777 0.5 350 63.546 2.55815e-05 -3.53552 63.546000 Cu 0.175637 0.738084 0.5 354 63.546 2.4582e-05 -3.53534 63.546000 Cu 0.141858 0.749927 1.31126e-16 392 63.546 1.02251e-05 -3.53443 63.546000 Cu 0.276937 0.702516 3.52709e-17 312 63.546 1.55815e-05 -3.53429 63.546000 Cu 0.290479 0.722823 4.00696e-17 313 63.546 2.78006e-05 -3.53478 63.546000 Cu 0.324249 0.71098 0.5 314 63.546 6.39075e-06 -3.53465 63.546000 Cu 0.243172 0.714366 0.5 315 63.546 1.26983e-05 -3.53457 63.546000 Cu 0.371557 0.719451 1.35445e-16 316 63.546 3.503e-06 -3.53459 63.546000 Cu 0.385091 0.739761 0 317 63.546 8.46748e-07 -3.53477 63.546000 Cu 0.337784 0.73129 0.5 319 63.546 9.33461e-06 -3.53482 63.546000 Cu 0.209412 0.726227 4.90673e-17 351 63.546 6.25637e-06 -3.53557 63.546000 Cu 0.222946 0.74654 0 352 63.546 1.20947e-05 -3.53487 63.546000 Cu 0.256716 0.73468 0.5 353 63.546 5.01218e-06 -3.53554 63.546000 Cu 0.304015 0.743138 2.39938e-19 355 63.546 1.2012e-05 -3.53541 63.546000 Cu 0.567469 0.700823 0.5 244 63.546 1.0338e-05 -3.53505 63.546000 Cu 0.452638 0.716068 4.15092e-17 278 63.546 7.54707e-06 -3.5349 63.546000 Cu 0.486405 0.704208 0.5 279 63.546 7.21973e-06 -3.53487 63.546000 Cu 0.405337 0.707609 0.5 280 63.546 2.21393e-05 -3.53525 63.546000 Cu 0.533698 0.712667 6.23838e-18 281 63.546 2.8416e-05 -3.53511 63.546000 Cu 0.547228 0.732988 2.18343e-17 282 63.546 1.03554e-05 -3.53552 63.546000 Cu 0.580999 0.72114 0.5 283 63.546 6.69455e-06 -3.53559 63.546000 Cu 0.499932 0.724524 0.5 284 63.546 3.62858e-06 -3.53511 63.546000 Cu 0.59454 0.741459 0.5 288 63.546 4.91781e-06 -3.53531 63.546000 Cu 0.418865 0.727919 0.5 318 63.546 1.30383e-05 -3.53442 63.546000 Cu 0.466165 0.73638 6.81423e-17 320 63.546 3.31863e-06 -3.53465 63.546000 Cu 0.513465 0.744841 0.5 322 63.546 1.77914e-06 -3.53497 63.546000 Cu 0.432397 0.74823 0.5 323 63.546 4.46145e-06 -3.53489 63.546000 Cu 0.776937 0.702516 9.81346e-17 207 63.546 1.55815e-05 -3.53429 63.546000 Cu 0.614778 0.7093 8.00193e-17 242 63.546 5.79424e-06 -3.53529 63.546000 Cu 0.69586 0.705916 3.61106e-17 245 63.546 6.86659e-06 -3.53473 63.546000 Cu 0.709412 0.726227 0 246 63.546 6.25637e-06 -3.53557 63.546000 Cu 0.743172 0.714366 0.5 247 63.546 1.26983e-05 -3.53457 63.546000 Cu 0.662096 0.71777 0.5 248 63.546 2.55815e-05 -3.53552 63.546000 Cu 0.790479 0.722823 0 249 63.546 2.78006e-05 -3.53478 63.546000 Cu 0.756716 0.73468 0.5 252 63.546 5.01218e-06 -3.53554 63.546000 Cu 0.628316 0.729616 0 285 63.546 8.07793e-06 -3.53573 63.546000 Cu 0.641858 0.749927 3.22716e-17 286 63.546 1.02251e-05 -3.53443 63.546000 Cu 0.675637 0.738084 0.5 287 63.546 2.4582e-05 -3.53534 63.546000 Cu 0.722946 0.74654 0 289 63.546 1.20947e-05 -3.53487 63.546000 Cu 0.999932 0.724524 0.5 216 63.546 3.62858e-06 -3.53511 63.546000 Cu 0.986405 0.704208 0.5 177 63.546 7.21973e-06 -3.53487 63.546000 Cu 0.871557 0.719451 1.63878e-16 211 63.546 3.503e-06 -3.53459 63.546000 Cu 0.905337 0.707609 0.5 212 63.546 2.21393e-05 -3.53525 63.546000 Cu 0.824249 0.71098 0.5 213 63.546 6.39075e-06 -3.53465 63.546000 Cu 0.952638 0.716068 5.14667e-17 214 63.546 7.54707e-06 -3.5349 63.546000 Cu 0.966165 0.73638 1.9159e-16 215 63.546 3.31863e-06 -3.53465 63.546000 Cu 0.918865 0.727919 0.5 217 63.546 1.30383e-05 -3.53442 63.546000 Cu 0.804015 0.743138 4.60681e-17 250 63.546 1.2012e-05 -3.53541 63.546000 Cu 0.837784 0.73129 0.5 251 63.546 9.33461e-06 -3.53482 63.546000 Cu 0.885091 0.739761 1.22968e-16 253 63.546 8.46748e-07 -3.53477 63.546000 Cu 0.932397 0.74823 0.5 255 63.546 4.46145e-06 -3.53489 63.546000 Cu 0.0607703 0.753303 2.45696e-16 219 63.546 7.23711e-06 -3.53463 63.546000 Cu 0.108081 0.761763 0.5 222 63.546 3.48338e-06 -3.53394 63.546000 Cu 0.0270011 0.76515 0.5 259 63.546 3.03999e-06 -3.53457 63.546000 Cu 0.0743036 0.773603 1.19969e-19 261 63.546 1.03635e-05 -3.53416 63.546000 Cu 0.0878291 0.793903 3.59907e-19 262 63.546 2.58053e-05 -3.53457 63.546000 Cu 0.121611 0.782058 0.5 263 63.546 8.78724e-06 -3.53423 63.546000 Cu 0.0405276 0.785455 0.5 264 63.546 5.9432e-06 -3.53474 63.546000 Cu 0.00676349 0.797318 1.22128e-16 301 63.546 1.60957e-05 -3.53544 63.546000 Cu 0.155393 0.770222 1.19969e-19 393 63.546 2.63016e-07 -3.53376 63.546000 Cu 0.189171 0.758386 0.5 394 63.546 1.01825e-05 -3.53378 63.546000 Cu 0.168922 0.79052 1.19969e-19 435 63.546 2.29238e-06 -3.53484 63.546000 Cu 0.317544 0.76345 1.56439e-16 356 63.546 6.54914e-06 -3.53459 63.546000 Cu 0.351317 0.751605 0.5 357 63.546 3.07321e-06 -3.53525 63.546000 Cu 0.270245 0.754992 0.5 358 63.546 4.77751e-06 -3.5346 63.546000 Cu 0.398624 0.760075 6.33436e-17 359 63.546 1.51516e-06 -3.53526 63.546000 Cu 0.364852 0.771917 0.5 362 63.546 1.57764e-06 -3.53478 63.546000 Cu 0.236475 0.766839 6.88622e-17 395 63.546 1.97419e-06 -3.53379 63.546000 Cu 0.250006 0.78714 5.24264e-17 396 63.546 2.83535e-06 -3.53491 63.546000 Cu 0.283776 0.775294 0.5 397 63.546 4.03303e-06 -3.53416 63.546000 Cu 0.202701 0.77868 0.5 398 63.546 3.67794e-06 -3.53428 63.546000 Cu 0.331083 0.783756 1.35085e-16 399 63.546 8.34606e-06 -3.53448 63.546000 Cu 0.378395 0.792228 0.5 401 63.546 2.54349e-06 -3.53489 63.546000 Cu 0.297311 0.7956 0.5 402 63.546 7.41914e-06 -3.53513 63.546000 Cu 0.216234 0.798987 0.5 437 63.546 6.67732e-06 -3.53557 63.546000 Cu 0.4797 0.756693 0 321 63.546 2.3029e-06 -3.53495 63.546000 Cu 0.56077 0.753303 7.07817e-18 324 63.546 7.23711e-06 -3.53463 63.546000 Cu 0.574304 0.773603 1.79953e-18 325 63.546 1.03635e-05 -3.53416 63.546000 Cu 0.527001 0.76515 0.5 327 63.546 3.03999e-06 -3.53457 63.546000 Cu 0.412162 0.78039 8.63776e-17 360 63.546 7.63358e-06 -3.53501 63.546000 Cu 0.445931 0.768544 0.5 361 63.546 9.68884e-06 -3.53521 63.546000 Cu 0.49323 0.777004 5.17066e-17 363 63.546 6.67232e-06 -3.53499 63.546000 Cu 0.506763 0.797318 0 364 63.546 1.60957e-05 -3.53544 63.546000 Cu 0.540528 0.785455 0.5 365 63.546 5.9432e-06 -3.53474 63.546000 Cu 0.459467 0.788859 0.5 366 63.546 2.51076e-05 -3.53533 63.546000 Cu 0.587829 0.793903 7.86996e-17 367 63.546 2.58053e-05 -3.53457 63.546000 Cu 0.736475 0.766839 0 290 63.546 1.97419e-06 -3.53379 63.546000 Cu 0.770245 0.754992 0.5 291 63.546 4.77751e-06 -3.5346 63.546000 Cu 0.689171 0.758386 0.5 292 63.546 1.01825e-05 -3.53378 63.546000 Cu 0.783776 0.775294 0.5 296 63.546 4.03303e-06 -3.53416 63.546000 Cu 0.608081 0.761763 0.5 326 63.546 3.48338e-06 -3.53394 63.546000 Cu 0.655393 0.770222 8.91369e-17 328 63.546 2.63016e-07 -3.53376 63.546000 Cu 0.668922 0.79052 0 329 63.546 2.29238e-06 -3.53484 63.546000 Cu 0.702701 0.77868 0.5 330 63.546 3.67794e-06 -3.53428 63.546000 Cu 0.621611 0.782058 0.5 331 63.546 8.78724e-06 -3.53423 63.546000 Cu 0.750006 0.78714 0 332 63.546 2.83535e-06 -3.53491 63.546000 Cu 0.797311 0.7956 0.5 334 63.546 7.41914e-06 -3.53513 63.546000 Cu 0.716234 0.798987 0.5 335 63.546 6.67732e-06 -3.53557 63.546000 Cu 0.898624 0.760075 6.43033e-17 254 63.546 1.51516e-06 -3.53526 63.546000 Cu 0.851317 0.751605 0.5 256 63.546 3.07321e-06 -3.53525 63.546000 Cu 0.9797 0.756693 0 257 63.546 2.3029e-06 -3.53495 63.546000 Cu 0.99323 0.777004 1.1709e-16 258 63.546 6.67232e-06 -3.53499 63.546000 Cu 0.945931 0.768544 0.5 260 63.546 9.68884e-06 -3.53521 63.546000 Cu 0.817544 0.76345 4.81075e-17 293 63.546 6.54914e-06 -3.53459 63.546000 Cu 0.831083 0.783756 1.23088e-16 294 63.546 8.34606e-06 -3.53448 63.546000 Cu 0.864852 0.771917 0.5 295 63.546 1.57764e-06 -3.53478 63.546000 Cu 0.912162 0.78039 1.00654e-16 297 63.546 7.63358e-06 -3.53501 63.546000 Cu 0.959467 0.788859 0.5 299 63.546 2.51076e-05 -3.53533 63.546000 Cu 0.878395 0.792228 0.5 300 63.546 2.54349e-06 -3.53489 63.546000 Cu 0.135139 0.802358 0.5 265 63.546 2.30803e-05 -3.53467 63.546000 Cu 0.0202966 0.817637 1.63398e-16 302 63.546 4.19569e-05 -3.53583 63.546000 Cu 0.0540538 0.805763 0.5 303 63.546 1.26048e-05 -3.53497 63.546000 Cu 0.10135 0.814203 1.19969e-19 305 63.546 7.10572e-05 -3.53417 63.546000 Cu 0.114874 0.83449 1.89791e-16 306 63.546 0.000247238 -3.53286 63.546000 Cu 0.0675766 0.826067 0.5 307 63.546 4.19085e-05 -3.53433 63.546000 Cu 0.0338402 0.837954 1.61118e-16 344 63.546 0.000126373 -3.5357 63.546000 Cu 0.0811203 0.846357 0.5 346 63.546 0.000146105 -3.5331 63.546000 Cu 0.000145137 0.849836 0.5 347 63.546 0.000582404 -3.53749 63.546000 Cu 0.182455 0.810826 1.19969e-19 436 63.546 6.1172e-06 -3.53531 63.546000 Cu 0.148663 0.822655 0.5 477 63.546 7.51792e-05 -3.53423 63.546000 Cu 0.195998 0.83113 8.96168e-17 478 63.546 2.24378e-05 -3.53526 63.546000 Cu 0.162218 0.842938 0.5 481 63.546 0.000209021 -3.53289 63.546000 Cu 0.34462 0.804068 2.39938e-19 400 63.546 1.57437e-05 -3.5351 63.546000 Cu 0.391935 0.812546 0.5 406 63.546 4.5523e-06 -3.53528 63.546000 Cu 0.263538 0.807453 1.62558e-16 438 63.546 3.5348e-06 -3.53579 63.546000 Cu 0.277072 0.827769 1.44443e-16 439 63.546 2.45871e-05 -3.53584 63.546000 Cu 0.310839 0.815915 0.5 440 63.546 8.57745e-06 -3.53525 63.546000 Cu 0.22977 0.819301 0.5 441 63.546 3.11394e-05 -3.53598 63.546000 Cu 0.358147 0.824378 7.3181e-17 442 63.546 4.87645e-05 -3.53442 63.546000 Cu 0.371697 0.844672 1.01614e-16 443 63.546 0.000196854 -3.53251 63.546000 Cu 0.324374 0.836222 0.5 445 63.546 3.43845e-05 -3.53422 63.546000 Cu 0.243327 0.839616 0.5 480 63.546 0.000132304 -3.53642 63.546000 Cu 0.290642 0.848084 5.08668e-17 482 63.546 0.000123216 -3.53596 63.546000 Cu 0.554054 0.805763 0.5 370 63.546 1.26048e-05 -3.53497 63.546000 Cu 0.425707 0.800708 1.30046e-16 403 63.546 1.96598e-05 -3.53557 63.546000 Cu 0.43925 0.821032 8.51779e-18 404 63.546 5.94951e-05 -3.53598 63.546000 Cu 0.473009 0.809182 0.5 405 63.546 6.76105e-05 -3.53614 63.546000 Cu 0.520297 0.817637 2.55174e-16 407 63.546 4.19569e-05 -3.53583 63.546000 Cu 0.53384 0.837954 1.59559e-17 408 63.546 0.000126373 -3.5357 63.546000 Cu 0.567577 0.826067 0.5 409 63.546 4.19085e-05 -3.53433 63.546000 Cu 0.486556 0.829509 0.5 410 63.546 0.000206105 -3.53644 63.546000 Cu 0.58112 0.846357 0.5 414 63.546 0.000146105 -3.5331 63.546000 Cu 0.405478 0.832858 0.5 444 63.546 2.16711e-05 -3.53443 63.546000 Cu 0.452821 0.841351 4.90673e-17 446 63.546 0.000154257 -3.53587 63.546000 Cu 0.500145 0.849836 0.5 448 63.546 0.000582404 -3.53749 63.546000 Cu 0.763538 0.807453 5.61455e-17 333 63.546 3.5348e-06 -3.53579 63.546000 Cu 0.60135 0.814203 2.45696e-16 368 63.546 7.10572e-05 -3.53417 63.546000 Cu 0.635139 0.802358 0.5 369 63.546 2.30803e-05 -3.53467 63.546000 Cu 0.682455 0.810826 0 371 63.546 6.1172e-06 -3.53531 63.546000 Cu 0.695998 0.83113 2.11385e-16 372 63.546 2.24378e-05 -3.53526 63.546000 Cu 0.72977 0.819301 0.5 373 63.546 3.11394e-05 -3.53598 63.546000 Cu 0.648663 0.822655 0.5 374 63.546 7.51792e-05 -3.53423 63.546000 Cu 0.777072 0.827769 5.09868e-17 375 63.546 2.45871e-05 -3.53584 63.546000 Cu 0.790642 0.848084 2.83966e-16 376 63.546 0.000123216 -3.53596 63.546000 Cu 0.743327 0.839616 0.5 378 63.546 0.000132304 -3.53642 63.546000 Cu 0.614874 0.83449 4.79876e-17 411 63.546 0.000247238 -3.53286 63.546000 Cu 0.662218 0.842938 0.5 413 63.546 0.000209021 -3.53289 63.546000 Cu 0.925707 0.800708 8.07391e-17 298 63.546 1.96598e-05 -3.53557 63.546000 Cu 0.973009 0.809182 0.5 304 63.546 6.76105e-05 -3.53614 63.546000 Cu 0.84462 0.804068 3.25116e-17 336 63.546 1.57437e-05 -3.5351 63.546000 Cu 0.858147 0.824378 2.34419e-16 337 63.546 4.87645e-05 -3.53442 63.546000 Cu 0.891935 0.812546 0.5 338 63.546 4.5523e-06 -3.53528 63.546000 Cu 0.810839 0.815915 0.5 339 63.546 8.57745e-06 -3.53525 63.546000 Cu 0.93925 0.821032 1.85712e-16 340 63.546 5.94951e-05 -3.53598 63.546000 Cu 0.952821 0.841351 8.64976e-17 341 63.546 0.000154257 -3.53587 63.546000 Cu 0.986556 0.829509 0.5 342 63.546 0.000206105 -3.53644 63.546000 Cu 0.905478 0.832858 0.5 343 63.546 2.16711e-05 -3.53443 63.546000 Cu 0.824374 0.836222 0.5 377 63.546 3.43845e-05 -3.53422 63.546000 Cu 0.871697 0.844672 4.79876e-19 379 63.546 0.000196854 -3.53251 63.546000 Cu 0.0474117 0.85827 4.28289e-17 345 63.546 0.000421794 -3.53646 63.546000 Cu 0.128429 0.85475 1.56799e-16 348 63.546 0.000868173 -3.53054 63.546000 Cu 0.0946304 0.866627 0.5 349 63.546 0.000619314 -3.53151 63.546000 Cu 0.0137092 0.870179 0.5 385 63.546 0.00200896 -3.54039 63.546000 Cu 0.0608717 0.878599 6.99419e-17 387 63.546 0.00146055 -3.53842 63.546000 Cu 0.0741935 0.898963 2.45336e-16 388 63.546 0.00568654 -3.54088 63.546000 Cu 0.107963 0.886869 0.5 389 63.546 0.00273007 -3.5277 63.546000 Cu 0.0271524 0.890566 0.5 390 63.546 0.00705284 -3.54543 63.546000 Cu 0.14189 0.874977 4.29489e-17 517 63.546 0.00312578 -3.52708 63.546000 Cu 0.175783 0.863199 0.5 518 63.546 0.000668122 -3.53183 63.546000 Cu 0.189229 0.883442 0.5 522 63.546 0.00186226 -3.5305 63.546000 Cu 0.155179 0.895144 1.64117e-16 549 63.546 0.0118252 -3.51955 63.546000 Cu 0.209581 0.851428 1.29566e-17 479 63.546 8.39095e-05 -3.53531 63.546000 Cu 0.304177 0.868404 2.13305e-16 483 63.546 0.000554841 -3.53746 63.546000 Cu 0.337927 0.856513 0.5 484 63.546 0.000162676 -3.53307 63.546000 Cu 0.256918 0.859936 0.5 485 63.546 0.000592465 -3.53814 63.546000 Cu 0.385241 0.864939 8.63776e-18 486 63.546 0.000904156 -3.53028 63.546000 Cu 0.398626 0.885168 2.57093e-16 487 63.546 0.00394769 -3.52581 63.546000 Cu 0.351376 0.876789 0.5 489 63.546 0.000775201 -3.53143 63.546000 Cu 0.22314 0.871731 6.68227e-17 519 63.546 0.000438597 -3.53718 63.546000 Cu 0.236587 0.892057 9.40556e-17 520 63.546 0.00193448 -3.54019 63.546000 Cu 0.270421 0.880284 0.5 521 63.546 0.00250366 -3.54202 63.546000 Cu 0.317556 0.888748 3.094e-16 523 63.546 0.00220835 -3.54003 63.546000 Cu 0.364631 0.897034 0.5 525 63.546 0.00402046 -3.52589 63.546000 Cu 0.46642 0.86167 2.301e-16 447 63.546 0.000517536 -3.53694 63.546000 Cu 0.419059 0.853151 0.5 449 63.546 9.88678e-05 -3.53336 63.546000 Cu 0.547412 0.85827 9.30959e-17 450 63.546 0.000421794 -3.53646 63.546000 Cu 0.560872 0.878599 1.43003e-16 451 63.546 0.00146055 -3.53842 63.546000 Cu 0.59463 0.866627 0.5 452 63.546 0.000619314 -3.53151 63.546000 Cu 0.513709 0.870179 0.5 453 63.546 0.00200896 -3.54039 63.546000 Cu 0.432592 0.873429 0.5 488 63.546 0.000491414 -3.53218 63.546000 Cu 0.479926 0.882004 2.29381e-16 490 63.546 0.00170703 -3.53929 63.546000 Cu 0.527152 0.890566 0.5 492 63.546 0.00705284 -3.54543 63.546000 Cu 0.445991 0.893689 0.5 493 63.546 0.0017364 -3.53025 63.546000 Cu 0.574194 0.898963 8.63776e-18 494 63.546 0.00568654 -3.54088 63.546000 Cu 0.628429 0.85475 1.1397e-16 412 63.546 0.000868173 -3.53054 63.546000 Cu 0.709581 0.851428 1.66757e-16 415 63.546 8.39095e-05 -3.53531 63.546000 Cu 0.72314 0.871731 3.31114e-17 416 63.546 0.000438597 -3.53718 63.546000 Cu 0.756918 0.859936 0.5 417 63.546 0.000592465 -3.53814 63.546000 Cu 0.675783 0.863199 0.5 418 63.546 0.000668122 -3.53183 63.546000 Cu 0.770421 0.880284 0.5 422 63.546 0.00250366 -3.54202 63.546000 Cu 0.64189 0.874977 2.84326e-16 454 63.546 0.00312578 -3.52708 63.546000 Cu 0.655179 0.895144 1.09172e-17 455 63.546 0.0118252 -3.51955 63.546000 Cu 0.689229 0.883442 0.5 456 63.546 0.00186226 -3.5305 63.546000 Cu 0.607963 0.886869 0.5 457 63.546 0.00273007 -3.5277 63.546000 Cu 0.736587 0.892057 1.40364e-17 458 63.546 0.00193448 -3.54019 63.546000 Cu 0.885241 0.864939 4.83475e-17 380 63.546 0.000904156 -3.53028 63.546000 Cu 0.919059 0.853151 0.5 381 63.546 9.88678e-05 -3.53336 63.546000 Cu 0.837927 0.856513 0.5 382 63.546 0.000162676 -3.53307 63.546000 Cu 0.96642 0.86167 1.19969e-19 383 63.546 0.000517536 -3.53694 63.546000 Cu 0.979926 0.882004 1.47682e-16 384 63.546 0.00170703 -3.53929 63.546000 Cu 0.932592 0.873429 0.5 386 63.546 0.000491414 -3.53218 63.546000 Cu 0.804177 0.868404 4.03096e-17 419 63.546 0.000554841 -3.53746 63.546000 Cu 0.817556 0.888748 1.19969e-19 420 63.546 0.00220835 -3.54003 63.546000 Cu 0.851376 0.876789 0.5 421 63.546 0.000775201 -3.53143 63.546000 Cu 0.898626 0.885168 1.19969e-16 423 63.546 0.00394769 -3.52581 63.546000 Cu 0.945991 0.893689 0.5 425 63.546 0.0017364 -3.53025 63.546000 Cu 0.864631 0.897034 0.5 426 63.546 0.00402046 -3.52589 63.546000 Cu 0.12116 0.907056 0.5 391 63.546 0.0133417 -3.51696 63.546000 Cu 0.00706654 0.922815 6.40634e-17 428 63.546 0.02007 -3.54547 63.546000 Cu 0.0406629 0.911039 0.5 429 63.546 0.0251874 -3.55344 63.546000 Cu 0.0875774 0.919414 1.38444e-16 431 63.546 0.0261646 -3.54408 63.546000 Cu 0.100867 0.940127 4.36687e-17 432 63.546 0.163488 -3.53726 63.546000 Cu 0.134332 0.92711 0.5 433 63.546 0.0750733 -3.4855 63.546000 Cu 0.05445 0.931688 0.5 434 63.546 0.0923463 -3.56602 63.546000 Cu 0.0208695 0.943396 1.02573e-16 470 63.546 0.059067 -3.53958 63.546000 Cu 0.168488 0.915206 9.05765e-17 550 63.546 0.0443053 -3.50361 63.546000 Cu 0.181812 0.935096 7.79798e-17 573 63.546 0.160116 -3.47331 63.546000 Cu 0.147197 0.94683 0.5 576 63.546 0.538621 -3.37488 63.546000 Cu 0.330913 0.909145 1.36285e-16 524 63.546 0.0098519 -3.54338 63.546000 Cu 0.283842 0.900692 0.5 526 63.546 0.0101919 -3.54844 63.546000 Cu 0.377883 0.9172 0.5 530 63.546 0.0226537 -3.51041 63.546000 Cu 0.20261 0.903662 0.5 551 63.546 0.00497346 -3.52704 63.546000 Cu 0.250131 0.912429 6.99419e-17 552 63.546 0.00811699 -3.54379 63.546000 Cu 0.263888 0.932892 1.82353e-16 553 63.546 0.0286522 -3.54481 63.546000 Cu 0.297503 0.921216 0.5 554 63.546 0.0399613 -3.55843 63.546000 Cu 0.216185 0.923849 0.5 555 63.546 0.0125454 -3.52085 63.546000 Cu 0.344334 0.929676 3.76702e-17 556 63.546 0.0517477 -3.54611 63.546000 Cu 0.390949 0.937186 0.5 558 63.546 0.146527 -3.45967 63.546000 Cu 0.311366 0.941968 0.5 559 63.546 0.150399 -3.57001 63.546000 Cu 0.229887 0.944014 0.5 575 63.546 0.0285374 -3.50444 63.546000 Cu 0.493394 0.902372 2.19783e-16 491 63.546 0.00586016 -3.54267 63.546000 Cu 0.587577 0.919414 9.41756e-17 495 63.546 0.0261646 -3.54408 63.546000 Cu 0.540663 0.911039 0.5 497 63.546 0.0251874 -3.55344 63.546000 Cu 0.411912 0.905325 4.48684e-17 527 63.546 0.0169939 -3.51514 63.546000 Cu 0.425292 0.925352 4.48684e-17 528 63.546 0.0682164 -3.49321 63.546000 Cu 0.459475 0.913925 0.5 529 63.546 0.00571014 -3.52481 63.546000 Cu 0.507067 0.922815 2.42937e-16 531 63.546 0.02007 -3.54547 63.546000 Cu 0.520869 0.943396 8.04991e-17 532 63.546 0.059067 -3.53958 63.546000 Cu 0.55445 0.931688 0.5 533 63.546 0.0923463 -3.56602 63.546000 Cu 0.473112 0.934136 0.5 534 63.546 0.0163136 -3.51392 63.546000 Cu 0.438528 0.945184 2.15224e-16 560 63.546 0.257985 -3.45249 63.546000 Cu 0.750131 0.912429 8.27786e-18 459 63.546 0.00811699 -3.54379 63.546000 Cu 0.783842 0.900692 0.5 460 63.546 0.0101919 -3.54844 63.546000 Cu 0.70261 0.903662 0.5 461 63.546 0.00497346 -3.52704 63.546000 Cu 0.797503 0.921216 0.5 465 63.546 0.0399613 -3.55843 63.546000 Cu 0.62116 0.907056 0.5 496 63.546 0.0133417 -3.51696 63.546000 Cu 0.668488 0.915206 7.738e-17 498 63.546 0.0443053 -3.50361 63.546000 Cu 0.681812 0.935096 1.33165e-17 499 63.546 0.160116 -3.47331 63.546000 Cu 0.716185 0.923849 0.5 500 63.546 0.0125454 -3.52085 63.546000 Cu 0.634332 0.92711 0.5 501 63.546 0.0750733 -3.4855 63.546000 Cu 0.763888 0.932892 0 502 63.546 0.0286522 -3.54481 63.546000 Cu 0.729887 0.944014 0.5 505 63.546 0.0285374 -3.50444 63.546000 Cu 0.600867 0.940127 4.79876e-19 535 63.546 0.163488 -3.53726 63.546000 Cu 0.647197 0.94683 0.5 537 63.546 0.538621 -3.37488 63.546000 Cu 0.911912 0.905325 1.79354e-16 424 63.546 0.0169939 -3.51514 63.546000 Cu 0.993394 0.902372 1.82593e-16 427 63.546 0.00586016 -3.54267 63.546000 Cu 0.959475 0.913925 0.5 430 63.546 0.00571014 -3.52481 63.546000 Cu 0.830913 0.909145 2.38018e-16 462 63.546 0.0098519 -3.54338 63.546000 Cu 0.844334 0.929676 3.59907e-19 463 63.546 0.0517477 -3.54611 63.546000 Cu 0.877883 0.9172 0.5 464 63.546 0.0226537 -3.51041 63.546000 Cu 0.925292 0.925352 2.05027e-16 466 63.546 0.0682164 -3.49321 63.546000 Cu 0.938528 0.945184 5.25464e-17 467 63.546 0.257985 -3.45249 63.546000 Cu 0.973112 0.934136 0.5 468 63.546 0.0163136 -3.51392 63.546000 Cu 0.890949 0.937186 0.5 469 63.546 0.146527 -3.45967 63.546000 Cu 0.811366 0.941968 0.5 504 63.546 0.150399 -3.57001 63.546000 Cu 0.0338732 0.964223 8.81772e-17 471 63.546 0.221932 -3.51612 63.546000 Cu 0.0686211 0.952721 0.5 472 63.546 0.37166 -3.58655 63.546000 Cu 0.113312 0.961752 2.57933e-17 474 63.546 1.55556 -3.50059 63.546000 Cu 0.11629 0.986899 3.64706e-17 475 63.546 5.43041 -3.53854 63.546000 Cu 0.0823265 0.974586 0.5 476 63.546 2.8613 -3.76835 63.546000 Cu 0.0361582 0.985101 1.22968e-16 514 63.546 0.259833 -3.52885 63.546000 Cu 0.0729099 0.996448 0.5 515 63.546 0.545653 -3.60405 63.546000 Cu 0.19518 0.954752 4.66679e-17 574 63.546 0.62269 -3.41109 63.546000 Cu 0.160467 0.965705 0.5 588 63.546 7.6346 -2.98369 63.546000 Cu 0.164245 0.984031 0.5 592 63.546 7.87436 -2.88861 63.546000 Cu 0.199375 0.994584 1.27047e-16 590 63.546 0.926734 -3.39672 63.546000 Cu 0.361373 0.997967 1.56919e-16 626 63.546 1.15262 -3.49909 63.546000 Cu 0.357322 0.95063 2.19063e-16 557 63.546 0.389101 -3.52437 63.546000 Cu 0.277516 0.953537 1.82353e-16 577 63.546 0.0934601 -3.52755 63.546000 Cu 0.286664 0.974449 5.55456e-17 578 63.546 0.24109 -3.53397 63.546000 Cu 0.325313 0.963244 0.5 579 63.546 0.771553 -3.62733 63.546000 Cu 0.242767 0.964296 0.5 580 63.546 0.166012 -3.49521 63.546000 Cu 0.367212 0.973267 1.03893e-16 581 63.546 6.17337 -3.5619 63.546000 Cu 0.330954 0.985081 0.5 584 63.546 2.36268 -3.74159 63.546000 Cu 0.203608 0.974606 0 589 63.546 2.51376 -3.38753 63.546000 Cu 0.246383 0.984762 0.5 591 63.546 0.43905 -3.5038 63.546000 Cu 0.282045 0.995315 1.1673e-16 593 63.546 0.190997 -3.51316 63.546000 Cu 0.568621 0.952721 0.5 538 63.546 0.37166 -3.58655 63.546000 Cu 0.45108 0.964815 1.45642e-16 561 63.546 1.16296 -3.39205 63.546000 Cu 0.486713 0.954345 0.5 562 63.546 0.0472658 -3.49374 63.546000 Cu 0.40345 0.956691 0.5 563 63.546 1.24408 -3.27346 63.546000 Cu 0.533873 0.964223 2.12945e-16 564 63.546 0.221932 -3.51612 63.546000 Cu 0.536158 0.985101 1.1709e-16 565 63.546 0.259833 -3.52885 63.546000 Cu 0.582326 0.974586 0.5 566 63.546 2.8613 -3.76835 63.546000 Cu 0.497446 0.974729 0.5 567 63.546 0.542413 -3.50252 63.546000 Cu 0.57291 0.996448 0.5 571 63.546 0.545653 -3.60405 63.546000 Cu 0.415639 0.975169 0.5 583 63.546 8.28607 -2.8388 63.546000 Cu 0.453161 0.98484 1.74915e-16 585 63.546 2.2137 -3.38059 63.546000 Cu 0.490803 0.995177 0.5 586 63.546 0.10586 -3.49153 63.546000 Cu 0.408239 0.993451 0.5 587 63.546 6.17967 -3.05164 63.546000 Cu 0.777516 0.953537 3.59907e-19 503 63.546 0.0934601 -3.52755 63.546000 Cu 0.613312 0.961752 1.538e-16 536 63.546 1.55556 -3.50059 63.546000 Cu 0.69518 0.954752 1.33645e-16 539 63.546 0.62269 -3.41109 63.546000 Cu 0.703608 0.974606 7.65402e-17 540 63.546 2.51376 -3.38753 63.546000 Cu 0.742767 0.964296 0.5 541 63.546 0.166012 -3.49521 63.546000 Cu 0.660467 0.965705 0.5 542 63.546 7.6346 -2.98369 63.546000 Cu 0.786664 0.974449 2.39938e-19 543 63.546 0.24109 -3.53397 63.546000 Cu 0.746383 0.984762 0.5 546 63.546 0.43905 -3.5038 63.546000 Cu 0.61629 0.986899 1.5296e-16 568 63.546 5.43041 -3.53854 63.546000 Cu 0.664245 0.984031 0.5 570 63.546 7.87436 -2.88861 63.546000 Cu 0.699375 0.994584 1.38804e-16 572 63.546 0.926734 -3.39672 63.546000 Cu 0.782045 0.995315 3.59907e-19 544 63.546 0.190997 -3.51316 63.546000 Cu 0.861373 0.997967 5.24264e-17 595 63.546 1.15262 -3.49909 63.546000 Cu 0.857322 0.95063 1.09172e-17 506 63.546 0.389101 -3.52437 63.546000 Cu 0.997446 0.974729 0.5 512 63.546 0.542413 -3.50252 63.546000 Cu 0.990803 0.995177 0.5 516 63.546 0.10586 -3.49153 63.546000 Cu 0.986713 0.954345 0.5 473 63.546 0.0472658 -3.49374 63.546000 Cu 0.867212 0.973267 7.28211e-17 507 63.546 6.17337 -3.5619 63.546000 Cu 0.90345 0.956691 0.5 508 63.546 1.24408 -3.27346 63.546000 Cu 0.825313 0.963244 0.5 509 63.546 0.771553 -3.62733 63.546000 Cu 0.95108 0.964815 1.62558e-16 510 63.546 1.16296 -3.39205 63.546000 Cu 0.953161 0.98484 0 511 63.546 2.2137 -3.38059 63.546000 Cu 0.915639 0.975169 0.5 513 63.546 8.28607 -2.8388 63.546000 Cu 0.830954 0.985081 0.5 545 63.546 2.36268 -3.74159 63.546000 Cu 0.908239 0.993451 0.5 548 63.546 6.17967 -3.05164