Number of particles = 974 A = 1 Angstrom (basic length-scale) H0(1,1) = 28.1918 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 112.943 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62018 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 0.0833377 0.00461935 1 502 63.546 0.0575715 -3.52559 63.546000 Cu 0.0340373 0.0158102 0.5 503 63.546 0.0109459 -3.53185 63.546000 Cu 0.0746384 0.0277968 1 515 63.546 0.0311088 -3.5364 63.546000 Cu 0.163659 0.0300997 1 516 63.546 0.0581065 -3.53728 63.546000 Cu 0.123518 0.0169918 0.5 517 63.546 0.0977915 -3.53142 63.546000 Cu 0.172255 0.00669161 1 519 63.546 0.265432 -3.51088 63.546000 Cu 0.26055 0.0125755 1.54536e-16 520 63.546 0.523924 -3.46655 63.546000 Cu 0.211536 0.020555 0.5 521 63.546 0.0876243 -3.51739 63.546000 Cu 0.310827 0.00318438 0.5 522 63.546 0.424528 -3.50149 63.546000 Cu 0.252769 0.0342712 1 541 63.546 0.0928336 -3.51618 63.546000 Cu 0.302324 0.024815 0.5 543 63.546 0.13636 -3.52289 63.546000 Cu 0.344004 0.0366188 1.96464e-17 542 63.546 0.0245431 -3.53521 63.546000 Cu 0.352379 0.0145662 1 545 63.546 0.0291855 -3.53454 63.546000 Cu 0.443533 0.0152508 1 546 63.546 0.00482771 -3.53581 63.546000 Cu 0.4021 0.00383397 0.5 547 63.546 0.0214287 -3.5363 63.546000 Cu 0.393776 0.0260933 0.5 548 63.546 0.00662582 -3.53724 63.546000 Cu 0.492915 0.0041805 0.5 549 63.546 0.0169089 -3.53369 63.546000 Cu 0.484574 0.0268546 0.5 577 63.546 0.00298478 -3.53576 63.546000 Cu 0.534037 0.0158102 0 579 63.546 0.0109459 -3.53185 63.546000 Cu 0.623518 0.0169918 0 580 63.546 0.0977915 -3.53142 63.546000 Cu 0.583338 0.00461935 0.5 581 63.546 0.0575715 -3.52559 63.546000 Cu 0.574638 0.0277968 0.5 582 63.546 0.0311088 -3.5364 63.546000 Cu 0.663659 0.0300997 0.5 619 63.546 0.0581065 -3.53728 63.546000 Cu 0.672255 0.00669161 0.5 583 63.546 0.265432 -3.51088 63.546000 Cu 0.810827 0.00318438 0 491 63.546 0.424528 -3.50149 63.546000 Cu 0.711536 0.020555 1.73224e-16 621 63.546 0.0876243 -3.51739 63.546000 Cu 0.802324 0.024815 0 622 63.546 0.13636 -3.52289 63.546000 Cu 0.76055 0.0125755 0.5 623 63.546 0.523924 -3.46655 63.546000 Cu 0.752769 0.0342712 0.5 624 63.546 0.0928336 -3.51618 63.546000 Cu 0.844004 0.0366188 0.5 495 63.546 0.0245431 -3.53521 63.546000 Cu 0.9021 0.00383397 1.22551e-16 492 63.546 0.0214287 -3.5363 63.546000 Cu 0.852379 0.0145662 0.5 493 63.546 0.0291855 -3.53454 63.546000 Cu 0.893776 0.0260933 1 497 63.546 0.00662582 -3.53724 63.546000 Cu 0.984574 0.0268546 1 498 63.546 0.00298478 -3.53576 63.546000 Cu 0.943533 0.0152508 0.5 499 63.546 0.00482771 -3.53581 63.546000 Cu 0.992915 0.0041805 1 501 63.546 0.0169089 -3.53369 63.546000 Cu 0.0660853 0.0508028 1 512 63.546 0.0163571 -3.53983 63.546000 Cu 0.0254114 0.0386721 0.5 513 63.546 0.00845732 -3.53734 63.546000 Cu 0.0168981 0.0614542 0.5 514 63.546 0.00544114 -3.53942 63.546000 Cu 0.115025 0.0402619 0.5 518 63.546 0.0385554 -3.53996 63.546000 Cu 0.0576542 0.0736574 1 533 63.546 0.00833779 -3.54063 63.546000 Cu 0.106663 0.0632568 0.5 535 63.546 0.0153886 -3.54101 63.546000 Cu 0.155455 0.0531109 1 537 63.546 0.0179258 -3.54016 63.546000 Cu 0.245029 0.0564201 3.11468e-17 538 63.546 0.0224972 -3.53194 63.546000 Cu 0.204 0.043377 0.5 539 63.546 0.0150498 -3.53458 63.546000 Cu 0.196102 0.0660296 0.5 540 63.546 0.0040082 -3.53815 63.546000 Cu 0.294356 0.046737 0.5 544 63.546 0.0483009 -3.53071 63.546000 Cu 0.286326 0.0688727 0.5 569 63.546 0.0169677 -3.53496 63.546000 Cu 0.434993 0.0377189 3.59386e-19 575 63.546 0.0022155 -3.53734 63.546000 Cu 0.335785 0.0587786 0 571 63.546 0.0144977 -3.53611 63.546000 Cu 0.426556 0.0601847 3.59386e-19 572 63.546 0.00148559 -3.53838 63.546000 Cu 0.385363 0.0483767 0.5 573 63.546 0.00548271 -3.53741 63.546000 Cu 0.377057 0.0707063 0.5 574 63.546 0.00361248 -3.53815 63.546000 Cu 0.476017 0.0494876 0.5 578 63.546 0.00222193 -3.5381 63.546000 Cu 0.46758 0.0720948 0.5 611 63.546 0.00142607 -3.5392 63.546000 Cu 0.525411 0.0386721 2.74451e-16 576 63.546 0.00845732 -3.53734 63.546000 Cu 0.516898 0.0614542 1.2279e-16 613 63.546 0.00544114 -3.53942 63.546000 Cu 0.606663 0.0632568 1 614 63.546 0.0153886 -3.54101 63.546000 Cu 0.566085 0.0508028 0.5 615 63.546 0.0163571 -3.53983 63.546000 Cu 0.557654 0.0736574 0.5 616 63.546 0.00833779 -3.54063 63.546000 Cu 0.615025 0.0402619 0 617 63.546 0.0385554 -3.53996 63.546000 Cu 0.655455 0.0531109 0.5 620 63.546 0.0179258 -3.54016 63.546000 Cu 0.704 0.043377 0 618 63.546 0.0150498 -3.53458 63.546000 Cu 0.696102 0.0660296 2.44742e-16 661 63.546 0.0040082 -3.53815 63.546000 Cu 0.786326 0.0688727 1 662 63.546 0.0169677 -3.53496 63.546000 Cu 0.745029 0.0564201 0.5 663 63.546 0.0224972 -3.53194 63.546000 Cu 0.794356 0.046737 1.42676e-16 665 63.546 0.0483009 -3.53071 63.546000 Cu 0.934993 0.0377189 0.5 500 63.546 0.0022155 -3.53734 63.546000 Cu 0.835785 0.0587786 0.5 496 63.546 0.0144977 -3.53611 63.546000 Cu 0.885363 0.0483767 1 494 63.546 0.00548271 -3.53741 63.546000 Cu 0.877057 0.0707063 1.2279e-16 507 63.546 0.00361248 -3.53815 63.546000 Cu 0.96758 0.0720948 3.59386e-19 508 63.546 0.00142607 -3.5392 63.546000 Cu 0.926556 0.0601847 0.5 509 63.546 0.00148559 -3.53838 63.546000 Cu 0.976017 0.0494876 4.79181e-19 511 63.546 0.00222193 -3.5381 63.546000 Cu 0.0492249 0.0964083 1 530 63.546 0.003945 -3.5406 63.546000 Cu 0.147272 0.0759284 1 534 63.546 0.00577144 -3.54045 63.546000 Cu 0.0983094 0.0860836 0.5 536 63.546 0.00594167 -3.54089 63.546000 Cu 0.0899438 0.108799 0.5 561 63.546 0.00242994 -3.54069 63.546000 Cu 0.139006 0.0986257 0 563 63.546 0.00199389 -3.54034 63.546000 Cu 0.00846515 0.0841652 0.5 531 63.546 0.00310618 -3.54007 63.546000 Cu 2.30491e-05 0.10682 0.5 532 63.546 0.00167096 -3.54023 63.546000 Cu 0.228953 0.101161 0 564 63.546 0.00228427 -3.53848 63.546000 Cu 0.187993 0.0886064 0.5 565 63.546 0.00138613 -3.53918 63.546000 Cu 0.237069 0.0787473 7.70284e-17 567 63.546 0.00662883 -3.5366 63.546000 Cu 0.327573 0.0810334 2.44742e-16 568 63.546 0.00712534 -3.53762 63.546000 Cu 0.278197 0.0911587 0.5 570 63.546 0.00640988 -3.53758 63.546000 Cu 0.319338 0.103381 1 605 63.546 0.00345466 -3.53843 63.546000 Cu 0.409787 0.105138 0 606 63.546 0.000408993 -3.53927 63.546000 Cu 0.368738 0.0930925 0.5 607 63.546 0.00217163 -3.5388 63.546000 Cu 0.418174 0.0826525 1 609 63.546 0.000776599 -3.53912 63.546000 Cu 0.459158 0.09468 0.5 612 63.546 0.000794475 -3.5397 63.546000 Cu 0.508465 0.0841652 1.24228e-16 610 63.546 0.00310618 -3.54007 63.546000 Cu 0.500023 0.10682 0 653 63.546 0.00167096 -3.54023 63.546000 Cu 0.589944 0.108799 2.9865e-16 654 63.546 0.00242994 -3.54069 63.546000 Cu 0.549225 0.0964083 0.5 655 63.546 0.003945 -3.5406 63.546000 Cu 0.598309 0.0860836 1.43754e-17 657 63.546 0.00594167 -3.54089 63.546000 Cu 0.647272 0.0759284 0.5 659 63.546 0.00577144 -3.54045 63.546000 Cu 0.639006 0.0986257 0.5 660 63.546 0.00199389 -3.54034 63.546000 Cu 0.827573 0.0810334 0.5 505 63.546 0.00712534 -3.53762 63.546000 Cu 0.819338 0.103381 0.5 506 63.546 0.00345466 -3.53843 63.546000 Cu 0.687993 0.0886064 1 658 63.546 0.00138613 -3.53918 63.546000 Cu 0.737069 0.0787473 0.5 664 63.546 0.00662883 -3.5366 63.546000 Cu 0.728953 0.101161 0.5 703 63.546 0.00228427 -3.53848 63.546000 Cu 0.778197 0.0911587 1.67234e-16 705 63.546 0.00640988 -3.53758 63.546000 Cu 0.868738 0.0930925 2.30366e-16 504 63.546 0.00217163 -3.5388 63.546000 Cu 0.918174 0.0826525 0.5 510 63.546 0.000776599 -3.53912 63.546000 Cu 0.909787 0.105138 0.5 527 63.546 0.000408993 -3.53927 63.546000 Cu 0.959158 0.09468 1.30577e-17 529 63.546 0.000794475 -3.5397 63.546000 Cu 0.0325856 0.141735 1 556 63.546 0.000665722 -3.54041 63.546000 Cu 0.0408249 0.119092 0 559 63.546 0.00170182 -3.54057 63.546000 Cu 0.130727 0.121258 1 560 63.546 0.000850931 -3.54049 63.546000 Cu 0.081644 0.131461 0.5 562 63.546 0.000947433 -3.54055 63.546000 Cu 0.122608 0.14386 1 597 63.546 0.000355869 -3.54019 63.546000 Cu 0.179816 0.111161 0.5 566 63.546 0.000543142 -3.53964 63.546000 Cu 0.171689 0.133708 0.5 599 63.546 0.000215738 -3.53997 63.546000 Cu 0.212741 0.146101 0 598 63.546 0.000298744 -3.53944 63.546000 Cu 0.220796 0.123615 1 601 63.546 0.000840299 -3.53907 63.546000 Cu 0.311086 0.125781 0 602 63.546 0.0016397 -3.53887 63.546000 Cu 0.270004 0.113536 0.5 603 63.546 0.00273487 -3.53845 63.546000 Cu 0.261883 0.135963 0.5 604 63.546 0.00104539 -3.53899 63.546000 Cu 0.360406 0.115511 0.5 608 63.546 0.00103712 -3.53898 63.546000 Cu 0.352191 0.13797 0.5 647 63.546 0.00055018 -3.53956 63.546000 Cu 0.401456 0.127631 1 649 63.546 0.000210817 -3.53975 63.546000 Cu 0.491665 0.129444 0 650 63.546 0.000834486 -3.54027 63.546000 Cu 0.450751 0.117247 0.5 651 63.546 0.000475554 -3.53985 63.546000 Cu 0.442491 0.139808 0.5 652 63.546 0.000279932 -3.54019 63.546000 Cu 0.540825 0.119092 0.5 656 63.546 0.00170182 -3.54057 63.546000 Cu 0.532586 0.141735 0.5 695 63.546 0.000665722 -3.54041 63.546000 Cu 0.581644 0.131461 0 697 63.546 0.000947433 -3.54055 63.546000 Cu 0.630727 0.121258 0.5 699 63.546 0.000850931 -3.54049 63.546000 Cu 0.622608 0.14386 0.5 700 63.546 0.000355869 -3.54019 63.546000 Cu 0.679816 0.111161 1.80531e-16 701 63.546 0.000543142 -3.53964 63.546000 Cu 0.671689 0.133708 0 698 63.546 0.000215738 -3.53997 63.546000 Cu 0.811086 0.125781 0.5 524 63.546 0.0016397 -3.53887 63.546000 Cu 0.770004 0.113536 1 702 63.546 0.00273487 -3.53845 63.546000 Cu 0.720796 0.123615 0.5 704 63.546 0.000840299 -3.53907 63.546000 Cu 0.712741 0.146101 0.5 743 63.546 0.000298744 -3.53944 63.546000 Cu 0.761883 0.135963 1 745 63.546 0.00104539 -3.53899 63.546000 Cu 0.852191 0.13797 0 523 63.546 0.00055018 -3.53956 63.546000 Cu 0.860406 0.115511 0 525 63.546 0.00103712 -3.53898 63.546000 Cu 0.950751 0.117247 1.22431e-16 526 63.546 0.000475554 -3.53985 63.546000 Cu 0.901456 0.127631 0.5 528 63.546 0.000210817 -3.53975 63.546000 Cu 0.942491 0.139808 1.21952e-16 555 63.546 0.000279932 -3.54019 63.546000 Cu 0.991665 0.129444 0.5 557 63.546 0.000834486 -3.54027 63.546000 Cu 0.0245577 0.164342 9.46383e-18 593 63.546 0.000305421 -3.54042 63.546000 Cu 0.114696 0.166431 1.19795e-19 594 63.546 0.000199508 -3.53996 63.546000 Cu 0.0735848 0.154074 0.5 595 63.546 0.000442714 -3.5403 63.546000 Cu 0.0657509 0.176657 0.5 596 63.546 0.000220314 -3.54016 63.546000 Cu 0.163687 0.156245 0.5 600 63.546 0.000116683 -3.53979 63.546000 Cu 0.155899 0.178785 0.5 639 63.546 4.74554e-05 -3.53977 63.546000 Cu 0.302999 0.148235 1 645 63.546 0.00080455 -3.5393 63.546000 Cu 0.204842 0.168611 1.2279e-16 641 63.546 0.000199496 -3.53971 63.546000 Cu 0.29511 0.170722 1 642 63.546 0.000393946 -3.53956 63.546000 Cu 0.253878 0.158434 0.5 643 63.546 0.00048491 -3.53952 63.546000 Cu 0.246104 0.180934 0.5 644 63.546 0.000218543 -3.53963 63.546000 Cu 0.344169 0.160462 0.5 648 63.546 0.000290862 -3.53956 63.546000 Cu 0.336388 0.182971 0.5 687 63.546 0.000103322 -3.53974 63.546000 Cu 0.393294 0.150157 1.22431e-16 646 63.546 0.000142484 -3.5399 63.546000 Cu 0.385375 0.172688 2.53008e-16 689 63.546 9.22601e-05 -3.53987 63.546000 Cu 0.475574 0.174637 1.60046e-16 690 63.546 0.000122821 -3.54039 63.546000 Cu 0.434408 0.162372 0.5 691 63.546 0.000184663 -3.54012 63.546000 Cu 0.426602 0.184939 0.5 692 63.546 2.93772e-05 -3.54027 63.546000 Cu 0.483488 0.152052 1.18717e-16 693 63.546 0.000342305 -3.54034 63.546000 Cu 0.573585 0.154074 2.4594e-16 694 63.546 0.000442714 -3.5403 63.546000 Cu 0.524558 0.164342 0.5 696 63.546 0.000305421 -3.54042 63.546000 Cu 0.565751 0.176657 1.77896e-16 737 63.546 0.000220314 -3.54016 63.546000 Cu 0.655899 0.178785 1 738 63.546 4.74554e-05 -3.53977 63.546000 Cu 0.614696 0.166431 0.5 739 63.546 0.000199508 -3.53996 63.546000 Cu 0.663687 0.156245 1.64719e-16 741 63.546 0.000116683 -3.53979 63.546000 Cu 0.802999 0.148235 0.5 746 63.546 0.00080455 -3.5393 63.546000 Cu 0.753878 0.158434 2.5732e-16 742 63.546 0.00048491 -3.53952 63.546000 Cu 0.704842 0.168611 0.5 744 63.546 0.000199496 -3.53971 63.546000 Cu 0.746104 0.180934 1 785 63.546 0.000218543 -3.53963 63.546000 Cu 0.79511 0.170722 0.5 786 63.546 0.000393946 -3.53956 63.546000 Cu 0.836388 0.182971 1 550 63.546 0.000103322 -3.53974 63.546000 Cu 0.844169 0.160462 1 551 63.546 0.000290862 -3.53956 63.546000 Cu 0.934408 0.162372 5.98976e-18 552 63.546 0.000184663 -3.54012 63.546000 Cu 0.893294 0.150157 0.5 553 63.546 0.000142484 -3.5399 63.546000 Cu 0.885375 0.172688 0.5 554 63.546 9.22601e-05 -3.53987 63.546000 Cu 0.983488 0.152052 0.5 558 63.546 0.000342305 -3.54034 63.546000 Cu 0.926602 0.184939 1 589 63.546 2.93772e-05 -3.54027 63.546000 Cu 0.975574 0.174637 0.5 591 63.546 0.000122821 -3.54039 63.546000 Cu 0.0168016 0.186924 1 590 63.546 9.03437e-05 -3.54023 63.546000 Cu 0.0991932 0.211531 2.37913e-16 634 63.546 0.000344507 -3.54015 63.546000 Cu 0.0580547 0.199219 0.5 635 63.546 0.000261787 -3.54012 63.546000 Cu 0.0500356 0.221778 0.5 636 63.546 0.000150257 -3.54003 63.546000 Cu 0.106987 0.188984 6.97208e-17 637 63.546 0.000147944 -3.53998 63.546000 Cu 0.148238 0.201325 0.5 640 63.546 0.000179143 -3.53999 63.546000 Cu 0.00904161 0.209482 0 633 63.546 0.000319534 -3.54001 63.546000 Cu 0.197175 0.191131 3.22249e-17 638 63.546 8.08815e-05 -3.53978 63.546000 Cu 0.189366 0.213656 0 681 63.546 0.000251665 -3.53968 63.546000 Cu 0.279546 0.21574 1 682 63.546 0.000184545 -3.5398 63.546000 Cu 0.238425 0.20345 0.5 683 63.546 0.000262589 -3.5397 63.546000 Cu 0.287402 0.193222 1.2267e-16 685 63.546 0.00012637 -3.53979 63.546000 Cu 0.32867 0.205501 0.5 688 63.546 0.000287002 -3.54012 63.546000 Cu 0.37767 0.195231 0 686 63.546 8.05586e-05 -3.54019 63.546000 Cu 0.369755 0.21778 1 729 63.546 0.00024674 -3.54013 63.546000 Cu 0.459905 0.219764 3.59386e-19 730 63.546 0.0001531 -3.53997 63.546000 Cu 0.418878 0.207501 0.5 731 63.546 0.000267764 -3.54006 63.546000 Cu 0.467874 0.19721 1 733 63.546 0.000100236 -3.54012 63.546000 Cu 0.509042 0.209482 0.5 736 63.546 0.000319534 -3.54001 63.546000 Cu 0.558055 0.199219 1.44952e-16 734 63.546 0.000261787 -3.54012 63.546000 Cu 0.516802 0.186924 0.5 735 63.546 9.03437e-05 -3.54023 63.546000 Cu 0.606987 0.188984 0.5 740 63.546 0.000147944 -3.53998 63.546000 Cu 0.550036 0.221778 0 777 63.546 0.000150257 -3.54003 63.546000 Cu 0.599193 0.211531 0.5 779 63.546 0.000344507 -3.54015 63.546000 Cu 0.648238 0.201325 2.1635e-16 781 63.546 0.000179143 -3.53999 63.546000 Cu 0.82867 0.205501 2.31205e-16 585 63.546 0.000287002 -3.54012 63.546000 Cu 0.738425 0.20345 3.59386e-19 782 63.546 0.000262589 -3.5397 63.546000 Cu 0.697175 0.191131 0.5 783 63.546 8.08815e-05 -3.53978 63.546000 Cu 0.689366 0.213656 0.5 784 63.546 0.000251665 -3.53968 63.546000 Cu 0.787402 0.193222 0.5 787 63.546 0.00012637 -3.53979 63.546000 Cu 0.779546 0.21574 0.5 826 63.546 0.000184545 -3.5398 63.546000 Cu 0.918878 0.207501 0 586 63.546 0.000267764 -3.54006 63.546000 Cu 0.87767 0.195231 0.5 587 63.546 8.05586e-05 -3.54019 63.546000 Cu 0.869755 0.21778 0.5 588 63.546 0.00024674 -3.54013 63.546000 Cu 0.967874 0.19721 0.5 592 63.546 0.000100236 -3.54012 63.546000 Cu 0.959905 0.219764 0.5 631 63.546 0.0001531 -3.53997 63.546000 Cu 0.0826338 0.256595 1 674 63.546 0.000107 -3.54002 63.546000 Cu 0.0417099 0.244316 0.5 675 63.546 6.11187e-05 -3.5399 63.546000 Cu 0.0909471 0.234068 3.14343e-16 677 63.546 9.35117e-05 -3.5398 63.546000 Cu 0.140184 0.223855 0.5 679 63.546 9.7427e-05 -3.53979 63.546000 Cu 0.131862 0.246364 0.5 680 63.546 6.48237e-05 -3.53978 63.546000 Cu 0.000823206 0.232039 2.11439e-16 630 63.546 5.71226e-05 -3.53998 63.546000 Cu 0.181118 0.236162 1.7574e-16 678 63.546 8.5876e-06 -3.53975 63.546000 Cu 0.172782 0.258665 2.64987e-16 721 63.546 8.04247e-05 -3.53963 63.546000 Cu 0.230351 0.225963 0.5 684 63.546 7.86757e-05 -3.53964 63.546000 Cu 0.222066 0.248467 0.5 723 63.546 1.2751e-05 -3.53975 63.546000 Cu 0.271322 0.238257 0 725 63.546 4.71013e-05 -3.53968 63.546000 Cu 0.320522 0.228032 0.5 727 63.546 7.98616e-05 -3.5399 63.546000 Cu 0.312215 0.250556 0.5 728 63.546 3.4501e-05 -3.5397 63.546000 Cu 0.361439 0.240325 2.44862e-16 726 63.546 0.000116234 -3.53989 63.546000 Cu 0.410682 0.230052 0.5 732 63.546 4.39738e-05 -3.54016 63.546000 Cu 0.402328 0.252607 0.5 771 63.546 0.00011713 -3.53988 63.546000 Cu 0.451571 0.242322 1.72385e-16 773 63.546 5.4508e-07 -3.54015 63.546000 Cu 0.49246 0.25459 0.5 776 63.546 5.33402e-05 -3.54023 63.546000 Cu 0.500823 0.232039 0.5 775 63.546 5.71226e-05 -3.53998 63.546000 Cu 0.54171 0.244316 0 774 63.546 6.11187e-05 -3.5399 63.546000 Cu 0.640184 0.223855 1 778 63.546 9.7427e-05 -3.53979 63.546000 Cu 0.590947 0.234068 0.5 780 63.546 9.35117e-05 -3.5398 63.546000 Cu 0.582634 0.256595 0.5 819 63.546 0.000107 -3.54002 63.546000 Cu 0.631862 0.246364 1 821 63.546 6.48237e-05 -3.53978 63.546000 Cu 0.681118 0.236162 0.5 823 63.546 8.5876e-06 -3.53975 63.546000 Cu 0.672782 0.258665 0.5 824 63.546 8.04247e-05 -3.53963 63.546000 Cu 0.820522 0.228032 2.39591e-19 584 63.546 7.98616e-05 -3.5399 63.546000 Cu 0.812215 0.250556 1 625 63.546 3.4501e-05 -3.5397 63.546000 Cu 0.722066 0.248467 0 822 63.546 1.2751e-05 -3.53975 63.546000 Cu 0.730351 0.225963 3.59386e-19 825 63.546 7.86757e-05 -3.53964 63.546000 Cu 0.771322 0.238257 0.5 827 63.546 4.71013e-05 -3.53968 63.546000 Cu 0.902328 0.252607 0 626 63.546 0.00011713 -3.53988 63.546000 Cu 0.861439 0.240325 0.5 627 63.546 0.000116234 -3.53989 63.546000 Cu 0.910682 0.230052 0 629 63.546 4.39738e-05 -3.54016 63.546000 Cu 0.951571 0.242322 0.5 632 63.546 5.4508e-07 -3.54015 63.546000 Cu 0.99246 0.25459 1 673 63.546 5.33402e-05 -3.54023 63.546000 Cu 0.0334307 0.266861 0.5 676 63.546 5.57865e-05 -3.54029 63.546000 Cu 0.0252784 0.289413 0.5 715 63.546 7.54644e-05 -3.53989 63.546000 Cu 0.0744215 0.279141 1.22311e-16 717 63.546 5.43246e-05 -3.53998 63.546000 Cu 0.164627 0.28117 3.17457e-16 718 63.546 0.000156808 -3.53966 63.546000 Cu 0.123594 0.268883 0.5 719 63.546 0.000109817 -3.53993 63.546000 Cu 0.115444 0.291405 0.5 720 63.546 0.00020281 -3.53978 63.546000 Cu 0.262975 0.260769 1 722 63.546 8.13952e-05 -3.53989 63.546000 Cu 0.213799 0.270967 0.5 724 63.546 5.75396e-05 -3.53965 63.546000 Cu 0.205701 0.29346 0.5 763 63.546 0.000294661 -3.53951 63.546000 Cu 0.254842 0.28329 1.19795e-19 765 63.546 4.50373e-05 -3.53969 63.546000 Cu 0.303989 0.27309 0.5 767 63.546 8.6366e-05 -3.54012 63.546000 Cu 0.295886 0.295619 0.5 768 63.546 0.000177283 -3.53977 63.546000 Cu 0.345008 0.285408 1.72385e-16 766 63.546 0.000141875 -3.54027 63.546000 Cu 0.353116 0.26286 1.47947e-16 769 63.546 0.000156902 -3.53988 63.546000 Cu 0.443245 0.26488 0 770 63.546 0.000128152 -3.54012 63.546000 Cu 0.394149 0.275153 0.5 772 63.546 8.20544e-05 -3.5402 63.546000 Cu 0.435173 0.287448 1.22311e-16 813 63.546 0.000107509 -3.54014 63.546000 Cu 0.484278 0.277149 0.5 815 63.546 1.41731e-05 -3.54006 63.546000 Cu 0.525278 0.289413 0 814 63.546 7.54644e-05 -3.53989 63.546000 Cu 0.533431 0.266861 8.5414e-17 817 63.546 5.57865e-05 -3.54029 63.546000 Cu 0.623594 0.268883 1 818 63.546 0.000109817 -3.53993 63.546000 Cu 0.574421 0.279141 0.5 820 63.546 5.43246e-05 -3.53998 63.546000 Cu 0.615444 0.291405 1 861 63.546 0.00020281 -3.53978 63.546000 Cu 0.664627 0.28117 0.5 863 63.546 0.000156808 -3.53966 63.546000 Cu 0.705701 0.29346 2.79003e-16 862 63.546 0.000294661 -3.53951 63.546000 Cu 0.713799 0.270967 1 865 63.546 5.75396e-05 -3.53965 63.546000 Cu 0.803989 0.27309 1 866 63.546 8.6366e-05 -3.54012 63.546000 Cu 0.762975 0.260769 0.5 867 63.546 8.13952e-05 -3.53989 63.546000 Cu 0.754842 0.28329 0.5 868 63.546 4.50373e-05 -3.53969 63.546000 Cu 0.795886 0.295619 2.44981e-16 907 63.546 0.000177283 -3.53977 63.546000 Cu 0.845008 0.285408 0.5 667 63.546 0.000141875 -3.54027 63.546000 Cu 0.853116 0.26286 0.5 628 63.546 0.000156902 -3.53988 63.546000 Cu 0.894149 0.275153 1 669 63.546 8.20544e-05 -3.5402 63.546000 Cu 0.984278 0.277149 1.57531e-16 670 63.546 1.41731e-05 -3.54006 63.546000 Cu 0.943245 0.26488 0.5 671 63.546 0.000128152 -3.54012 63.546000 Cu 0.935173 0.287448 0.5 672 63.546 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0.00416586 -3.53778 63.546000 Cu 0.250909 0.43101 0.5 886 63.546 0.0158693 -3.53444 63.546000 Cu 0.291298 0.444271 1 917 63.546 0.0601514 -3.538 63.546000 Cu 0.347943 0.411116 0.5 890 63.546 0.0145724 -3.54097 63.546000 Cu 0.339903 0.434094 0.5 919 63.546 0.0370351 -3.54026 63.546000 Cu 0.388715 0.423553 2.47976e-16 921 63.546 0.0150091 -3.54005 63.546000 Cu 0.478782 0.424882 1 922 63.546 0.00226262 -3.53858 63.546000 Cu 0.437701 0.412909 0.5 923 63.546 0.00486794 -3.5398 63.546000 Cu 0.429514 0.435681 0.5 924 63.546 0.00784873 -3.53764 63.546000 Cu 0.528054 0.414206 0.5 928 63.546 0.00162592 -3.53886 63.546000 Cu 0.519884 0.43666 0.5 949 63.546 0.00243638 -3.53761 63.546000 Cu 0.569448 0.42602 1 951 63.546 0.00551443 -3.53763 63.546000 Cu 0.660507 0.427668 1 952 63.546 0.0470087 -3.52991 63.546000 Cu 0.618866 0.415644 0.5 953 63.546 0.0131909 -3.53603 63.546000 Cu 0.610931 0.437776 0.5 954 63.546 0.0235706 -3.53482 63.546000 Cu 0.758422 0.408378 2.44742e-16 956 63.546 0.00416586 -3.53778 63.546000 Cu 0.70969 0.417992 0.5 958 63.546 0.022016 -3.53106 63.546000 Cu 0.702172 0.440109 0.5 970 63.546 0.0939864 -3.51587 63.546000 Cu 0.750909 0.43101 1.45551e-16 972 63.546 0.0158693 -3.53444 63.546000 Cu 0.799323 0.421276 0.5 973 63.546 0.0184859 -3.5402 63.546000 Cu 0.791298 0.444271 0.5 974 63.546 0.0601514 -3.538 63.546000 Cu 0.839903 0.434094 3.58188e-16 788 63.546 0.0370351 -3.54026 63.546000 Cu 0.847943 0.411116 2.45101e-16 789 63.546 0.0145724 -3.54097 63.546000 Cu 0.937701 0.412909 1 790 63.546 0.00486794 -3.5398 63.546000 Cu 0.888715 0.423553 0.5 792 63.546 0.0150091 -3.54005 63.546000 Cu 0.929514 0.435681 1 833 63.546 0.00784873 -3.53764 63.546000 Cu 0.978782 0.424882 0.5 835 63.546 0.00226262 -3.53858 63.546000 Cu 0.10248 0.459792 1.22311e-16 876 63.546 0.0289916 -3.53384 63.546000 Cu 0.0611468 0.448283 0.5 877 63.546 0.0063342 -3.53695 63.546000 Cu 0.0526495 0.470506 0.5 878 63.546 0.0201395 -3.53577 63.546000 Cu 0.152634 0.449563 0.5 882 63.546 0.135451 -3.52216 63.546000 Cu 0.143931 0.471158 0.5 911 63.546 0.421184 -3.49968 63.546000 Cu 0.0113384 0.459095 0 875 63.546 0.00445486 -3.53538 63.546000 Cu 0.194333 0.461792 3.6298e-17 913 63.546 0.515634 -3.46569 63.546000 Cu 0.282561 0.467646 5.27099e-18 914 63.546 0.264657 -3.51311 63.546000 Cu 0.243379 0.453813 0.5 915 63.546 0.0876623 -3.51838 63.546000 Cu 0.235848 0.477162 0.5 916 63.546 5.58888 -3.41895 63.546000 Cu 0.331407 0.457338 0.5 920 63.546 0.0944348 -3.53226 63.546000 Cu 0.322293 0.481066 0.5 941 63.546 0.343704 -3.49894 63.546000 Cu 0.380332 0.446538 1.84125e-16 918 63.546 0.0285472 -3.53666 63.546000 Cu 0.371489 0.46969 2.19225e-16 943 63.546 0.053353 -3.52592 63.546000 Cu 0.461883 0.470159 1 944 63.546 0.0152684 -3.53355 63.546000 Cu 0.420893 0.458518 0.5 945 63.546 0.00972784 -3.53223 63.546000 Cu 0.413028 0.481401 0.5 946 63.546 0.0607474 -3.53173 63.546000 Cu 0.470347 0.447504 1 947 63.546 0.00311205 -3.5358 63.546000 Cu 0.511338 0.459095 0.5 950 63.546 0.00445486 -3.53538 63.546000 Cu 0.561147 0.448283 0 948 63.546 0.0063342 -3.53695 63.546000 Cu 0.55265 0.470506 2.24017e-17 964 63.546 0.0201395 -3.53577 63.546000 Cu 0.643931 0.471158 1.3477e-16 965 63.546 0.421184 -3.49968 63.546000 Cu 0.60248 0.459792 0.5 966 63.546 0.0289916 -3.53384 63.546000 Cu 0.652634 0.449563 1.2279e-16 968 63.546 0.135451 -3.52216 63.546000 Cu 0.782561 0.467646 0.5 15 63.546 0.264657 -3.51311 63.546000 Cu 0.735848 0.477162 1 60 63.546 5.58888 -3.41895 63.546000 Cu 0.822293 0.481066 2.25215e-17 828 63.546 0.343704 -3.49894 63.546000 Cu 0.831407 0.457338 1.22551e-16 829 63.546 0.0944348 -3.53226 63.546000 Cu 0.743379 0.453813 1 969 63.546 0.0876623 -3.51838 63.546000 Cu 0.694333 0.461792 0.5 971 63.546 0.515634 -3.46569 63.546000 Cu 0.920893 0.458518 1.22311e-16 830 63.546 0.00972784 -3.53223 63.546000 Cu 0.880332 0.446538 0.5 831 63.546 0.0285472 -3.53666 63.546000 Cu 0.871489 0.46969 0.5 832 63.546 0.053353 -3.52592 63.546000 Cu 0.970347 0.447504 0.5 836 63.546 0.00311205 -3.5358 63.546000 Cu 0.913028 0.481401 1.1716e-16 871 63.546 0.0607474 -3.53173 63.546000 Cu 0.961883 0.470159 0.5 873 63.546 0.0152684 -3.53355 63.546000 Cu 0.0941897 0.503893 1 1 63.546 0.090267 -3.53365 63.546000 Cu 0.143415 0.514542 0.5 2 63.546 0.44788 -3.49991 63.546000 Cu 0.00365268 0.504063 1 4 63.546 0.0586855 -3.53821 63.546000 Cu 0.0521875 0.515144 0.5 6 63.546 0.021589 -3.53599 63.546000 Cu 0.0481468 0.492824 0.5 908 63.546 0.0708691 -3.54248 63.546000 Cu 0.0944875 0.481793 1.2279e-16 909 63.546 0.0846164 -3.53373 63.546000 Cu 0.13901 0.492842 0.5 912 63.546 3.2198 -3.4691 63.546000 Cu 0.0039484 0.481569 2.45101e-16 872 63.546 0.0539089 -3.53784 63.546000 Cu 0.184512 0.482643 1 910 63.546 7.13339 -3.26104 63.546000 Cu 0.184081 0.503088 1 92 63.546 7.12604 -3.25682 63.546000 Cu 0.235533 0.508422 0.5 938 63.546 5.57251 -3.41691 63.546000 Cu 0.270309 0.492818 1.43754e-18 939 63.546 4.50648 -3.52622 63.546000 Cu 0.322002 0.50454 0.5 942 63.546 0.344253 -3.49936 63.546000 Cu 0.281985 0.51797 1 95 63.546 0.268572 -3.51307 63.546000 Cu 0.370986 0.515902 1 58 63.546 0.0583171 -3.52675 63.546000 Cu 0.412773 0.504194 0.5 59 63.546 0.0629489 -3.53214 63.546000 Cu 0.461402 0.515471 2.09402e-16 61 63.546 0.0178622 -3.53389 63.546000 Cu 0.365166 0.492803 2.42705e-16 940 63.546 0.200909 -3.52263 63.546000 Cu 0.457035 0.492811 1.98621e-16 961 63.546 0.0911216 -3.54144 63.546000 Cu 0.503948 0.481569 0.5 963 63.546 0.0539089 -3.53784 63.546000 Cu 0.552187 0.515144 0 32 63.546 0.021589 -3.53599 63.546000 Cu 0.59419 0.503893 0.5 33 63.546 0.090267 -3.53365 63.546000 Cu 0.503653 0.504063 0.5 34 63.546 0.0586855 -3.53821 63.546000 Cu 0.643415 0.514542 1.22311e-16 35 63.546 0.44788 -3.49991 63.546000 Cu 0.63901 0.492842 4.01314e-17 490 63.546 3.2198 -3.4691 63.546000 Cu 0.548147 0.492824 9.17632e-17 962 63.546 0.0708691 -3.54248 63.546000 Cu 0.594488 0.481793 0.5 967 63.546 0.0846164 -3.53373 63.546000 Cu 0.684512 0.482643 0.5 94 63.546 7.13339 -3.26104 63.546000 Cu 0.770309 0.492818 0.5 13 63.546 4.50648 -3.52622 63.546000 Cu 0.684081 0.503088 0.5 14 63.546 7.12604 -3.25682 63.546000 Cu 0.735533 0.508422 4.51508e-16 469 63.546 5.57251 -3.41691 63.546000 Cu 0.822002 0.50454 1 869 63.546 0.344253 -3.49936 63.546000 Cu 0.781985 0.51797 0.5 18 63.546 0.268572 -3.51307 63.546000 Cu 0.912773 0.504194 0 3 63.546 0.0629489 -3.53214 63.546000 Cu 0.961402 0.515471 0.5 7 63.546 0.0178622 -3.53389 63.546000 Cu 0.870986 0.515902 0.5 17 63.546 0.0583171 -3.52675 63.546000 Cu 0.865166 0.492803 0.5 870 63.546 0.200909 -3.52263 63.546000 Cu 0.957035 0.492811 0.5 874 63.546 0.0911216 -3.54144 63.546000 Cu 0.0107342 0.526537 1.22311e-16 5 63.546 0.00528192 -3.53559 63.546000 Cu 0.101856 0.5259 1 8 63.546 0.031666 -3.53392 63.546000 Cu 0.110361 0.547911 1.2279e-16 9 63.546 0.0262425 -3.53447 63.546000 Cu 0.0605176 0.537378 0.5 11 63.546 0.00647589 -3.53666 63.546000 Cu 0.0193792 0.548976 2.44862e-16 23 63.546 0.00224279 -3.53709 63.546000 Cu 0.151978 0.53614 0.5 10 63.546 0.144823 -3.5218 63.546000 Cu 0.193739 0.523917 1 93 63.546 0.553154 -3.46194 63.546000 Cu 0.290675 0.54134 1 96 63.546 0.0623162 -3.53814 63.546000 Cu 0.242769 0.531825 0.5 98 63.546 0.0928538 -3.51702 63.546000 Cu 0.201588 0.545564 3.59386e-19 134 63.546 0.0979364 -3.51482 63.546000 Cu 0.250495 0.554612 0.5 136 63.546 0.0162611 -3.53489 63.546000 Cu 0.330787 0.528261 0.5 97 63.546 0.0969071 -3.53235 63.546000 Cu 0.469757 0.538117 1 62 63.546 0.00325716 -3.53563 63.546000 Cu 0.420272 0.527083 0.5 64 63.546 0.0115637 -3.53224 63.546000 Cu 0.379726 0.539052 1 99 63.546 0.0307336 -3.53667 63.546000 Cu 0.429027 0.549922 0.5 101 63.546 0.00803191 -3.53716 63.546000 Cu 0.339463 0.551493 0.5 102 63.546 0.0392659 -3.54045 63.546000 Cu 0.601856 0.5259 0.5 38 63.546 0.031666 -3.53392 63.546000 Cu 0.510734 0.526537 0.5 63 63.546 0.00528192 -3.53559 63.546000 Cu 0.560518 0.537378 0 65 63.546 0.00647589 -3.53666 63.546000 Cu 0.610361 0.547911 0.5 67 63.546 0.0262425 -3.53447 63.546000 Cu 0.519379 0.548976 0.5 68 63.546 0.00224279 -3.53709 63.546000 Cu 0.651978 0.53614 2.44502e-16 36 63.546 0.144823 -3.5218 63.546000 Cu 0.693739 0.523917 0.5 37 63.546 0.553154 -3.46194 63.546000 Cu 0.742769 0.531825 0 39 63.546 0.0928538 -3.51702 63.546000 Cu 0.750495 0.554612 2.45101e-16 40 63.546 0.0162611 -3.53489 63.546000 Cu 0.790675 0.54134 0.5 41 63.546 0.0623162 -3.53814 63.546000 Cu 0.701588 0.545564 0.5 42 63.546 0.0979364 -3.51482 63.546000 Cu 0.830787 0.528261 2.46299e-16 16 63.546 0.0969071 -3.53235 63.546000 Cu 0.920272 0.527083 0 19 63.546 0.0115637 -3.53224 63.546000 Cu 0.929027 0.549922 1.22311e-16 20 63.546 0.00803191 -3.53716 63.546000 Cu 0.969757 0.538117 0.5 21 63.546 0.00325716 -3.53563 63.546000 Cu 0.879726 0.539052 0.5 22 63.546 0.0307336 -3.53667 63.546000 Cu 0.839463 0.551493 3.67652e-16 43 63.546 0.0392659 -3.54045 63.546000 Cu 0.0281422 0.57142 1.22431e-16 24 63.546 0.00146833 -3.53803 63.546000 Cu 0.0691095 0.559639 0.5 25 63.546 0.00585116 -3.53712 63.546000 Cu 0.118886 0.570035 3.39021e-17 27 63.546 0.0156998 -3.53594 63.546000 Cu 0.127564 0.592266 4.25273e-17 28 63.546 0.00808125 -3.53701 63.546000 Cu 0.077868 0.581951 0.5 30 63.546 0.0040901 -3.53775 63.546000 Cu 0.160129 0.558014 0.5 12 63.546 0.0516621 -3.53015 63.546000 Cu 0.168546 0.580115 0.5 29 63.546 0.0186767 -3.5349 63.546000 Cu 0.209672 0.567654 1.23389e-17 135 63.546 0.0229518 -3.53166 63.546000 Cu 0.299149 0.564317 1.18597e-16 137 63.546 0.0196621 -3.54058 63.546000 Cu 0.307771 0.587099 2.0461e-16 138 63.546 0.00701069 -3.54096 63.546000 Cu 0.258729 0.577226 0.5 140 63.546 0.00408577 -3.53839 63.546000 Cu 0.218036 0.589951 1 174 63.546 0.00698707 -3.53651 63.546000 Cu 0.388505 0.562026 1.89277e-17 100 63.546 0.0165744 -3.53968 63.546000 Cu 0.478507 0.560732 1 103 63.546 0.00226304 -3.53775 63.546000 Cu 0.437856 0.57268 0.5 106 63.546 0.00516731 -3.53915 63.546000 Cu 0.348154 0.574455 0.5 139 63.546 0.0161495 -3.54128 63.546000 Cu 0.397366 0.584859 1 141 63.546 0.00810914 -3.54048 63.546000 Cu 0.487394 0.583319 4.32461e-17 104 63.546 0.00142249 -3.53906 63.546000 Cu 0.569109 0.559639 1 66 63.546 0.00585116 -3.53712 63.546000 Cu 0.618886 0.570035 0.5 72 63.546 0.0156998 -3.53594 63.546000 Cu 0.528142 0.57142 0.5 105 63.546 0.00146833 -3.53803 63.546000 Cu 0.577868 0.581951 1.18597e-16 107 63.546 0.0040901 -3.53775 63.546000 Cu 0.627564 0.592266 0.5 109 63.546 0.00808125 -3.53701 63.546000 Cu 0.660129 0.558014 1.55614e-16 69 63.546 0.0516621 -3.53015 63.546000 Cu 0.799149 0.564317 0.5 46 63.546 0.0196621 -3.54058 63.546000 Cu 0.668546 0.580115 2.39591e-19 70 63.546 0.0186767 -3.5349 63.546000 Cu 0.709672 0.567654 0.5 71 63.546 0.0229518 -3.53166 63.546000 Cu 0.758729 0.577226 1 73 63.546 0.00408577 -3.53839 63.546000 Cu 0.807771 0.587099 0.5 75 63.546 0.00701069 -3.54096 63.546000 Cu 0.718036 0.589951 0.5 76 63.546 0.00698707 -3.53651 63.546000 Cu 0.987394 0.583319 0.5 49 63.546 0.00142249 -3.53906 63.546000 Cu 0.978507 0.560732 0.5 26 63.546 0.00226304 -3.53775 63.546000 Cu 0.848154 0.574455 1 44 63.546 0.0161495 -3.54128 63.546000 Cu 0.888505 0.562026 0.5 45 63.546 0.0165744 -3.53968 63.546000 Cu 0.937856 0.57268 0 47 63.546 0.00516731 -3.53915 63.546000 Cu 0.897366 0.584859 0.5 50 63.546 0.00810914 -3.54048 63.546000 Cu 0.0370444 0.593872 3.76517e-16 51 63.546 0.000785551 -3.53879 63.546000 Cu 0.0459809 0.616344 2.24017e-17 52 63.546 0.000567697 -3.53908 63.546000 Cu 0.0866977 0.604309 0.5 53 63.546 0.00260189 -3.53835 63.546000 Cu 0.136355 0.614576 3.59386e-19 55 63.546 0.00382059 -3.53838 63.546000 Cu 0.0957156 0.626714 0.5 57 63.546 0.0014943 -3.53875 63.546000 Cu 0.00543298 0.628442 0.5 83 63.546 0.000423169 -3.53962 63.546000 Cu 0.177178 0.602358 0.5 31 63.546 0.00672379 -3.53718 63.546000 Cu 0.226705 0.612324 9.08048e-17 175 63.546 0.00217666 -3.53858 63.546000 Cu 0.267304 0.599777 0.5 176 63.546 0.0014575 -3.53942 63.546000 Cu 0.276171 0.622307 0.5 180 63.546 0.000519655 -3.53999 63.546000 Cu 0.186098 0.624709 0.5 214 63.546 0.002776 -3.53867 63.546000 Cu 0.316579 0.609772 0 177 63.546 0.00262054 -3.54082 63.546000 Cu 0.406341 0.607583 0 142 63.546 0.0040673 -3.54041 63.546000 Cu 0.446797 0.595377 0.5 143 63.546 0.00255144 -3.53982 63.546000 Cu 0.356988 0.597249 0.5 144 63.546 0.00699534 -3.54115 63.546000 Cu 0.455826 0.618012 0.5 148 63.546 0.00133137 -3.53978 63.546000 Cu 0.36595 0.619945 0.5 179 63.546 0.00301571 -3.54075 63.546000 Cu 0.496345 0.605887 1.72505e-16 145 63.546 0.000737864 -3.53947 63.546000 Cu 0.586698 0.604309 1.72505e-16 108 63.546 0.00260189 -3.53835 63.546000 Cu 0.537044 0.593872 0.5 110 63.546 0.000785551 -3.53879 63.546000 Cu 0.636355 0.614576 0.5 114 63.546 0.00382059 -3.53838 63.546000 Cu 0.505433 0.628442 2.44981e-16 146 63.546 0.000423169 -3.53962 63.546000 Cu 0.545981 0.616344 0.5 147 63.546 0.000567697 -3.53908 63.546000 Cu 0.595716 0.626714 1.32973e-17 149 63.546 0.0014943 -3.53875 63.546000 Cu 0.767304 0.599777 5.17516e-17 74 63.546 0.0014575 -3.53942 63.546000 Cu 0.677178 0.602358 3.92929e-17 111 63.546 0.00672379 -3.53718 63.546000 Cu 0.686098 0.624709 1.58369e-16 112 63.546 0.002776 -3.53867 63.546000 Cu 0.726705 0.612324 0.5 113 63.546 0.00217666 -3.53858 63.546000 Cu 0.776171 0.622307 0 115 63.546 0.000519655 -3.53999 63.546000 Cu 0.816579 0.609772 0.5 80 63.546 0.00262054 -3.54082 63.546000 Cu 0.996345 0.605887 0.5 54 63.546 0.000737864 -3.53947 63.546000 Cu 0.946797 0.595377 3.59386e-19 48 63.546 0.00255144 -3.53982 63.546000 Cu 0.856988 0.597249 2.81519e-17 77 63.546 0.00699534 -3.54115 63.546000 Cu 0.86595 0.619945 1.40759e-16 78 63.546 0.00301571 -3.54075 63.546000 Cu 0.906341 0.607583 0.5 79 63.546 0.0040673 -3.54041 63.546000 Cu 0.955826 0.618012 1 81 63.546 0.00133137 -3.53978 63.546000 Cu 0.145465 0.636953 1 56 63.546 0.0015913 -3.53866 63.546000 Cu 0.0551564 0.63882 0 85 63.546 0.000270552 -3.53951 63.546000 Cu 0.0643255 0.661319 3.27041e-17 86 63.546 0.000455856 -3.53978 63.546000 Cu 0.104894 0.649138 0.5 87 63.546 0.000673382 -3.53924 63.546000 Cu 0.0146501 0.650986 0.5 88 63.546 0.000144045 -3.53973 63.546000 Cu 0.154538 0.659379 3.67771e-16 89 63.546 0.000909281 -3.53901 63.546000 Cu 0.2357 0.634771 3.1626e-16 215 63.546 0.0010122 -3.53938 63.546000 Cu 0.244662 0.657239 0 216 63.546 0.000427546 -3.53951 63.546000 Cu 0.285243 0.644841 0.5 217 63.546 0.000362778 -3.54005 63.546000 Cu 0.195122 0.647107 0.5 218 63.546 0.000915386 -3.53891 63.546000 Cu 0.325647 0.63239 1.18597e-16 178 63.546 0.00111688 -3.54029 63.546000 Cu 0.415432 0.630244 1.2279e-16 181 63.546 0.00206841 -3.54037 63.546000 Cu 0.424597 0.652872 1.43874e-16 182 63.546 0.00084762 -3.54022 63.546000 Cu 0.464996 0.64062 0.5 183 63.546 0.000611726 -3.53993 63.546000 Cu 0.375067 0.642592 0.5 184 63.546 0.00123131 -3.54031 63.546000 Cu 0.474142 0.663178 0.5 188 63.546 0.0006398 -3.54008 63.546000 Cu 0.334666 0.654975 3.80949e-17 219 63.546 0.000595746 -3.54022 63.546000 Cu 0.384072 0.665185 0.5 221 63.546 0.000609669 -3.54049 63.546000 Cu 0.604894 0.649138 1.78255e-16 150 63.546 0.000673382 -3.53924 63.546000 Cu 0.645465 0.636953 0.5 151 63.546 0.0015913 -3.53866 63.546000 Cu 0.555156 0.63882 0.5 152 63.546 0.000270552 -3.53951 63.546000 Cu 0.51465 0.650986 0 185 63.546 0.000144045 -3.53973 63.546000 Cu 0.564326 0.661319 0.5 187 63.546 0.000455856 -3.53978 63.546000 Cu 0.654538 0.659379 0.5 156 63.546 0.000909281 -3.53901 63.546000 Cu 0.785243 0.644841 1.2267e-16 116 63.546 0.000362778 -3.54005 63.546000 Cu 0.7357 0.634771 0.5 118 63.546 0.0010122 -3.53938 63.546000 Cu 0.695122 0.647107 1.18717e-16 153 63.546 0.000915386 -3.53891 63.546000 Cu 0.744662 0.657239 0.5 155 63.546 0.000427546 -3.53951 63.546000 Cu 0.825647 0.63239 0.5 117 63.546 0.00111688 -3.54029 63.546000 Cu 0.964996 0.64062 6.98406e-17 82 63.546 0.000611726 -3.53993 63.546000 Cu 0.915432 0.630244 0.5 84 63.546 0.00206841 -3.54037 63.546000 Cu 0.875067 0.642592 2.84873e-16 119 63.546 0.00123131 -3.54031 63.546000 Cu 0.884072 0.665185 1.19795e-19 120 63.546 0.000609669 -3.54049 63.546000 Cu 0.924597 0.652872 0.5 121 63.546 0.00084762 -3.54022 63.546000 Cu 0.834666 0.654975 0.5 122 63.546 0.000595746 -3.54022 63.546000 Cu 0.974142 0.663178 1 123 63.546 0.0006398 -3.54008 63.546000 Cu 0.113809 0.671609 0.5 91 63.546 0.00054382 -3.53962 63.546000 Cu 0.0236262 0.673509 0.5 125 63.546 0.00025518 -3.54002 63.546000 Cu 0.0729522 0.683833 1 127 63.546 0.000210951 -3.5397 63.546000 Cu 0.122343 0.694104 0.5 129 63.546 0.000286811 -3.53974 63.546000 Cu 0.0322028 0.696057 0.5 130 63.546 0.000153157 -3.54 63.546000 Cu 0.163167 0.681841 1 90 63.546 0.000265219 -3.5397 63.546000 Cu 0.294088 0.667376 0.5 222 63.546 0.000168711 -3.53981 63.546000 Cu 0.204008 0.669561 0.5 256 63.546 0.000477262 -3.53924 63.546000 Cu 0.253388 0.679722 1 257 63.546 0.000213842 -3.53972 63.546000 Cu 0.261805 0.702228 2.4007e-16 258 63.546 0.000103608 -3.53973 63.546000 Cu 0.302736 0.689886 0.5 259 63.546 0.000228965 -3.54 63.546000 Cu 0.212557 0.692039 0.5 260 63.546 0.000219383 -3.53982 63.546000 Cu 0.343442 0.677536 3.59386e-19 220 63.546 0.0002343 -3.54001 63.546000 Cu 0.433497 0.675444 1.92032e-16 223 63.546 0.000481859 -3.54034 63.546000 Cu 0.442068 0.69801 1.41239e-16 224 63.546 0.000250976 -3.54015 63.546000 Cu 0.482854 0.685743 0.5 225 63.546 0.0002096 -3.54011 63.546000 Cu 0.392833 0.687743 0.5 226 63.546 0.000623925 -3.54005 63.546000 Cu 0.351971 0.700071 3.59386e-19 261 63.546 0.000244863 -3.54033 63.546000 Cu 0.523626 0.673509 3.6873e-16 186 63.546 0.00025518 -3.54002 63.546000 Cu 0.613809 0.671609 5.16318e-17 189 63.546 0.00054382 -3.53962 63.546000 Cu 0.622343 0.694104 1.19795e-19 190 63.546 0.000286811 -3.53974 63.546000 Cu 0.572952 0.683833 0.5 192 63.546 0.000210951 -3.5397 63.546000 Cu 0.532203 0.696057 9.67946e-17 227 63.546 0.000153157 -3.54 63.546000 Cu 0.663167 0.681841 0.5 191 63.546 0.000265219 -3.5397 63.546000 Cu 0.704008 0.669561 1 154 63.546 0.000477262 -3.53924 63.546000 Cu 0.794088 0.667376 6.25331e-17 157 63.546 0.000168711 -3.53981 63.546000 Cu 0.802736 0.689886 1 158 63.546 0.000228965 -3.54 63.546000 Cu 0.753388 0.679722 0.5 160 63.546 0.000213842 -3.53972 63.546000 Cu 0.712557 0.692039 1.53937e-16 193 63.546 0.000219383 -3.53982 63.546000 Cu 0.761805 0.702228 0.5 195 63.546 0.000103608 -3.53973 63.546000 Cu 0.982854 0.685743 2.68222e-16 124 63.546 0.0002096 -3.54011 63.546000 Cu 0.933497 0.675444 0.5 126 63.546 0.000481859 -3.54034 63.546000 Cu 0.843442 0.677536 0.5 159 63.546 0.0002343 -3.54001 63.546000 Cu 0.892833 0.687743 2.1659e-16 161 63.546 0.000623925 -3.54005 63.546000 Cu 0.942068 0.69801 0.5 163 63.546 0.000250976 -3.54015 63.546000 Cu 0.851971 0.700071 0.5 164 63.546 0.000244863 -3.54033 63.546000 Cu 0.0814528 0.706354 1.2267e-16 128 63.546 0.000160742 -3.54007 63.546000 Cu 0.130683 0.716614 0.5 133 63.546 0.000175643 -3.53995 63.546000 Cu 0.0405019 0.718603 0.5 167 63.546 3.55391e-05 -3.5401 63.546000 Cu 0.089741 0.728896 7.94243e-17 169 63.546 0.000267456 -3.53999 63.546000 Cu 0.138887 0.739134 0.5 171 63.546 0.000157656 -3.53989 63.546000 Cu 0.171659 0.704323 1.22551e-16 131 63.546 0.000151856 -3.53963 63.546000 Cu 0.179904 0.726833 1.68672e-16 132 63.546 8.53062e-05 -3.53983 63.546000 Cu 0.311013 0.712409 0.5 264 63.546 4.60197e-05 -3.53988 63.546000 Cu 0.220853 0.714532 0.5 296 63.546 3.88497e-05 -3.53944 63.546000 Cu 0.270098 0.724722 1 297 63.546 5.34699e-05 -3.53953 63.546000 Cu 0.229097 0.737031 0.5 300 63.546 0.000170454 -3.54 63.546000 Cu 0.319317 0.734912 0.5 299 63.546 0.000338243 -3.53954 63.546000 Cu 0.360293 0.722607 1 262 63.546 0.000248788 -3.53998 63.546000 Cu 0.401183 0.710306 0.5 263 63.546 0.000163107 -3.54028 63.546000 Cu 0.450404 0.72057 1 265 63.546 0.000136247 -3.54004 63.546000 Cu 0.40948 0.732863 0.5 268 63.546 0.000245242 -3.5401 63.546000 Cu 0.491273 0.708307 0.5 230 63.546 5.04597e-05 -3.54017 63.546000 Cu 0.499625 0.730865 0.5 267 63.546 0.000195008 -3.54015 63.546000 Cu 0.540502 0.718603 1 228 63.546 3.55391e-05 -3.5401 63.546000 Cu 0.581453 0.706354 0.5 229 63.546 0.000160742 -3.54007 63.546000 Cu 0.630683 0.716614 1.21952e-16 231 63.546 0.000175643 -3.53995 63.546000 Cu 0.638887 0.739134 2.07246e-17 232 63.546 0.000157656 -3.53989 63.546000 Cu 0.589741 0.728896 0.5 234 63.546 0.000267456 -3.53999 63.546000 Cu 0.720853 0.714532 1.21952e-16 194 63.546 3.88497e-05 -3.53944 63.546000 Cu 0.671659 0.704323 0.5 196 63.546 0.000151856 -3.53963 63.546000 Cu 0.811013 0.712409 2.02574e-16 197 63.546 4.60197e-05 -3.53988 63.546000 Cu 0.770098 0.724722 0.5 200 63.546 5.34699e-05 -3.53953 63.546000 Cu 0.679904 0.726833 0.5 233 63.546 8.53062e-05 -3.53983 63.546000 Cu 0.729097 0.737031 0 235 63.546 0.000170454 -3.54 63.546000 Cu 0.819317 0.734912 1.22551e-16 198 63.546 0.000338243 -3.53954 63.546000 Cu 0.991273 0.708307 1 165 63.546 5.04597e-05 -3.54017 63.546000 Cu 0.999625 0.730865 1 166 63.546 0.000195008 -3.54015 63.546000 Cu 0.901183 0.710306 1 162 63.546 0.000163107 -3.54028 63.546000 Cu 0.950404 0.72057 0.5 168 63.546 0.000136247 -3.54004 63.546000 Cu 0.860293 0.722607 0.5 199 63.546 0.000248788 -3.53998 63.546000 Cu 0.90948 0.732863 1 201 63.546 0.000245242 -3.5401 63.546000 Cu 0.0977754 0.751437 3.59386e-19 170 63.546 0.000141253 -3.53994 63.546000 Cu 0.0487097 0.741166 0.5 172 63.546 0.000113718 -3.54012 63.546000 Cu 0.14685 0.761669 0.5 173 63.546 8.62872e-05 -3.53997 63.546000 Cu 0.00763284 0.753436 0 205 63.546 2.07023e-05 -3.5403 63.546000 Cu 0.0156846 0.776013 3.00686e-17 206 63.546 0.000170329 -3.54032 63.546000 Cu 0.0566951 0.763727 0.5 207 63.546 0.000153312 -3.54012 63.546000 Cu 0.105821 0.773987 1 209 63.546 0.000138308 -3.54007 63.546000 Cu 0.278168 0.747218 1 298 63.546 6.89726e-05 -3.53973 63.546000 Cu 0.187937 0.74935 2.56601e-16 336 63.546 4.85748e-05 -3.54007 63.546000 Cu 0.195964 0.771877 1.22551e-16 337 63.546 7.37437e-05 -3.53979 63.546000 Cu 0.237 0.759549 0.5 338 63.546 7.60458e-05 -3.53969 63.546000 Cu 0.286124 0.769725 8.52942e-17 339 63.546 0.000183889 -3.53944 63.546000 Cu 0.327207 0.757424 0.5 304 63.546 0.000244411 -3.53975 63.546000 Cu 0.458563 0.743139 1 266 63.546 5.73986e-05 -3.54041 63.546000 Cu 0.368349 0.745134 1 301 63.546 0.000170686 -3.53982 63.546000 Cu 0.376356 0.767668 1 302 63.546 0.000167156 -3.53994 63.546000 Cu 0.417418 0.755405 0.5 303 63.546 9.05924e-05 -3.54022 63.546000 Cu 0.466553 0.7657 3.59386e-19 305 63.546 4.52483e-05 -3.54026 63.546000 Cu 0.54871 0.741166 1 269 63.546 0.000113718 -3.54012 63.546000 Cu 0.556695 0.763727 0 270 63.546 0.000153312 -3.54012 63.546000 Cu 0.597775 0.751437 0.5 271 63.546 0.000141253 -3.53994 63.546000 Cu 0.507633 0.753436 0.5 272 63.546 2.07023e-05 -3.5403 63.546000 Cu 0.64685 0.761669 0 273 63.546 8.62872e-05 -3.53997 63.546000 Cu 0.605821 0.773987 0.5 276 63.546 0.000138308 -3.54007 63.546000 Cu 0.515685 0.776013 0.5 307 63.546 0.000170329 -3.54032 63.546000 Cu 0.737 0.759549 1 236 63.546 7.60458e-05 -3.53969 63.546000 Cu 0.778168 0.747218 0.5 237 63.546 6.89726e-05 -3.53973 63.546000 Cu 0.687937 0.74935 0.5 238 63.546 4.85748e-05 -3.54007 63.546000 Cu 0.786124 0.769725 0.5 242 63.546 0.000183889 -3.53944 63.546000 Cu 0.695964 0.771877 0.5 275 63.546 7.37437e-05 -3.53979 63.546000 Cu 0.827207 0.757424 1 239 63.546 0.000244411 -3.53975 63.546000 Cu 0.917418 0.755405 0 202 63.546 9.05924e-05 -3.54022 63.546000 Cu 0.958563 0.743139 0.5 203 63.546 5.73986e-05 -3.54041 63.546000 Cu 0.868349 0.745134 0.5 204 63.546 0.000170686 -3.53982 63.546000 Cu 0.966553 0.7657 0.5 208 63.546 4.52483e-05 -3.54026 63.546000 Cu 0.876356 0.767668 0.5 241 63.546 0.000167156 -3.53994 63.546000 Cu 0.114008 0.796548 0 210 63.546 0.000193612 -3.54024 63.546000 Cu 0.0648438 0.786298 0.5 212 63.546 0.000219503 -3.54029 63.546000 Cu 0.0239286 0.798597 2.14194e-16 247 63.546 0.000418513 -3.5403 63.546000 Cu 0.0731576 0.808893 0.5 249 63.546 0.000562108 -3.54038 63.546000 Cu 0.154943 0.784215 0.5 211 63.546 0.000159318 -3.54003 63.546000 Cu 0.163179 0.806766 0.5 213 63.546 0.000369267 -3.53992 63.546000 Cu 0.294261 0.792213 3.59386e-19 340 63.546 0.000551291 -3.53958 63.546000 Cu 0.24507 0.782045 0.5 342 63.546 0.000130819 -3.53954 63.546000 Cu 0.204087 0.794408 1 378 63.546 0.000208305 -3.53973 63.546000 Cu 0.253306 0.804541 0.5 380 63.546 0.000311364 -3.53937 63.546000 Cu 0.302669 0.81468 1.19795e-19 381 63.546 0.00106494 -3.53926 63.546000 Cu 0.474711 0.788272 0 306 63.546 0.000121278 -3.54023 63.546000 Cu 0.425534 0.77795 0.5 308 63.546 8.7029e-05 -3.54 63.546000 Cu 0.335305 0.779928 0.5 341 63.546 0.00036599 -3.53971 63.546000 Cu 0.384532 0.790188 1.2267e-16 343 63.546 0.000266055 -3.53986 63.546000 Cu 0.392919 0.812703 1.9898e-16 344 63.546 0.00036465 -3.53974 63.546000 Cu 0.433791 0.800501 0.5 345 63.546 0.000128713 -3.54003 63.546000 Cu 0.343552 0.802419 0.5 346 63.546 0.000795481 -3.5396 63.546000 Cu 0.483102 0.810851 2.92899e-16 347 63.546 0.000254355 -3.54008 63.546000 Cu 0.564844 0.786298 1 309 63.546 0.000219503 -3.54029 63.546000 Cu 0.573158 0.808893 1 310 63.546 0.000562108 -3.54038 63.546000 Cu 0.614008 0.796548 0.5 311 63.546 0.000193612 -3.54024 63.546000 Cu 0.523929 0.798597 0.5 312 63.546 0.000418513 -3.5403 63.546000 Cu 0.654943 0.784215 1.29618e-16 274 63.546 0.000159318 -3.54003 63.546000 Cu 0.663179 0.806766 1 313 63.546 0.000369267 -3.53992 63.546000 Cu 0.74507 0.782045 1 277 63.546 0.000130819 -3.53954 63.546000 Cu 0.753306 0.804541 0 278 63.546 0.000311364 -3.53937 63.546000 Cu 0.794261 0.792213 0.5 279 63.546 0.000551291 -3.53958 63.546000 Cu 0.704087 0.794408 0.5 280 63.546 0.000208305 -3.53973 63.546000 Cu 0.802669 0.81468 0.5 284 63.546 0.00106494 -3.53926 63.546000 Cu 0.835305 0.779928 2.39591e-19 240 63.546 0.00036599 -3.53971 63.546000 Cu 0.925534 0.77795 0 243 63.546 8.7029e-05 -3.54 63.546000 Cu 0.933791 0.800501 1.22311e-16 244 63.546 0.000128713 -3.54003 63.546000 Cu 0.974711 0.788272 0.5 245 63.546 0.000121278 -3.54023 63.546000 Cu 0.884532 0.790188 0.5 246 63.546 0.000266055 -3.53986 63.546000 Cu 0.983102 0.810851 0.5 250 63.546 0.000254355 -3.54008 63.546000 Cu 0.843552 0.802419 0 281 63.546 0.000795481 -3.5396 63.546000 Cu 0.892919 0.812703 0.5 283 63.546 0.00036465 -3.53974 63.546000 Cu 0.0324309 0.821195 0 248 63.546 0.000605406 -3.54033 63.546000 Cu 0.122398 0.819142 2.44862e-16 251 63.546 0.000634242 -3.54036 63.546000 Cu 0.130922 0.841756 0 252 63.546 0.00173639 -3.54042 63.546000 Cu 0.0817248 0.831521 0.5 254 63.546 0.00138326 -3.54061 63.546000 Cu 0.0410186 0.843843 1.19795e-19 289 63.546 0.00161367 -3.54049 63.546000 Cu 0.171643 0.829309 0.5 253 63.546 0.000534083 -3.53979 63.546000 Cu 0.212442 0.816908 1.83047e-16 379 63.546 0.000193249 -3.53929 63.546000 Cu 0.311228 0.837117 0 382 63.546 0.00209486 -3.53889 63.546000 Cu 0.261807 0.826994 0.5 384 63.546 0.000782724 -3.53887 63.546000 Cu 0.220947 0.839371 1.93469e-16 416 63.546 0.000595789 -3.53891 63.546000 Cu 0.270272 0.849405 0.5 418 63.546 0.0026505 -3.53825 63.546000 Cu 0.180081 0.851847 0.5 255 63.546 0.000824292 -3.53953 63.546000 Cu 0.442317 0.823056 0.5 350 63.546 0.000126688 -3.53983 63.546000 Cu 0.352074 0.824898 0.5 383 63.546 0.00109785 -3.53934 63.546000 Cu 0.401536 0.835213 2.06168e-16 385 63.546 0.000489051 -3.53949 63.546000 Cu 0.450963 0.845618 0.5 387 63.546 0.000393039 -3.53978 63.546000 Cu 0.36066 0.847358 0.5 388 63.546 0.00176211 -3.53934 63.546000 Cu 0.491703 0.833447 0 348 63.546 0.000540657 -3.54013 63.546000 Cu 0.622398 0.819142 0.5 316 63.546 0.000634242 -3.54036 63.546000 Cu 0.532431 0.821195 0.5 349 63.546 0.000605406 -3.54033 63.546000 Cu 0.581725 0.831521 7.96639e-17 351 63.546 0.00138326 -3.54061 63.546000 Cu 0.630922 0.841756 0.5 353 63.546 0.00173639 -3.54042 63.546000 Cu 0.541019 0.843843 0.5 354 63.546 0.00161367 -3.54049 63.546000 Cu 0.671643 0.829309 1 314 63.546 0.000534083 -3.53979 63.546000 Cu 0.712442 0.816908 0.5 315 63.546 0.000193249 -3.53929 63.546000 Cu 0.761807 0.826994 4.64806e-17 317 63.546 0.000782724 -3.53887 63.546000 Cu 0.770272 0.849405 1 318 63.546 0.0026505 -3.53825 63.546000 Cu 0.811228 0.837117 0.5 319 63.546 0.00209486 -3.53889 63.546000 Cu 0.720947 0.839371 0.5 320 63.546 0.000595789 -3.53891 63.546000 Cu 0.680081 0.851847 7.82263e-17 355 63.546 0.000824292 -3.53953 63.546000 Cu 0.991703 0.833447 0.5 287 63.546 0.000540657 -3.54013 63.546000 Cu 0.852074 0.824898 2.44742e-16 282 63.546 0.00109785 -3.53934 63.546000 Cu 0.942317 0.823056 3.67771e-17 285 63.546 0.000126688 -3.53983 63.546000 Cu 0.950963 0.845618 1 286 63.546 0.000393039 -3.53978 63.546000 Cu 0.901536 0.835213 0.5 288 63.546 0.000489051 -3.53949 63.546000 Cu 0.86066 0.847358 1 321 63.546 0.00176211 -3.53934 63.546000 Cu 0.0493865 0.866543 1.19795e-19 290 63.546 0.00374859 -3.54066 63.546000 Cu 0.0901829 0.854188 0.5 291 63.546 0.00331684 -3.54082 63.546000 Cu 0.000260823 0.856083 0.5 292 63.546 0.00136062 -3.54012 63.546000 Cu 0.13923 0.864389 0 293 63.546 0.00352649 -3.5405 63.546000 Cu 0.147316 0.887072 2.01256e-16 294 63.546 0.00714157 -3.54033 63.546000 Cu 0.098403 0.876919 0.5 295 63.546 0.00779024 -3.54102 63.546000 Cu 0.00856668 0.87877 0.5 327 63.546 0.00287432 -3.54005 63.546000 Cu 0.229222 0.861808 1 417 63.546 0.0020424 -3.53797 63.546000 Cu 0.278411 0.871766 0.5 422 63.546 0.00703135 -3.53725 63.546000 Cu 0.18819 0.874383 0.5 446 63.546 0.00137291 -3.53891 63.546000 Cu 0.237196 0.884208 2.11558e-16 447 63.546 0.00620487 -3.53629 63.546000 Cu 0.319598 0.859519 3.73761e-17 419 63.546 0.00412273 -3.53853 63.546000 Cu 0.327719 0.881866 1 420 63.546 0.00818091 -3.53778 63.546000 Cu 0.410048 0.857727 6.84031e-17 386 63.546 0.000809689 -3.53961 63.546000 Cu 0.459364 0.868212 0.5 392 63.546 0.000707729 -3.53973 63.546000 Cu 0.368983 0.869794 0.5 421 63.546 0.00276877 -3.53899 63.546000 Cu 0.418302 0.880235 1.07217e-16 423 63.546 0.00116895 -3.53924 63.546000 Cu 0.590183 0.854188 2.07006e-16 352 63.546 0.00331684 -3.54082 63.546000 Cu 0.63923 0.864389 0.5 358 63.546 0.00352649 -3.5405 63.546000 Cu 0.500261 0.856083 1 389 63.546 0.00136062 -3.54012 63.546000 Cu 0.508567 0.87877 1 390 63.546 0.00287432 -3.54005 63.546000 Cu 0.549386 0.866543 0.5 391 63.546 0.00374859 -3.54066 63.546000 Cu 0.598403 0.876919 4.85171e-17 393 63.546 0.00779024 -3.54102 63.546000 Cu 0.647316 0.887072 0.5 395 63.546 0.00714157 -3.54033 63.546000 Cu 0.68819 0.874383 1.08055e-16 356 63.546 0.00137291 -3.53891 63.546000 Cu 0.729222 0.861808 0.5 357 63.546 0.0020424 -3.53797 63.546000 Cu 0.778411 0.871766 1 359 63.546 0.00703135 -3.53725 63.546000 Cu 0.737196 0.884208 0.5 362 63.546 0.00620487 -3.53629 63.546000 Cu 0.819598 0.859519 0.5 324 63.546 0.00412273 -3.53853 63.546000 Cu 0.827719 0.881866 0.5 361 63.546 0.00818091 -3.53778 63.546000 Cu 0.868983 0.869794 2.30845e-16 322 63.546 0.00276877 -3.53899 63.546000 Cu 0.910048 0.857727 0.5 323 63.546 0.000809689 -3.53961 63.546000 Cu 0.959364 0.868212 6.09758e-17 325 63.546 0.000707729 -3.53973 63.546000 Cu 0.918302 0.880235 0.5 328 63.546 0.00116895 -3.53924 63.546000 Cu 0.0576536 0.88932 1 329 63.546 0.00881856 -3.5406 63.546000 Cu 0.0659692 0.912187 1 330 63.546 0.0180133 -3.53988 63.546000 Cu 0.106603 0.899737 0.5 331 63.546 0.0170708 -3.54104 63.546000 Cu 0.0168312 0.901511 0.5 332 63.546 0.00550247 -3.53947 63.546000 Cu 0.114881 0.922709 0.5 335 63.546 0.039964 -3.54013 63.546000 Cu 0.0252368 0.924304 0.5 369 63.546 0.00847671 -3.53738 63.546000 Cu 0.155386 0.90986 1 333 63.546 0.0184785 -3.53986 63.546000 Cu 0.245011 0.906523 1 448 63.546 0.0216238 -3.53128 63.546000 Cu 0.286385 0.894051 0.5 449 63.546 0.0177866 -3.53502 63.546000 Cu 0.196117 0.896944 0.5 450 63.546 0.00382631 -3.53769 63.546000 Cu 0.294305 0.916185 0.5 454 63.546 0.0494223 -3.53046 63.546000 Cu 0.203902 0.919556 0.5 470 63.546 0.0146849 -3.53434 63.546000 Cu 0.426525 0.902739 1.19795e-19 424 63.546 0.00166957 -3.53875 63.546000 Cu 0.467605 0.890828 0.5 425 63.546 0.00121857 -3.53937 63.546000 Cu 0.377116 0.892192 0.5 426 63.546 0.00446372 -3.53848 63.546000 Cu 0.475908 0.913468 0.5 430 63.546 0.00202641 -3.53825 63.546000 Cu 0.335794 0.904138 1 451 63.546 0.01555 -3.5365 63.546000 Cu 0.3853 0.914551 0.5 453 63.546 0.00604322 -3.53767 63.546000 Cu 0.434868 0.925234 1 455 63.546 0.0022529 -3.53739 63.546000 Cu 0.606603 0.899737 3.11468e-17 394 63.546 0.0170708 -3.54104 63.546000 Cu 0.557654 0.88932 0.5 396 63.546 0.00881856 -3.5406 63.546000 Cu 0.516831 0.901511 1 427 63.546 0.00550247 -3.53947 63.546000 Cu 0.525237 0.924304 1 428 63.546 0.00847671 -3.53738 63.546000 Cu 0.565969 0.912187 0.5 429 63.546 0.0180133 -3.53988 63.546000 Cu 0.614881 0.922709 1 431 63.546 0.039964 -3.54013 63.546000 Cu 0.655386 0.90986 0.5 400 63.546 0.0184785 -3.53986 63.546000 Cu 0.786385 0.894051 1 360 63.546 0.0177866 -3.53502 63.546000 Cu 0.696117 0.896944 1 397 63.546 0.00382631 -3.53769 63.546000 Cu 0.703902 0.919556 0 398 63.546 0.0146849 -3.53434 63.546000 Cu 0.745011 0.906523 0.5 399 63.546 0.0216238 -3.53128 63.546000 Cu 0.794305 0.916185 1 401 63.546 0.0494223 -3.53046 63.546000 Cu 0.967605 0.890828 1.30816e-16 326 63.546 0.00121857 -3.53937 63.546000 Cu 0.877116 0.892192 1.19316e-16 363 63.546 0.00446372 -3.53848 63.546000 Cu 0.8853 0.914551 3.67652e-16 364 63.546 0.00604322 -3.53767 63.546000 Cu 0.926525 0.902739 0.5 365 63.546 0.00166957 -3.53875 63.546000 Cu 0.835794 0.904138 0.5 366 63.546 0.01555 -3.5365 63.546000 Cu 0.975908 0.913468 1 367 63.546 0.00202641 -3.53825 63.546000 Cu 0.934868 0.925234 0.5 370 63.546 0.0022529 -3.53739 63.546000 Cu 0.0744776 0.935173 1 371 63.546 0.0314309 -3.53672 63.546000 Cu 0.0832106 0.958336 1 372 63.546 0.0571322 -3.52578 63.546000 Cu 0.123364 0.945954 0.5 373 63.546 0.0977365 -3.532 63.546000 Cu 0.0338522 0.94717 0.5 374 63.546 0.0111873 -3.532 63.546000 Cu 0.163533 0.932847 0 334 63.546 0.0588364 -3.53759 63.546000 Cu 0.172127 0.956218 1 375 63.546 0.261446 -3.5112 63.546000 Cu 0.252707 0.928646 2.87509e-17 471 63.546 0.0938682 -3.51571 63.546000 Cu 0.260441 0.95033 0 472 63.546 0.522564 -3.46713 63.546000 Cu 0.302209 0.938096 0.5 473 63.546 0.139718 -3.5226 63.546000 Cu 0.211449 0.942353 0.5 474 63.546 0.0833228 -3.51741 63.546000 Cu 0.310744 0.959726 0.5 478 63.546 0.42739 -3.50173 63.546000 Cu 0.343935 0.926307 1.14524e-16 452 63.546 0.0254941 -3.53519 63.546000 Cu 0.443384 0.947716 0 456 63.546 0.00427135 -3.5355 63.546000 Cu 0.484415 0.936124 0.5 457 63.546 0.00307853 -3.53578 63.546000 Cu 0.393667 0.93685 0.5 458 63.546 0.00688432 -3.53705 63.546000 Cu 0.352289 0.948359 0 475 63.546 0.0304071 -3.53449 63.546000 Cu 0.402 0.959121 0.5 477 63.546 0.0206207 -3.53643 63.546000 Cu 0.492803 0.958802 0.5 462 63.546 0.0165271 -3.53362 63.546000 Cu 0.623364 0.945954 2.46778e-17 432 63.546 0.0977365 -3.532 63.546000 Cu 0.574478 0.935173 0.5 434 63.546 0.0314309 -3.53672 63.546000 Cu 0.533852 0.94717 1.22191e-16 459 63.546 0.0111873 -3.532 63.546000 Cu 0.583211 0.958336 0.5 461 63.546 0.0571322 -3.52578 63.546000 Cu 0.663533 0.932847 0.5 433 63.546 0.0588364 -3.53759 63.546000 Cu 0.802209 0.938096 3.33031e-17 402 63.546 0.139718 -3.5226 63.546000 Cu 0.752707 0.928646 0.5 404 63.546 0.0938682 -3.51571 63.546000 Cu 0.711449 0.942353 1 435 63.546 0.0833228 -3.51741 63.546000 Cu 0.760441 0.95033 0.5 437 63.546 0.522564 -3.46713 63.546000 Cu 0.672127 0.956218 0.5 438 63.546 0.261446 -3.5112 63.546000 Cu 0.810744 0.959726 1 439 63.546 0.42739 -3.50173 63.546000 Cu 0.992803 0.958802 3.67412e-16 409 63.546 0.0165271 -3.53362 63.546000 Cu 0.984415 0.936124 1.72266e-16 368 63.546 0.00307853 -3.53578 63.546000 Cu 0.843935 0.926307 0.5 403 63.546 0.0254941 -3.53519 63.546000 Cu 0.893667 0.93685 1 405 63.546 0.00688432 -3.53705 63.546000 Cu 0.902 0.959121 4.88765e-17 406 63.546 0.0206207 -3.53643 63.546000 Cu 0.943384 0.947716 0.5 407 63.546 0.00427135 -3.5355 63.546000 Cu 0.852289 0.948359 0.5 408 63.546 0.0304071 -3.53449 63.546000 Cu 0.132324 0.969697 0.5 377 63.546 0.351077 -3.49799 63.546000 Cu 0.0415574 0.970075 0.5 411 63.546 0.0615394 -3.53173 63.546000 Cu 0.0893383 0.981469 1.13566e-16 413 63.546 0.201168 -3.52167 63.546000 Cu 0.132392 0.993214 0.5 414 63.546 0.356816 -3.49737 63.546000 Cu 0.0416138 0.9929 0.5 415 63.546 0.0611805 -3.5316 63.546000 Cu 0.184217 0.981435 1 376 63.546 4.54686 -3.52182 63.546000 Cu 0.218742 0.965711 0.5 484 63.546 5.64411 -3.41686 63.546000 Cu 0.270044 0.971242 2.4594e-16 485 63.546 7.14531 -3.26108 63.546000 Cu 0.270156 0.991674 0 486 63.546 7.16421 -3.25976 63.546000 Cu 0.218802 0.997165 0.5 488 63.546 5.62808 -3.41629 63.546000 Cu 0.315328 0.981455 0.5 487 63.546 3.28869 -3.46915 63.546000 Cu 0.360015 0.970406 2.5157e-17 476 63.546 0.0840732 -3.5348 63.546000 Cu 0.450594 0.970233 1 479 63.546 0.0543465 -3.53841 63.546000 Cu 0.450657 0.992751 1 480 63.546 0.0551427 -3.5381 63.546000 Cu 0.406255 0.981486 0.5 482 63.546 0.0687098 -3.5429 63.546000 Cu 0.360105 0.992539 2.0497e-16 489 63.546 0.087665 -3.53462 63.546000 Cu 0.497412 0.981498 0.5 481 63.546 0.0893264 -3.54139 63.546000 Cu 0.541557 0.970075 1 460 63.546 0.0615394 -3.53173 63.546000 Cu 0.632324 0.969697 0 463 63.546 0.351077 -3.49799 63.546000 Cu 0.632392 0.993214 0 464 63.546 0.356816 -3.49737 63.546000 Cu 0.589338 0.981469 0.5 466 63.546 0.201168 -3.52167 63.546000 Cu 0.541614 0.9929 1.21952e-16 483 63.546 0.0611805 -3.5316 63.546000 Cu 0.718742 0.965711 1 436 63.546 5.64411 -3.41686 63.546000 Cu 0.770044 0.971242 0.5 442 63.546 7.14531 -3.26108 63.546000 Cu 0.684217 0.981435 0.5 465 63.546 4.54686 -3.52182 63.546000 Cu 0.718802 0.997165 1 467 63.546 5.62808 -3.41629 63.546000 Cu 0.770156 0.991674 0.5 468 63.546 7.16421 -3.25976 63.546000 Cu 0.815328 0.981455 1 440 63.546 3.28869 -3.46915 63.546000 Cu 0.997412 0.981498 1.22551e-16 410 63.546 0.0893264 -3.54139 63.546000 Cu 0.950594 0.970233 0.5 412 63.546 0.0543465 -3.53841 63.546000 Cu 0.860015 0.970406 0.5 441 63.546 0.0840732 -3.5348 63.546000 Cu 0.906255 0.981486 1.2267e-16 443 63.546 0.0687098 -3.5429 63.546000 Cu 0.950657 0.992751 0.5 444 63.546 0.0551427 -3.5381 63.546000 Cu 0.860105 0.992539 0.5 445 63.546 0.087665 -3.53462