Number of particles = 1170 A = 1 Angstrom (basic length-scale) H0(1,1) = 30.7559 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 124.057 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61418 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 0.0363439 0.00393251 3.43543e-16 586 63.546 9.62827 -3.9059 63.546000 Cu 0.0942076 0.00411767 0.5 588 63.546 11.3743 -3.02544 63.546000 Cu 0.00960766 0.0270557 7.67003e-16 590 63.546 0.57438 -3.4842 63.546000 Cu 0.0842714 0.0358194 7.73603e-16 591 63.546 0.0299245 -3.48751 63.546000 Cu 0.0619486 0.0217755 0.5 592 63.546 0.597982 -3.40466 63.546000 Cu 0.0304249 0.0411552 0.5 593 63.546 0.0508725 -3.51789 63.546000 Cu 0.117822 0.016188 5.88092e-16 594 63.546 2.41112 -3.50312 63.546000 Cu 0.19327 0.0261962 5.24975e-16 595 63.546 0.353006 -3.42578 63.546000 Cu 0.173372 0.0133624 0.5 596 63.546 9.43174 -3.09297 63.546000 Cu 0.137132 0.0311741 0.5 597 63.546 0.106491 -3.46893 63.546000 Cu 0.158795 0.0450534 4.0774e-16 611 63.546 0.00570549 -3.51739 63.546000 Cu 0.218522 0.00382881 6.00571e-16 598 63.546 8.4303 -3.85051 63.546000 Cu 0.301763 0.0157953 6.07891e-16 599 63.546 2.64611 -3.55072 63.546000 Cu 0.276502 0.00411206 0.5 600 63.546 11.2732 -3.03019 63.546000 Cu 0.246607 0.0216731 0.5 601 63.546 0.744861 -3.34216 63.546000 Cu 0.356572 0.013263 0.5 603 63.546 9.5019 -3.07658 63.546000 Cu 0.212765 0.040277 0.5 613 63.546 0.0117347 -3.51225 63.546000 Cu 0.267814 0.0352942 3.90221e-16 615 63.546 0.0293047 -3.49455 63.546000 Cu 0.342616 0.0443721 5.90491e-16 616 63.546 0.0229842 -3.50954 63.546000 Cu 0.321084 0.0308172 0.5 617 63.546 0.122711 -3.4589 63.546000 Cu 0.28787 0.0493034 0.5 618 63.546 0.0123434 -3.51432 63.546000 Cu 0.377173 0.0257935 7.24285e-16 619 63.546 0.517902 -3.42887 63.546000 Cu 0.398632 0.00361061 5.73332e-16 602 63.546 7.67463 -3.79454 63.546000 Cu 0.397166 0.0395746 0.5 622 63.546 0.135392 -3.46028 63.546000 Cu 0.453394 0.00413349 0.5 604 63.546 10.0622 -2.75167 63.546000 Cu 0.454421 0.0337504 5.06136e-16 620 63.546 0.087264 -3.44956 63.546000 Cu 0.429925 0.0215447 0.5 621 63.546 1.63791 -3.19226 63.546000 Cu 0.486796 0.0143629 5.84492e-16 623 63.546 2.44828 -3.40056 63.546000 Cu 0.561949 0.0217755 8.83997e-16 624 63.546 0.597982 -3.40466 63.546000 Cu 0.536344 0.00393251 0.5 625 63.546 9.62827 -3.9059 63.546000 Cu 0.509608 0.0270557 0.5 626 63.546 0.57438 -3.4842 63.546000 Cu 0.475539 0.0466514 0.5 650 63.546 0.0570751 -3.54255 63.546000 Cu 0.530425 0.0411552 7.03766e-16 652 63.546 0.0508725 -3.51789 63.546000 Cu 0.584271 0.0358194 0.5 654 63.546 0.0299245 -3.48751 63.546000 Cu 0.594208 0.00411767 4.40379e-16 627 63.546 11.3743 -3.02544 63.546000 Cu 0.673372 0.0133624 4.90656e-16 628 63.546 9.43174 -3.09297 63.546000 Cu 0.617822 0.016188 0.5 629 63.546 2.41112 -3.50312 63.546000 Cu 0.776502 0.00411206 4.0678e-16 630 63.546 11.2732 -3.03019 63.546000 Cu 0.718522 0.00382881 0.5 631 63.546 8.4303 -3.85051 63.546000 Cu 0.637132 0.0311741 4.0714e-16 656 63.546 0.106491 -3.46893 63.546000 Cu 0.712765 0.040277 7.09046e-16 657 63.546 0.0117347 -3.51225 63.546000 Cu 0.69327 0.0261962 0.5 658 63.546 0.353006 -3.42578 63.546000 Cu 0.658795 0.0450534 0.5 659 63.546 0.00570549 -3.51739 63.546000 Cu 0.746607 0.0216731 5.50173e-16 660 63.546 0.744861 -3.34216 63.546000 Cu 0.767814 0.0352942 0.5 663 63.546 0.0293047 -3.49455 63.546000 Cu 0.78787 0.0493034 4.88616e-16 698 63.546 0.0123434 -3.51432 63.546000 Cu 0.953394 0.00413349 4.1686e-16 585 63.546 10.0622 -2.75167 63.546000 Cu 0.986796 0.0143629 0.5 587 63.546 2.44828 -3.40056 63.546000 Cu 0.975539 0.0466514 7.22365e-16 589 63.546 0.0570751 -3.54255 63.546000 Cu 0.821084 0.0308172 3.33464e-16 661 63.546 0.122711 -3.4589 63.546000 Cu 0.801763 0.0157953 0.5 662 63.546 2.64611 -3.55072 63.546000 Cu 0.856572 0.013263 4.51418e-16 664 63.546 9.5019 -3.07658 63.546000 Cu 0.929925 0.0215447 5.00976e-16 665 63.546 1.63791 -3.19226 63.546000 Cu 0.898632 0.00361061 0.5 666 63.546 7.67463 -3.79454 63.546000 Cu 0.877173 0.0257935 0.5 667 63.546 0.517902 -3.42887 63.546000 Cu 0.842616 0.0443721 0.5 700 63.546 0.0229842 -3.50954 63.546000 Cu 0.897166 0.0395746 3.69102e-16 702 63.546 0.135392 -3.46028 63.546000 Cu 0.954421 0.0337504 0.5 703 63.546 0.087264 -3.44956 63.546000 Cu 0.104889 0.0500662 0.5 609 63.546 0.00635841 -3.50715 63.546000 Cu 0.0168131 0.0739184 3.58903e-16 605 63.546 0.00537243 -3.54104 63.546000 Cu 0.0509029 0.0549955 3.09945e-16 607 63.546 0.0108958 -3.53045 63.546000 Cu 0.125615 0.0639449 4.46018e-16 608 63.546 0.000871269 -3.52589 63.546000 Cu 0.0712833 0.0688995 0.5 610 63.546 0.00101509 -3.53139 63.546000 Cu 0.179678 0.0590223 0.5 614 63.546 0.00113057 -3.52456 63.546000 Cu 0.0374586 0.0877088 0.5 634 63.546 0.000990549 -3.53589 63.546000 Cu 0.0918962 0.0827183 5.26895e-16 636 63.546 0.000146429 -3.53352 63.546000 Cu 0.16704 0.0915323 3.74382e-16 637 63.546 0.000517059 -3.53264 63.546000 Cu 0.146282 0.0777755 0.5 638 63.546 0.000407653 -3.5314 63.546000 Cu 0.112626 0.0965021 0.5 639 63.546 0.000147106 -3.53353 63.546000 Cu 0.233773 0.0540622 5.11295e-16 612 63.546 0.00246135 -3.53076 63.546000 Cu 0.200579 0.0728247 1.50473e-16 640 63.546 0.000825235 -3.53012 63.546000 Cu 0.275949 0.0815577 5.55933e-16 641 63.546 0.00473002 -3.52555 63.546000 Cu 0.254742 0.0679125 0.5 642 63.546 0.00415817 -3.52533 63.546000 Cu 0.221467 0.0865706 0.5 643 63.546 0.00211728 -3.52928 63.546000 Cu 0.3091 0.062935 3.29624e-16 644 63.546 0.0102356 -3.52239 63.546000 Cu 0.385752 0.071109 5.26535e-16 645 63.546 0.0026733 -3.53177 63.546000 Cu 0.36383 0.0579107 0.5 646 63.546 0.0286781 -3.50954 63.546000 Cu 0.330618 0.0764539 0.5 647 63.546 0.00776747 -3.52292 63.546000 Cu 0.297236 0.0950885 0.5 680 63.546 0.00259599 -3.52851 63.546000 Cu 0.352177 0.0898351 2.70347e-16 682 63.546 0.00100807 -3.53315 63.546000 Cu 0.419679 0.0524208 5.50653e-16 648 63.546 0.0102547 -3.52242 63.546000 Cu 0.496212 0.0601976 6.1713e-16 649 63.546 0.0180176 -3.54637 63.546000 Cu 0.441083 0.0656037 0.5 651 63.546 0.0126291 -3.54624 63.546000 Cu 0.550903 0.0549955 0.5 655 63.546 0.0108958 -3.53045 63.546000 Cu 0.428293 0.0979979 5.41294e-16 683 63.546 0.00332736 -3.5414 63.546000 Cu 0.407202 0.0844635 0.5 684 63.546 0.00354764 -3.54106 63.546000 Cu 0.462115 0.0791189 7.47084e-16 686 63.546 0.00785084 -3.54439 63.546000 Cu 0.537459 0.0877088 5.61933e-16 687 63.546 0.000990549 -3.53589 63.546000 Cu 0.516813 0.0739184 0.5 688 63.546 0.00537243 -3.54104 63.546000 Cu 0.482965 0.0927953 0.5 689 63.546 0.00284048 -3.5396 63.546000 Cu 0.571283 0.0688995 5.67333e-16 690 63.546 0.00101509 -3.53139 63.546000 Cu 0.591896 0.0827183 0.5 693 63.546 0.000146429 -3.53352 63.546000 Cu 0.604889 0.0500662 5.00496e-16 653 63.546 0.00635841 -3.50715 63.546000 Cu 0.646282 0.0777755 3.65742e-16 691 63.546 0.000407653 -3.5314 63.546000 Cu 0.625615 0.0639449 0.5 692 63.546 0.000871269 -3.52589 63.546000 Cu 0.679678 0.0590223 6.59848e-16 694 63.546 0.00113057 -3.52456 63.546000 Cu 0.754742 0.0679125 2.66987e-16 695 63.546 0.00415817 -3.52533 63.546000 Cu 0.733773 0.0540622 0.5 696 63.546 0.00246135 -3.53076 63.546000 Cu 0.700579 0.0728247 0.5 697 63.546 0.000825235 -3.53012 63.546000 Cu 0.612626 0.0965021 4.31379e-16 728 63.546 0.000147106 -3.53353 63.546000 Cu 0.66704 0.0915323 0.5 730 63.546 0.000517059 -3.53264 63.546000 Cu 0.721467 0.0865706 4.58378e-16 732 63.546 0.00211728 -3.52928 63.546000 Cu 0.797236 0.0950885 4.0942e-16 733 63.546 0.00259599 -3.52851 63.546000 Cu 0.775949 0.0815577 0.5 734 63.546 0.00473002 -3.52555 63.546000 Cu 0.996212 0.0601976 0.5 606 63.546 0.0180176 -3.54637 63.546000 Cu 0.982965 0.0927953 5.32174e-16 632 63.546 0.00284048 -3.5396 63.546000 Cu 0.86383 0.0579107 4.80577e-16 699 63.546 0.0286781 -3.50954 63.546000 Cu 0.8091 0.062935 0.5 701 63.546 0.0102356 -3.52239 63.546000 Cu 0.919679 0.0524208 0.5 704 63.546 0.0102547 -3.52242 63.546000 Cu 0.830618 0.0764539 5.75852e-16 736 63.546 0.00776747 -3.52292 63.546000 Cu 0.907202 0.0844635 2.53908e-16 737 63.546 0.00354764 -3.54106 63.546000 Cu 0.885752 0.071109 0.5 738 63.546 0.0026733 -3.53177 63.546000 Cu 0.852177 0.0898351 0.5 739 63.546 0.00100807 -3.53315 63.546000 Cu 0.941083 0.0656037 6.09211e-16 740 63.546 0.0126291 -3.54624 63.546000 Cu 0.962115 0.0791189 0.5 741 63.546 0.00785084 -3.54439 63.546000 Cu 0.928293 0.0979979 0.5 776 63.546 0.00332736 -3.5414 63.546000 Cu 0.0581993 0.101486 4.74217e-16 633 63.546 0.000191305 -3.53438 63.546000 Cu 0.00374503 0.106528 0.5 635 63.546 0.000761146 -3.53655 63.546000 Cu 0.0245308 0.120261 5.67573e-16 670 63.546 0.000224848 -3.53552 63.546000 Cu 0.0998118 0.128953 4.1626e-16 671 63.546 0.000258663 -3.53302 63.546000 Cu 0.0789993 0.11524 0.5 672 63.546 8.88322e-05 -3.53356 63.546000 Cu 0.0452801 0.133981 0.5 673 63.546 5.83952e-05 -3.53491 63.546000 Cu 0.133425 0.110239 5.65533e-16 674 63.546 0.000382625 -3.53259 63.546000 Cu 0.187901 0.105238 0.5 676 63.546 0.00121649 -3.53147 63.546000 Cu 0.154313 0.123927 0.5 677 63.546 0.000767296 -3.53156 63.546000 Cu 0.0660473 0.147669 4.37739e-16 708 63.546 0.000168649 -3.5336 63.546000 Cu 0.120637 0.142619 0.5 710 63.546 0.000395482 -3.53246 63.546000 Cu 0.17527 0.137552 3.21344e-16 712 63.546 0.000559011 -3.53197 63.546000 Cu 0.24248 0.1002 6.31529e-16 678 63.546 0.00218579 -3.52949 63.546000 Cu 0.20888 0.118867 3.09825e-16 675 63.546 0.00109747 -3.53114 63.546000 Cu 0.31846 0.108562 7.03046e-16 679 63.546 0.00042566 -3.53481 63.546000 Cu 0.263602 0.113752 0.5 681 63.546 0.000856891 -3.53137 63.546000 Cu 0.373433 0.103288 0.5 685 63.546 0.00109198 -3.53952 63.546000 Cu 0.250995 0.146002 7.37004e-16 713 63.546 0.000113999 -3.5348 63.546000 Cu 0.229964 0.132439 0.5 714 63.546 0.00032401 -3.53271 63.546000 Cu 0.284721 0.127282 4.49138e-16 716 63.546 0.000168254 -3.53451 63.546000 Cu 0.360549 0.135637 5.73452e-16 717 63.546 0.000415655 -3.53758 63.546000 Cu 0.339585 0.122077 0.5 718 63.546 0.000276889 -3.53766 63.546000 Cu 0.305791 0.140834 0.5 719 63.546 0.000104175 -3.53626 63.546000 Cu 0.394419 0.116839 5.02656e-16 720 63.546 0.00115811 -3.53991 63.546000 Cu 0.381489 0.149248 0.5 756 63.546 0.000503517 -3.5372 63.546000 Cu 0.469967 0.125334 1.92231e-16 721 63.546 0.000530302 -3.53704 63.546000 Cu 0.449167 0.111648 0.5 722 63.546 0.00141603 -3.53926 63.546000 Cu 0.415319 0.13046 0.5 723 63.546 0.000821916 -3.53805 63.546000 Cu 0.503745 0.106528 3.99101e-16 724 63.546 0.000761146 -3.53655 63.546000 Cu 0.578999 0.11524 3.59023e-16 725 63.546 8.88322e-05 -3.53356 63.546000 Cu 0.558199 0.101486 0.5 726 63.546 0.000191305 -3.53438 63.546000 Cu 0.524531 0.120261 0.5 727 63.546 0.000224848 -3.53552 63.546000 Cu 0.436128 0.144119 5.06975e-16 758 63.546 0.000333598 -3.53666 63.546000 Cu 0.490726 0.139032 0.5 760 63.546 0.000121137 -3.53592 63.546000 Cu 0.54528 0.133981 5.25695e-16 762 63.546 5.83952e-05 -3.53491 63.546000 Cu 0.566047 0.147669 0.5 765 63.546 0.000168649 -3.5336 63.546000 Cu 0.599812 0.128953 0.5 764 63.546 0.000258663 -3.53302 63.546000 Cu 0.74248 0.1002 0.5 735 63.546 0.00218579 -3.52949 63.546000 Cu 0.687901 0.105238 5.93371e-16 729 63.546 0.00121649 -3.53147 63.546000 Cu 0.633425 0.110239 0.5 731 63.546 0.000382625 -3.53259 63.546000 Cu 0.620637 0.142619 3.14265e-16 763 63.546 0.000395482 -3.53246 63.546000 Cu 0.654313 0.123927 5.70812e-16 766 63.546 0.000767296 -3.53156 63.546000 Cu 0.729964 0.132439 3.96221e-16 767 63.546 0.00032401 -3.53271 63.546000 Cu 0.70888 0.118867 0.5 768 63.546 0.00109747 -3.53114 63.546000 Cu 0.67527 0.137552 0.5 769 63.546 0.000559011 -3.53197 63.546000 Cu 0.763602 0.113752 3.04785e-16 770 63.546 0.000856891 -3.53137 63.546000 Cu 0.784721 0.127282 0.5 773 63.546 0.000168254 -3.53451 63.546000 Cu 0.750995 0.146002 0.5 806 63.546 0.000113999 -3.5348 63.546000 Cu 0.990726 0.139032 2.96266e-16 668 63.546 0.000121137 -3.53592 63.546000 Cu 0.969967 0.125334 0.5 669 63.546 0.000530302 -3.53704 63.546000 Cu 0.839585 0.122077 3.28304e-16 771 63.546 0.000276889 -3.53766 63.546000 Cu 0.81846 0.108562 0.5 772 63.546 0.00042566 -3.53481 63.546000 Cu 0.873433 0.103288 5.43094e-16 774 63.546 0.00109198 -3.53952 63.546000 Cu 0.949167 0.111648 6.41009e-16 775 63.546 0.00141603 -3.53926 63.546000 Cu 0.894419 0.116839 0.5 777 63.546 0.00115811 -3.53991 63.546000 Cu 0.805791 0.140834 3.57703e-16 808 63.546 0.000104175 -3.53626 63.546000 Cu 0.881489 0.149248 5.36134e-16 809 63.546 0.000503517 -3.5372 63.546000 Cu 0.860549 0.135637 0.5 810 63.546 0.000415655 -3.53758 63.546000 Cu 0.915319 0.13046 5.43694e-16 812 63.546 0.000821916 -3.53805 63.546000 Cu 0.936128 0.144119 0.5 813 63.546 0.000333598 -3.53666 63.546000 Cu 0.0322621 0.166384 3.79182e-16 705 63.546 9.29502e-05 -3.53379 63.546000 Cu 0.0114801 0.15272 0.5 706 63.546 4.05474e-05 -3.53458 63.546000 Cu 0.141517 0.156235 5.24495e-16 709 63.546 0.000224147 -3.53226 63.546000 Cu 0.086872 0.161311 0.5 711 63.546 0.000160971 -3.53295 63.546000 Cu 0.196235 0.151132 0.5 715 63.546 0.000137877 -3.53308 63.546000 Cu 0.0738249 0.19361 4.62458e-16 743 63.546 0.000155122 -3.53402 63.546000 Cu 0.0530606 0.180014 0.5 744 63.546 0.000133947 -3.5337 63.546000 Cu 0.0190481 0.198708 0.5 745 63.546 9.16985e-05 -3.53428 63.546000 Cu 0.107739 0.174923 4.90536e-16 746 63.546 7.5839e-05 -3.53381 63.546000 Cu 0.183299 0.183411 8.41519e-16 747 63.546 0.000113031 -3.53508 63.546000 Cu 0.162426 0.169823 0.5 748 63.546 5.55163e-05 -3.53376 63.546000 Cu 0.128557 0.188521 0.5 749 63.546 0.000156114 -3.53472 63.546000 Cu 0.217142 0.164707 3.72582e-16 750 63.546 4.89352e-05 -3.53455 63.546000 Cu 0.292817 0.173145 4.30539e-16 751 63.546 0.000141139 -3.53642 63.546000 Cu 0.27193 0.159567 0.5 752 63.546 3.34936e-05 -3.5358 63.546000 Cu 0.238037 0.178285 0.5 753 63.546 4.9379e-05 -3.53556 63.546000 Cu 0.326742 0.154407 5.60613e-16 754 63.546 0.000237759 -3.53673 63.546000 Cu 0.347552 0.16801 0.5 757 63.546 0.000177516 -3.53677 63.546000 Cu 0.20404 0.196993 0.5 786 63.546 0.000178428 -3.53485 63.546000 Cu 0.258823 0.19187 5.79692e-16 788 63.546 0.000168695 -3.53562 63.546000 Cu 0.313571 0.18675 0.5 790 63.546 0.000100406 -3.53664 63.546000 Cu 0.368306 0.181636 4.45298e-16 792 63.546 8.98946e-05 -3.53663 63.546000 Cu 0.388993 0.19526 0.5 795 63.546 0.000163358 -3.53519 63.546000 Cu 0.402272 0.16289 4.83817e-16 755 63.546 0.000180388 -3.5365 63.546000 Cu 0.51148 0.15272 3.81942e-16 759 63.546 4.05474e-05 -3.53458 63.546000 Cu 0.456901 0.157795 0.5 761 63.546 6.88757e-05 -3.53539 63.546000 Cu 0.443703 0.190178 4.91976e-16 793 63.546 0.000102118 -3.53545 63.546000 Cu 0.422996 0.176537 0.5 794 63.546 4.32124e-05 -3.53644 63.546000 Cu 0.477666 0.171454 3.25424e-16 796 63.546 4.97815e-05 -3.53514 63.546000 Cu 0.553061 0.180014 5.45974e-16 797 63.546 0.000133947 -3.5337 63.546000 Cu 0.532262 0.166384 0.5 798 63.546 9.29502e-05 -3.53379 63.546000 Cu 0.498398 0.185096 0.5 799 63.546 0.000134649 -3.53483 63.546000 Cu 0.586872 0.161311 4.95336e-16 800 63.546 0.000160971 -3.53295 63.546000 Cu 0.519048 0.198708 4.77337e-16 834 63.546 9.16985e-05 -3.53428 63.546000 Cu 0.573825 0.19361 0.5 836 63.546 0.000155122 -3.53402 63.546000 Cu 0.662426 0.169823 6.31769e-16 801 63.546 5.55163e-05 -3.53376 63.546000 Cu 0.641517 0.156235 0.5 802 63.546 0.000224147 -3.53226 63.546000 Cu 0.607739 0.174923 0.5 803 63.546 7.5839e-05 -3.53381 63.546000 Cu 0.696235 0.151132 3.20025e-16 804 63.546 0.000137877 -3.53308 63.546000 Cu 0.77193 0.159567 5.89651e-16 805 63.546 3.34936e-05 -3.5358 63.546000 Cu 0.717142 0.164707 0.5 807 63.546 4.89352e-05 -3.53455 63.546000 Cu 0.628557 0.188521 8.43199e-16 838 63.546 0.000156114 -3.53472 63.546000 Cu 0.70404 0.196993 4.2154e-16 839 63.546 0.000178428 -3.53485 63.546000 Cu 0.683299 0.183411 0.5 840 63.546 0.000113031 -3.53508 63.546000 Cu 0.738037 0.178285 3.22304e-16 842 63.546 4.9379e-05 -3.53556 63.546000 Cu 0.792817 0.173145 0.5 844 63.546 0.000141139 -3.53642 63.546000 Cu 0.758823 0.19187 0.5 845 63.546 0.000168695 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63.546000 Cu 0.552291 0.303967 0.5 947 63.546 5.16231e-05 -3.53507 63.546000 Cu 0.429039 0.346461 4.27899e-16 975 63.546 9.07959e-05 -3.53473 63.546000 Cu 0.408474 0.332836 0.5 976 63.546 4.20078e-05 -3.53377 63.546000 Cu 0.463228 0.327752 6.2121e-16 978 63.546 6.55525e-05 -3.53474 63.546000 Cu 0.538439 0.336305 2.18869e-16 979 63.546 0.000137178 -3.53604 63.546000 Cu 0.517984 0.32267 0.5 980 63.546 2.74059e-05 -3.53532 63.546000 Cu 0.483716 0.34139 0.5 981 63.546 3.96247e-05 -3.53558 63.546000 Cu 0.57275 0.317583 1.9967e-16 982 63.546 1.95382e-05 -3.53637 63.546000 Cu 0.593213 0.331197 0.5 985 63.546 0.00014499 -3.53594 63.546000 Cu 0.558992 0.349931 0.5 1018 63.546 0.000244443 -3.53645 63.546000 Cu 0.64805 0.326083 2.83186e-16 983 63.546 8.73592e-05 -3.53581 63.546000 Cu 0.62753 0.312481 0.5 984 63.546 5.12851e-05 -3.53691 63.546000 Cu 0.68234 0.307382 4.38939e-16 986 63.546 0.000125038 -3.5367 63.546000 Cu 0.75775 0.31584 3.15945e-16 987 63.546 1.01102e-05 -3.53543 63.546000 Cu 0.737185 0.302272 0.5 988 63.546 0.000115888 -3.53589 63.546000 Cu 0.702908 0.320966 0.5 989 63.546 3.8641e-05 -3.53529 63.546000 Cu 0.613786 0.344796 3.47743e-16 1020 63.546 0.000169896 -3.53605 63.546000 Cu 0.66862 0.339661 0.5 1022 63.546 0.000107402 -3.535 63.546000 Cu 0.723493 0.334531 6.2421e-16 1024 63.546 2.70565e-05 -3.53391 63.546000 Cu 0.798957 0.342986 4.01261e-16 1025 63.546 0.000167366 -3.53325 63.546000 Cu 0.77833 0.329412 0.5 1026 63.546 5.64584e-05 -3.53446 63.546000 Cu 0.744153 0.348091 0.5 1027 63.546 0.000107676 -3.53299 63.546000 Cu 0.997507 0.309059 0.5 889 63.546 2.92286e-05 -3.5345 63.546000 Cu 0.983716 0.34139 6.05731e-16 924 63.546 3.96247e-05 -3.53558 63.546000 Cu 0.867389 0.30564 5.68173e-16 991 63.546 5.15787e-05 -3.5335 63.546000 Cu 0.81259 0.310726 0.5 993 63.546 9.90482e-05 -3.53443 63.546000 Cu 0.922206 0.300556 0.5 996 63.546 5.73528e-05 -3.53461 63.546000 Cu 0.833154 0.32431 1.50953e-16 1028 63.546 8.4647e-05 -3.53409 63.546000 Cu 0.908474 0.332836 3.87461e-16 1029 63.546 4.20078e-05 -3.53377 63.546000 Cu 0.887924 0.31923 0.5 1030 63.546 2.5492e-05 -3.5339 63.546000 Cu 0.853738 0.337907 0.5 1031 63.546 8.61295e-05 -3.53318 63.546000 Cu 0.942716 0.314146 4.0882e-16 1032 63.546 2.35304e-05 -3.53493 63.546000 Cu 0.963228 0.327752 0.5 1033 63.546 6.55525e-05 -3.53474 63.546000 Cu 0.929039 0.346461 0.5 1068 63.546 9.07959e-05 -3.53473 63.546000 Cu 0.00424918 0.355043 0.5 927 63.546 0.000196698 -3.53669 63.546000 Cu 0.0248503 0.368684 6.77967e-16 962 63.546 0.000426663 -3.53754 63.546000 Cu 0.100404 0.377108 4.60778e-16 963 63.546 0.000260647 -3.53637 63.546000 Cu 0.0796343 0.363537 0.5 964 63.546 0.000348426 -3.53683 63.546000 Cu 0.0455337 0.382295 0.5 965 63.546 0.00076472 -3.53802 63.546000 Cu 0.134466 0.358373 5.39614e-16 966 63.546 0.000141279 -3.53592 63.546000 Cu 0.189331 0.353219 0.5 968 63.546 6.11517e-05 -3.53395 63.546000 Cu 0.155287 0.371921 0.5 969 63.546 0.000110955 -3.53456 63.546000 Cu 0.0664362 0.395855 6.1293e-16 1000 63.546 0.000502867 -3.53704 63.546000 Cu 0.121324 0.390631 0.5 1002 63.546 0.000202696 -3.53434 63.546000 Cu 0.176197 0.385457 5.22695e-16 1004 63.546 0.000605067 -3.53289 63.546000 Cu 0.197172 0.399019 0.5 1007 63.546 0.00131566 -3.53183 63.546000 Cu 0.210109 0.366773 2.54628e-16 967 63.546 0.000276579 -3.53289 63.546000 Cu 0.319616 0.356582 5.18375e-16 971 63.546 0.000301099 -3.53341 63.546000 Cu 0.264875 0.361666 0.5 973 63.546 0.000287057 -3.53305 63.546000 Cu 0.374317 0.351525 0.5 977 63.546 0.000131515 -3.53374 63.546000 Cu 0.251831 0.393964 5.01696e-16 1005 63.546 0.000802746 -3.53224 63.546000 Cu 0.230965 0.380349 0.5 1006 63.546 0.000536312 -3.53232 63.546000 Cu 0.285643 0.375274 3.46423e-16 1008 63.546 0.000444121 -3.533 63.546000 Cu 0.36093 0.383908 7.68923e-16 1009 63.546 9.62289e-05 -3.53463 63.546000 Cu 0.340273 0.370223 0.5 1010 63.546 0.000249366 -3.53442 63.546000 Cu 0.306389 0.388931 0.5 1011 63.546 0.000399169 -3.53316 63.546000 Cu 0.394923 0.365178 5.90251e-16 1012 63.546 9.06059e-05 -3.53473 63.546000 Cu 0.381562 0.39763 0.5 1048 63.546 0.000161214 -3.53478 63.546000 Cu 0.470105 0.373797 4.0858e-16 1013 63.546 0.000410167 -3.53648 63.546000 Cu 0.449546 0.360127 0.5 1014 63.546 0.00010016 -3.53555 63.546000 Cu 0.415499 0.37887 0.5 1015 63.546 0.000113718 -3.53512 63.546000 Cu 0.504249 0.355043 5.63493e-16 1016 63.546 0.000196698 -3.53669 63.546000 Cu 0.579634 0.363537 4.70377e-16 1017 63.546 0.000348426 -3.53683 63.546000 Cu 0.52485 0.368684 0.5 1019 63.546 0.000426663 -3.53754 63.546000 Cu 0.436106 0.39257 8.2592e-16 1050 63.546 0.000580237 -3.53629 63.546000 Cu 0.490777 0.387462 0.5 1052 63.546 0.000969525 -3.5381 63.546000 Cu 0.545534 0.382295 6.2361e-16 1054 63.546 0.00076472 -3.53802 63.546000 Cu 0.566436 0.395855 0.5 1057 63.546 0.000502867 -3.53704 63.546000 Cu 0.689331 0.353219 2.78027e-16 1021 63.546 6.11517e-05 -3.53395 63.546000 Cu 0.634466 0.358373 0.5 1023 63.546 0.000141279 -3.53592 63.546000 Cu 0.621324 0.390631 6.78567e-16 1055 63.546 0.000202696 -3.53434 63.546000 Cu 0.600404 0.377108 0.5 1056 63.546 0.000260647 -3.53637 63.546000 Cu 0.655287 0.371921 2.37829e-16 1058 63.546 0.000110955 -3.53456 63.546000 Cu 0.730965 0.380349 6.02731e-16 1059 63.546 0.000536312 -3.53232 63.546000 Cu 0.710109 0.366773 0.5 1060 63.546 0.000276579 -3.53289 63.546000 Cu 0.676197 0.385457 0.5 1061 63.546 0.000605067 -3.53289 63.546000 Cu 0.764875 0.361666 5.24375e-16 1062 63.546 0.000287057 -3.53305 63.546000 Cu 0.785643 0.375274 0.5 1065 63.546 0.000444121 -3.533 63.546000 Cu 0.751831 0.393964 0.5 1098 63.546 0.000802746 -3.53224 63.546000 Cu 0.697172 0.399019 6.40769e-16 1096 63.546 0.00131566 -3.53183 63.546000 Cu 0.990777 0.387462 5.72132e-16 960 63.546 0.000969525 -3.5381 63.546000 Cu 0.970105 0.373797 0.5 961 63.546 0.000410167 -3.53648 63.546000 Cu 0.840273 0.370223 5.18015e-16 1063 63.546 0.000249366 -3.53442 63.546000 Cu 0.819616 0.356582 0.5 1064 63.546 0.000301099 -3.53341 63.546000 Cu 0.874317 0.351525 7.02326e-16 1066 63.546 0.000131515 -3.53374 63.546000 Cu 0.949546 0.360127 5.69132e-16 1067 63.546 0.00010016 -3.53555 63.546000 Cu 0.894923 0.365178 0.5 1069 63.546 9.06059e-05 -3.53473 63.546000 Cu 0.806389 0.388931 5.94331e-16 1100 63.546 0.000399169 -3.53316 63.546000 Cu 0.881562 0.39763 4.0738e-16 1101 63.546 0.000161214 -3.53478 63.546000 Cu 0.86093 0.383908 0.5 1102 63.546 9.62289e-05 -3.53463 63.546000 Cu 0.915499 0.37887 4.86216e-16 1104 63.546 0.000113718 -3.53512 63.546000 Cu 0.936106 0.39257 0.5 1105 63.546 0.000580237 -3.53629 63.546000 Cu 0.0325293 0.414622 2.60387e-17 997 63.546 0.00131728 -3.53789 63.546000 Cu 0.0115457 0.40108 0.5 998 63.546 0.0015916 -3.53893 63.546000 Cu 0.142412 0.404137 3.37904e-16 1001 63.546 0.00121952 -3.53117 63.546000 Cu 0.0875012 0.409343 0.5 1003 63.546 0.000364707 -3.53311 63.546000 Cu 0.0753422 0.441437 1.45793e-16 1035 63.546 0.00833751 -3.52302 63.546000 Cu 0.0537893 0.428056 0.5 1036 63.546 0.000932202 -3.53261 63.546000 Cu 0.020173 0.446773 0.5 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1084 63.546 0.000863992 -3.53628 63.546000 Cu 0.389046 0.443968 0.5 1087 63.546 0.00525613 -3.54078 63.546000 Cu 0.334589 0.448997 4.49738e-16 1081 63.546 0.00104077 -3.53106 63.546000 Cu 0.402239 0.411364 8.50879e-16 1047 63.546 0.000712426 -3.53608 63.546000 Cu 0.511546 0.40108 6.09811e-16 1051 63.546 0.0015916 -3.53893 63.546000 Cu 0.456827 0.406261 0.5 1053 63.546 0.00166493 -3.53812 63.546000 Cu 0.443747 0.438768 6.37049e-16 1085 63.546 0.00814898 -3.54476 63.546000 Cu 0.422944 0.425094 0.5 1086 63.546 0.00289246 -3.53972 63.546000 Cu 0.47765 0.419902 7.61603e-16 1088 63.546 0.00360632 -3.54076 63.546000 Cu 0.553789 0.428056 5.04336e-16 1089 63.546 0.000932202 -3.53261 63.546000 Cu 0.532529 0.414622 0.5 1090 63.546 0.00131728 -3.53789 63.546000 Cu 0.498724 0.433429 0.5 1091 63.546 0.00370834 -3.54145 63.546000 Cu 0.587501 0.409343 4.31739e-16 1092 63.546 0.000364707 -3.53311 63.546000 Cu 0.520173 0.446773 4.231e-16 1123 63.546 0.00264315 -3.53154 63.546000 Cu 0.575342 0.441437 0.5 1125 63.546 0.00833751 -3.52302 63.546000 Cu 0.663481 0.417682 3.06345e-16 1093 63.546 0.00258432 -3.52995 63.546000 Cu 0.642412 0.404137 0.5 1094 63.546 0.00121952 -3.53117 63.546000 Cu 0.608747 0.422799 0.5 1095 63.546 0.00307948 -3.52811 63.546000 Cu 0.772603 0.407642 6.54928e-16 1097 63.546 0.000510066 -3.53306 63.546000 Cu 0.718099 0.412646 0.5 1099 63.546 0.00134153 -3.53206 63.546000 Cu 0.63001 0.436334 5.16935e-16 1127 63.546 0.0051634 -3.52619 63.546000 Cu 0.705324 0.445079 5.13095e-16 1128 63.546 0.000770274 -3.53083 63.546000 Cu 0.684482 0.431326 0.5 1129 63.546 0.00200919 -3.53024 63.546000 Cu 0.738887 0.426351 3.31304e-16 1131 63.546 0.000644587 -3.53303 63.546000 Cu 0.793309 0.421388 0.5 1133 63.546 0.000132253 -3.53363 63.546000 Cu 0.759619 0.440123 0.5 1134 63.546 0.000388447 -3.53128 63.546000 Cu 0.97765 0.419902 0.5 999 63.546 0.00360632 -3.54076 63.546000 Cu 0.998724 0.433429 7.30405e-16 1034 63.546 0.00370834 -3.54145 63.546000 Cu 0.827085 0.402648 0.5 1103 63.546 8.51518e-05 -3.53389 63.546000 Cu 0.813971 0.435177 6.2181e-16 1132 63.546 0.000167596 -3.53347 63.546000 Cu 0.847748 0.416399 4.37379e-16 1135 63.546 0.000159245 -3.53469 63.546000 Cu 0.922944 0.425094 3.52063e-16 1136 63.546 0.00289246 -3.53972 63.546000 Cu 0.902239 0.411364 0.5 1137 63.546 0.000712426 -3.53608 63.546000 Cu 0.868417 0.430176 0.5 1138 63.546 0.000863992 -3.53628 63.546000 Cu 0.956827 0.406261 5.86292e-16 1139 63.546 0.00166493 -3.53812 63.546000 Cu 0.889046 0.443968 3.09345e-16 1158 63.546 0.00525613 -3.54078 63.546000 Cu 0.943747 0.438768 0.5 1160 63.546 0.00814898 -3.54476 63.546000 Cu 0.834589 0.448997 0.5 1156 63.546 0.00104077 -3.53106 63.546000 Cu 0.00885331 0.478317 5.95411e-16 1070 63.546 0.143636 -3.45675 63.546000 Cu 0.0420946 0.459979 2.71427e-16 1072 63.546 0.0299233 -3.50899 63.546000 Cu 0.118024 0.46863 4.99416e-16 1073 63.546 0.0104368 -3.51467 63.546000 Cu 0.0968053 0.454962 0.5 1074 63.546 0.0105807 -3.52255 63.546000 Cu 0.0633513 0.473539 0.5 1075 63.546 0.0235179 -3.50894 63.546000 Cu 0.151171 0.450004 2.20669e-16 1076 63.546 0.00352863 -3.52626 63.546000 Cu 0.1721 0.46386 0.5 1079 63.546 0.00228304 -3.53099 63.546000 Cu 0.028852 0.492139 0.5 1107 63.546 0.570228 -3.42953 63.546000 Cu 0.0848843 0.487143 3.38744e-16 1108 63.546 0.125844 -3.45888 63.546000 Cu 0.159437 0.496231 4.219e-16 1109 63.546 0.852198 -3.32962 63.546000 Cu 0.138095 0.482656 0.5 1110 63.546 0.0351172 -3.49342 63.546000 Cu 0.193198 0.477642 5.05296e-16 1111 63.546 0.0134308 -3.51017 63.546000 Cu 0.226223 0.458892 2.1587e-16 1077 63.546 0.00115093 -3.5235 63.546000 Cu 0.280266 0.453965 0.5 1083 63.546 0.000843942 -3.52517 63.546000 Cu 0.268922 0.486769 4.90776e-16 1112 63.546 0.111619 -3.46911 63.546000 Cu 0.247115 0.47287 0.5 1113 63.546 0.00596913 -3.51648 63.546000 Cu 0.212793 0.491751 0.5 1114 63.546 0.387474 -3.42468 63.546000 Cu 0.30103 0.467846 4.58498e-16 1115 63.546 0.00682933 -3.5076 63.546000 Cu 0.375572 0.476733 2.72987e-16 1116 63.546 0.0509521 -3.51591 63.546000 Cu 0.355011 0.462898 0.5 1117 63.546 0.0107739 -3.53031 63.546000 Cu 0.321734 0.482106 0.5 1118 63.546 0.0337779 -3.48743 63.546000 Cu 0.344304 0.496101 3.29744e-16 1140 63.546 0.642154 -3.3941 63.546000 Cu 0.396526 0.490874 0.5 1141 63.546 0.606842 -3.48241 63.546000 Cu 0.409703 0.457687 5.15135e-16 1119 63.546 0.0176054 -3.54566 63.546000 Cu 0.486258 0.465457 6.1689e-16 1120 63.546 0.0108098 -3.52241 63.546000 Cu 0.464816 0.45228 0.5 1121 63.546 0.0125039 -3.54578 63.546000 Cu 0.430433 0.471241 0.5 1122 63.546 0.0585544 -3.54216 63.546000 Cu 0.596805 0.454962 1.79511e-16 1124 63.546 0.0105807 -3.52255 63.546000 Cu 0.542095 0.459979 0.5 1126 63.546 0.0299233 -3.50899 63.546000 Cu 0.451582 0.484134 2.21749e-16 1142 63.546 0.0973431 -3.44422 63.546000 Cu 0.528852 0.492139 3.43663e-16 1143 63.546 0.570228 -3.42953 63.546000 Cu 0.508853 0.478317 0.5 1144 63.546 0.143636 -3.45675 63.546000 Cu 0.563351 0.473539 4.41339e-16 1146 63.546 0.0235179 -3.50894 63.546000 Cu 0.584884 0.487143 0.5 1149 63.546 0.125844 -3.45888 63.546000 Cu 0.476124 0.4963 0.5 1145 63.546 1.84687 -3.17744 63.546000 Cu 0.651171 0.450004 0.5 1130 63.546 0.00352863 -3.52626 63.546000 Cu 0.638095 0.482656 4.47338e-16 1147 63.546 0.0351172 -3.49342 63.546000 Cu 0.618024 0.46863 0.5 1148 63.546 0.0104368 -3.51467 63.546000 Cu 0.6721 0.46386 4.93416e-16 1150 63.546 0.00228304 -3.53099 63.546000 Cu 0.747115 0.47287 5.40694e-16 1151 63.546 0.00596913 -3.51648 63.546000 Cu 0.726223 0.458892 0.5 1152 63.546 0.00115093 -3.5235 63.546000 Cu 0.693198 0.477642 0.5 1153 63.546 0.0134308 -3.51017 63.546000 Cu 0.780266 0.453965 5.81252e-16 1154 63.546 0.000843942 -3.52517 63.546000 Cu 0.659437 0.496231 0.5 1162 63.546 0.852198 -3.32962 63.546000 Cu 0.712793 0.491751 5.76332e-16 1163 63.546 0.387474 -3.42468 63.546000 Cu 0.768922 0.486769 0.5 1164 63.546 0.111619 -3.46911 63.546000 Cu 0.80103 0.467846 0.5 1157 63.546 0.00682933 -3.5076 63.546000 Cu 0.986258 0.465457 0.5 1071 63.546 0.0108098 -3.52241 63.546000 Cu 0.855011 0.462898 3.77502e-16 1155 63.546 0.0107739 -3.53031 63.546000 Cu 0.964816 0.45228 2.44668e-16 1159 63.546 0.0125039 -3.54578 63.546000 Cu 0.909703 0.457687 0.5 1161 63.546 0.0176054 -3.54566 63.546000 Cu 0.821734 0.482106 3.40304e-16 1165 63.546 0.0337779 -3.48743 63.546000 Cu 0.896526 0.490874 4.0786e-16 1166 63.546 0.606842 -3.48241 63.546000 Cu 0.875572 0.476733 0.5 1167 63.546 0.0509521 -3.51591 63.546000 Cu 0.844304 0.496101 0.5 1168 63.546 0.642154 -3.3941 63.546000 Cu 0.930433 0.471241 4.28859e-16 1169 63.546 0.0585544 -3.54216 63.546000 Cu 0.951582 0.484134 0.5 1170 63.546 0.0973431 -3.44422 63.546000 Cu 0.976124 0.4963 3.08985e-16 1106 63.546 1.84687 -3.17744 63.546000 Cu 0.00846757 0.514492 0.5 3 63.546 7.58113 -3.77855 63.546000 Cu 0.0171139 0.549219 2.36629e-16 18 63.546 0.0831174 -3.47444 63.546000 Cu 0.0493723 0.504693 2.75987e-16 47 63.546 9.59227 -3.07665 63.546000 Cu 0.0571699 0.52306 4.89936e-16 48 63.546 7.94974 -3.1134 63.546000 Cu 0.104339 0.502275 0.5 49 63.546 2.88025 -3.56923 63.546000 Cu 0.130721 0.51385 2.92306e-16 50 63.546 11.1549 -3.0303 63.546000 Cu 0.166487 0.531223 3.54223e-16 51 63.546 0.354546 -3.40106 63.546000 Cu 0.188603 0.514247 0.5 52 63.546 8.3254 -3.83918 63.546000 Cu 0.111464 0.526231 0.5 53 63.546 1.47875 -3.45885 63.546000 Cu 0.0366026 0.535693 0.5 84 63.546 0.266793 -3.43228 63.546000 Cu 0.0928978 0.540773 2.0651e-16 85 63.546 0.104013 -3.4658 63.546000 Cu 0.146653 0.545196 0.5 87 63.546 0.0107579 -3.49536 63.546000 Cu 0.232741 0.504572 6.2889e-16 20 63.546 9.57827 -3.09101 63.546000 Cu 0.313062 0.513805 3.20025e-16 21 63.546 11.5392 -3.02408 63.546000 Cu 0.288395 0.501832 0.5 22 63.546 2.5868 -3.5175 63.546000 Cu 0.370833 0.514067 0.5 26 63.546 9.56644 -3.89709 63.546000 Cu 0.239357 0.523081 2.67227e-16 54 63.546 9.21547 -3.11994 63.546000 Cu 0.276414 0.540998 4.99056e-16 55 63.546 0.0803599 -3.47596 63.546000 Cu 0.294702 0.526421 0.5 56 63.546 1.56104 -3.43058 63.546000 Cu 0.219867 0.535968 0.5 57 63.546 0.220364 -3.4315 63.546000 Cu 0.350576 0.531285 4.88376e-16 58 63.546 0.492091 -3.456 63.546000 Cu 0.330003 0.545587 0.5 61 63.546 0.0180897 -3.49168 63.546000 Cu 0.201522 0.549961 7.28125e-16 89 63.546 0.00520022 -3.52219 63.546000 Cu 0.419577 0.503615 3.65022e-16 23 63.546 2.56672 -3.41836 63.546000 Cu 0.549372 0.504693 0.5 5 63.546 9.59227 -3.07665 63.546000 Cu 0.425155 0.524417 4.29339e-16 24 63.546 1.75648 -3.32075 63.546000 Cu 0.453826 0.513811 0.5 25 63.546 9.92527 -2.76229 63.546000 Cu 0.508468 0.514492 7.28605e-16 27 63.546 7.58113 -3.77855 63.546000 Cu 0.536603 0.535693 3.61543e-16 28 63.546 0.266793 -3.43228 63.546000 Cu 0.55717 0.52306 0.5 29 63.546 7.94974 -3.1134 63.546000 Cu 0.483513 0.530989 0.5 30 63.546 0.805779 -3.29731 63.546000 Cu 0.592898 0.540773 0.5 34 63.546 0.104013 -3.4658 63.546000 Cu 0.403834 0.536894 0.5 60 63.546 0.445098 -3.48339 63.546000 Cu 0.459992 0.543403 3.06825e-16 62 63.546 0.0468686 -3.46359 63.546000 Cu 0.517114 0.549219 0.5 64 63.546 0.0831174 -3.47444 63.546000 Cu 0.604339 0.502275 2.78147e-16 4 63.546 2.88025 -3.56923 63.546000 Cu 0.688603 0.514247 3.34544e-16 6 63.546 8.3254 -3.83918 63.546000 Cu 0.732741 0.504572 0.5 7 63.546 9.57827 -3.09101 63.546000 Cu 0.630721 0.51385 0.5 8 63.546 11.1549 -3.0303 63.546000 Cu 0.788395 0.501832 3.67542e-16 9 63.546 2.5868 -3.5175 63.546000 Cu 0.739357 0.523081 0.5 12 63.546 9.21547 -3.11994 63.546000 Cu 0.611464 0.526231 5.49813e-16 31 63.546 1.47875 -3.45885 63.546000 Cu 0.646653 0.545196 5.06376e-17 32 63.546 0.0107579 -3.49536 63.546000 Cu 0.666487 0.531223 0.5 33 63.546 0.354546 -3.40106 63.546000 Cu 0.719867 0.535968 4.66777e-17 35 63.546 0.220364 -3.4315 63.546000 Cu 0.776414 0.540998 0.5 37 63.546 0.0803599 -3.47596 63.546000 Cu 0.701522 0.549961 0.5 38 63.546 0.00520022 -3.52219 63.546000 Cu 0.794702 0.526421 2.0255e-16 10 63.546 1.56104 -3.43058 63.546000 Cu 0.953826 0.513811 2.94466e-16 1 63.546 9.92527 -2.76229 63.546000 Cu 0.919577 0.503615 0.5 2 63.546 2.56672 -3.41836 63.546000 Cu 0.813062 0.513805 0.5 11 63.546 11.5392 -3.02408 63.546000 Cu 0.870833 0.514067 1.23114e-16 13 63.546 9.56644 -3.89709 63.546000 Cu 0.903834 0.536894 2.69627e-16 14 63.546 0.445098 -3.48339 63.546000 Cu 0.925155 0.524417 0.5 15 63.546 1.75648 -3.32075 63.546000 Cu 0.850576 0.531285 0.5 16 63.546 0.492091 -3.456 63.546000 Cu 0.983513 0.530989 9.79153e-17 17 63.546 0.805779 -3.29731 63.546000 Cu 0.959992 0.543403 0.5 19 63.546 0.0468686 -3.46359 63.546000 Cu 0.830003 0.545587 5.73932e-16 39 63.546 0.0180897 -3.49168 63.546000 Cu 0.0107846 0.594 1.11115e-16 82 63.546 0.00407965 -3.53885 63.546000 Cu 0.127439 0.559125 3.59503e-16 86 63.546 0.0197651 -3.51206 63.546000 Cu 0.0722385 0.554185 0.5 88 63.546 0.023064 -3.51136 63.546000 Cu 0.181925 0.563821 0.5 92 63.546 0.00236094 -3.52832 63.546000 Cu 0.0519528 0.567566 1.77231e-16 120 63.546 0.0196258 -3.51455 63.546000 Cu 0.0868233 0.586069 3.19305e-16 121 63.546 0.00722216 -3.52529 63.546000 Cu 0.107234 0.572654 0.5 122 63.546 0.0121751 -3.52309 63.546000 Cu 0.0312028 0.580721 0.5 123 63.546 0.00200316 -3.53079 63.546000 Cu 0.162132 0.57761 1.61872e-16 124 63.546 0.00710088 -3.52472 63.546000 Cu 0.141978 0.591192 0.5 127 63.546 0.00658885 -3.5266 63.546000 Cu 0.0662718 0.599381 0.5 158 63.546 0.000809797 -3.53195 63.546000 Cu 0.196876 0.596184 3.59983e-19 125 63.546 0.00368474 -3.52891 63.546000 Cu 0.384235 0.550763 2.29189e-16 59 63.546 0.0575814 -3.52649 63.546000 Cu 0.236355 0.568656 3.78942e-16 90 63.546 0.000417794 -3.52884 63.546000 Cu 0.255954 0.554753 0.5 91 63.546 0.00489878 -3.52396 63.546000 Cu 0.310498 0.559742 3.79542e-16 93 63.546 0.00517293 -3.50923 63.546000 Cu 0.345531 0.578491 1.9847e-16 94 63.546 0.000789246 -3.52924 63.546000 Cu 0.364887 0.564628 0.5 95 63.546 0.00955154 -3.52904 63.546000 Cu 0.290802 0.573551 0.5 96 63.546 0.00044954 -3.52731 63.546000 Cu 0.216674 0.582468 0.5 126 63.546 0.00123925 -3.52969 63.546000 Cu 0.271283 0.587351 9.49154e-17 128 63.546 0.000219547 -3.5322 63.546000 Cu 0.325938 0.592271 0.5 130 63.546 0.000161346 -3.53317 63.546000 Cu 0.380734 0.597237 1.59592e-16 132 63.546 0.00103412 -3.53548 63.546000 Cu 0.495781 0.56208 2.56308e-16 63 63.546 0.00750246 -3.51984 63.546000 Cu 0.439574 0.5563 0.5 65 63.546 0.0501745 -3.53852 63.546000 Cu 0.572238 0.554185 1.50113e-16 66 63.546 0.023064 -3.51136 63.546000 Cu 0.551953 0.567566 0.5 69 63.546 0.0196258 -3.51455 63.546000 Cu 0.419867 0.569784 8.42359e-17 97 63.546 0.0222822 -3.54432 63.546000 Cu 0.455408 0.588657 2.84506e-16 98 63.546 0.00965082 -3.54303 63.546000 Cu 0.47537 0.575212 0.5 99 63.546 0.0122452 -3.54252 63.546000 Cu 0.400295 0.583477 0.5 100 63.546 0.00636535 -3.53878 63.546000 Cu 0.531203 0.580721 4.0354e-16 101 63.546 0.00200316 -3.53079 63.546000 Cu 0.566272 0.599381 4.91856e-16 102 63.546 0.000809797 -3.53195 63.546000 Cu 0.586823 0.586069 0.5 103 63.546 0.00722216 -3.52529 63.546000 Cu 0.510785 0.594 0.5 104 63.546 0.00407965 -3.53885 63.546000 Cu 0.755954 0.554753 5.92291e-16 36 63.546 0.00489878 -3.52396 63.546000 Cu 0.607234 0.572654 4.39299e-16 67 63.546 0.0121751 -3.52309 63.546000 Cu 0.627439 0.559125 0.5 68 63.546 0.0197651 -3.51206 63.546000 Cu 0.681925 0.563821 9.70753e-17 70 63.546 0.00236094 -3.52832 63.546000 Cu 0.716674 0.582468 2.31109e-16 71 63.546 0.00123925 -3.52969 63.546000 Cu 0.736355 0.568656 0.5 72 63.546 0.000417794 -3.52884 63.546000 Cu 0.662132 0.57761 0.5 73 63.546 0.00710088 -3.52472 63.546000 Cu 0.790802 0.573551 2.57628e-16 74 63.546 0.00044954 -3.52731 63.546000 Cu 0.771283 0.587351 0.5 77 63.546 0.000219547 -3.5322 63.546000 Cu 0.641978 0.591192 2.26189e-16 105 63.546 0.00658885 -3.5266 63.546000 Cu 0.696876 0.596184 0.5 107 63.546 0.00368474 -3.52891 63.546000 Cu 0.884235 0.550763 0.5 41 63.546 0.0575814 -3.52649 63.546000 Cu 0.995781 0.56208 0.5 45 63.546 0.00750246 -3.51984 63.546000 Cu 0.864887 0.564628 1.81911e-16 40 63.546 0.00955154 -3.52904 63.546000 Cu 0.810498 0.559742 0.5 42 63.546 0.00517293 -3.50923 63.546000 Cu 0.939574 0.5563 1.10035e-16 43 63.546 0.0501745 -3.53852 63.546000 Cu 0.97537 0.575212 3.81822e-16 44 63.546 0.0122452 -3.54252 63.546000 Cu 0.919867 0.569784 0.5 46 63.546 0.0222822 -3.54432 63.546000 Cu 0.825938 0.592271 1.27194e-16 75 63.546 0.000161346 -3.53317 63.546000 Cu 0.845531 0.578491 0.5 76 63.546 0.000789246 -3.52924 63.546000 Cu 0.900295 0.583477 4.00181e-16 78 63.546 0.00636535 -3.53878 63.546000 Cu 0.955408 0.588657 0.5 80 63.546 0.00965082 -3.54303 63.546000 Cu 0.880734 0.597237 0.5 81 63.546 0.00103412 -3.53548 63.546000 Cu 0.00570765 0.639845 1.07515e-16 118 63.546 0.00111892 -3.53846 63.546000 Cu 0.0459379 0.612754 1.20474e-16 157 63.546 0.00148227 -3.5371 63.546000 Cu 0.12166 0.604645 2.59667e-16 159 63.546 0.00299941 -3.52868 63.546000 Cu 0.156501 0.62326 2.93146e-16 160 63.546 0.00132134 -3.53119 63.546000 Cu 0.176785 0.609768 0.5 161 63.546 0.0034377 -3.5295 63.546000 Cu 0.101272 0.61805 0.5 162 63.546 0.000396675 -3.53306 63.546000 Cu 0.0257679 0.626252 0.5 193 63.546 0.00194005 -3.53881 63.546000 Cu 0.0809334 0.631489 8.66358e-17 194 63.546 0.000637109 -3.53623 63.546000 Cu 0.136165 0.636719 0.5 196 63.546 0.000163098 -3.53376 63.546000 Cu 0.0607512 0.645012 0.5 197 63.546 0.000852384 -3.53749 63.546000 Cu 0.191311 0.641897 3.14745e-16 198 63.546 0.00067295 -3.53221 63.546000 Cu 0.251567 0.601108 0.5 131 63.546 0.000836565 -3.53228 63.546000 Cu 0.306275 0.60603 1.05235e-16 129 63.546 0.000130405 -3.53408 63.546000 Cu 0.361011 0.610981 0.5 135 63.546 0.000241275 -3.53487 63.546000 Cu 0.231705 0.614794 2.0555e-16 163 63.546 0.00236572 -3.53115 63.546000 Cu 0.266492 0.633423 1.43873e-16 164 63.546 0.00141135 -3.53145 63.546000 Cu 0.286472 0.619756 0.5 165 63.546 0.000647319 -3.53267 63.546000 Cu 0.211596 0.628378 0.5 166 63.546 0.00194735 -3.53096 63.546000 Cu 0.341186 0.624717 4.79977e-19 167 63.546 8.11263e-05 -3.53391 63.546000 Cu 0.376044 0.64341 9.59954e-19 168 63.546 6.71158e-05 -3.53423 63.546000 Cu 0.395947 0.629699 0.5 169 63.546 0.000263797 -3.53532 63.546000 Cu 0.321291 0.638417 0.5 170 63.546 0.000454615 -3.53297 63.546000 Cu 0.246324 0.647012 0.5 200 63.546 0.00103689 -3.53166 63.546000 Cu 0.415802 0.615989 2.52468e-16 133 63.546 0.000950986 -3.53658 63.546000 Cu 0.435606 0.602283 0.5 134 63.546 0.0039318 -3.5394 63.546000 Cu 0.490667 0.607473 3.79062e-16 136 63.546 0.00421605 -3.54008 63.546000 Cu 0.525768 0.626252 3.13665e-16 137 63.546 0.00194005 -3.53881 63.546000 Cu 0.545938 0.612754 0.5 138 63.546 0.00148227 -3.5371 63.546000 Cu 0.470716 0.621071 0.5 139 63.546 0.00217191 -3.53879 63.546000 Cu 0.580933 0.631489 0.5 143 63.546 0.000637109 -3.53623 63.546000 Cu 0.450779 0.634739 1.48313e-16 171 63.546 0.000742493 -3.53737 63.546000 Cu 0.505708 0.639845 0.5 173 63.546 0.00111892 -3.53846 63.546000 Cu 0.43083 0.648425 0.5 174 63.546 0.000218186 -3.53606 63.546000 Cu 0.560751 0.645012 3.83261e-16 175 63.546 0.000852384 -3.53749 63.546000 Cu 0.751567 0.601108 1.89351e-16 109 63.546 0.000836565 -3.53228 63.546000 Cu 0.676785 0.609768 5.91931e-16 106 63.546 0.0034377 -3.5295 63.546000 Cu 0.62166 0.604645 0.5 108 63.546 0.00299941 -3.52868 63.546000 Cu 0.786472 0.619756 2.39988e-19 110 63.546 0.000647319 -3.53267 63.546000 Cu 0.731705 0.614794 0.5 112 63.546 0.00236572 -3.53115 63.546000 Cu 0.601272 0.61805 2.60147e-16 140 63.546 0.000396675 -3.53306 63.546000 Cu 0.636165 0.636719 1.95591e-16 141 63.546 0.000163098 -3.53376 63.546000 Cu 0.656501 0.62326 0.5 142 63.546 0.00132134 -3.53119 63.546000 Cu 0.711596 0.628378 3.90941e-16 144 63.546 0.00194735 -3.53096 63.546000 Cu 0.746324 0.647012 2.1383e-16 145 63.546 0.00103689 -3.53166 63.546000 Cu 0.766492 0.633423 0.5 146 63.546 0.00141135 -3.53145 63.546000 Cu 0.691311 0.641897 0.5 147 63.546 0.00067295 -3.53221 63.546000 Cu 0.935606 0.602283 1.56592e-16 79 63.546 0.0039318 -3.5394 63.546000 Cu 0.990667 0.607473 0.5 83 63.546 0.00421605 -3.54008 63.546000 Cu 0.806275 0.60603 0.5 111 63.546 0.000130405 -3.53408 63.546000 Cu 0.861011 0.610981 2.23309e-16 113 63.546 0.000241275 -3.53487 63.546000 Cu 0.895947 0.629699 2.54028e-16 114 63.546 0.000263797 -3.53532 63.546000 Cu 0.915802 0.615989 0.5 115 63.546 0.000950986 -3.53658 63.546000 Cu 0.841186 0.624717 0.5 116 63.546 8.11263e-05 -3.53391 63.546000 Cu 0.970716 0.621071 2.94826e-16 117 63.546 0.00217191 -3.53879 63.546000 Cu 0.950779 0.634739 0.5 119 63.546 0.000742493 -3.53737 63.546000 Cu 0.821291 0.638417 4.2178e-16 148 63.546 0.000454615 -3.53297 63.546000 Cu 0.876044 0.64341 0.5 150 63.546 6.71158e-05 -3.53423 63.546000 Cu 0.93083 0.648425 1.88271e-16 152 63.546 0.000218186 -3.53606 63.546000 Cu 0.115846 0.650206 5.54373e-17 195 63.546 0.000339493 -3.536 63.546000 Cu 0.0205597 0.672232 0.5 156 63.546 0.000240811 -3.53639 63.546000 Cu 0.000453107 0.685874 3.02385e-16 191 63.546 5.42213e-05 -3.53587 63.546000 Cu 0.170978 0.655397 0.5 201 63.546 9.32698e-05 -3.53423 63.546000 Cu 0.040647 0.658602 7.19965e-19 230 63.546 0.000545464 -3.53715 63.546000 Cu 0.0755091 0.677347 4.79977e-19 231 63.546 0.000260709 -3.53749 63.546000 Cu 0.0956605 0.663756 0.5 232 63.546 0.000331204 -3.53722 63.546000 Cu 0.150729 0.668925 4.87536e-16 233 63.546 0.000117656 -3.53631 63.546000 Cu 0.185499 0.687647 3.07545e-16 234 63.546 2.47303e-05 -3.53602 63.546000 Cu 0.130495 0.682492 0.5 236 63.546 0.000112651 -3.53727 63.546000 Cu 0.0553415 0.690966 0.5 267 63.546 0.000103306 -3.53745 63.546000 Cu 0.110278 0.696084 4.26939e-16 268 63.546 0.000128551 -3.53693 63.546000 Cu 0.226065 0.660553 2.47188e-16 199 63.546 0.000330737 -3.53299 63.546000 Cu 0.301244 0.652067 1 202 63.546 0.000785084 -3.532 63.546000 Cu 0.335948 0.670719 8.39959e-19 203 63.546 0.000324295 -3.53229 63.546000 Cu 0.356073 0.657089 0.5 204 63.546 0.000325139 -3.53231 63.546000 Cu 0.281052 0.665659 0.5 205 63.546 0.000505887 -3.53257 63.546000 Cu 0.390787 0.675757 0.5 209 63.546 0.000130562 -3.53328 63.546000 Cu 0.205757 0.674087 0.5 235 63.546 5.88011e-05 -3.53503 63.546000 Cu 0.26076 0.679225 7.69163e-17 237 63.546 0.000196128 -3.53428 63.546000 Cu 0.295438 0.697903 3.72462e-16 238 63.546 0.000131807 -3.53437 63.546000 Cu 0.315689 0.684317 0.5 239 63.546 0.000175585 -3.5338 63.546000 Cu 0.240467 0.692785 0.5 240 63.546 4.50334e-05 -3.53518 63.546000 Cu 0.37056 0.689383 5.78972e-16 241 63.546 7.84858e-05 -3.53353 63.546000 Cu 0.485702 0.653491 3.04905e-16 172 63.546 0.000430955 -3.53714 63.546000 Cu 0.59566 0.663756 3.62502e-16 176 63.546 0.000331204 -3.53722 63.546000 Cu 0.540647 0.658602 0.5 178 63.546 0.000545464 -3.53715 63.546000 Cu 0.410871 0.66211 4.28139e-16 206 63.546 0.000103953 -3.53403 63.546000 Cu 0.445616 0.680808 1.30554e-16 207 63.546 8.14463e-05 -3.53431 63.546000 Cu 0.465703 0.667152 0.5 208 63.546 0.0001257 -3.53542 63.546000 Cu 0.52056 0.672232 1.43393e-16 210 63.546 0.000240811 -3.53639 63.546000 Cu 0.555342 0.690966 2.43348e-16 211 63.546 0.000103306 -3.53745 63.546000 Cu 0.575509 0.677347 0.5 212 63.546 0.000260709 -3.53749 63.546000 Cu 0.500453 0.685874 0.5 213 63.546 5.42213e-05 -3.53587 63.546000 Cu 0.425411 0.694434 0.5 243 63.546 2.34359e-05 -3.53417 63.546000 Cu 0.480282 0.699505 2.52348e-16 245 63.546 2.36101e-05 -3.53546 63.546000 Cu 0.615846 0.650206 0.5 177 63.546 0.000339493 -3.536 63.546000 Cu 0.670978 0.655397 2.19589e-16 179 63.546 9.32698e-05 -3.53423 63.546000 Cu 0.705757 0.674087 3.17385e-16 180 63.546 5.88011e-05 -3.53503 63.546000 Cu 0.726065 0.660553 0.5 181 63.546 0.000330737 -3.53299 63.546000 Cu 0.650729 0.668925 0.5 182 63.546 0.000117656 -3.53631 63.546000 Cu 0.781052 0.665659 4.069e-16 183 63.546 0.000505887 -3.53257 63.546000 Cu 0.76076 0.679225 0.5 186 63.546 0.000196128 -3.53428 63.546000 Cu 0.630495 0.682492 1.14234e-16 214 63.546 0.000112651 -3.53727 63.546000 Cu 0.685499 0.687647 0.5 216 63.546 2.47303e-05 -3.53602 63.546000 Cu 0.610278 0.696084 0.5 217 63.546 0.000128551 -3.53693 63.546000 Cu 0.740467 0.692785 2.27389e-16 218 63.546 4.50334e-05 -3.53518 63.546000 Cu 0.795438 0.697903 0.5 220 63.546 0.000131807 -3.53437 63.546000 Cu 0.856073 0.657089 4.1698e-16 149 63.546 0.000325139 -3.53231 63.546000 Cu 0.801244 0.652067 0.5 151 63.546 0.000785084 -3.532 63.546000 Cu 0.965703 0.667152 4.85977e-16 153 63.546 0.0001257 -3.53542 63.546000 Cu 0.985702 0.653491 0.5 154 63.546 0.000430955 -3.53714 63.546000 Cu 0.910871 0.66211 0.5 155 63.546 0.000103953 -3.53403 63.546000 Cu 0.815689 0.684317 2.34709e-16 184 63.546 0.000175585 -3.5338 63.546000 Cu 0.835948 0.670719 0.5 185 63.546 0.000324295 -3.53229 63.546000 Cu 0.890787 0.675757 9.64753e-17 187 63.546 0.000130562 -3.53328 63.546000 Cu 0.925411 0.694434 8.39959e-19 188 63.546 2.34359e-05 -3.53417 63.546000 Cu 0.945616 0.680808 0.5 189 63.546 8.14463e-05 -3.53431 63.546000 Cu 0.87056 0.689383 0.5 190 63.546 7.84858e-05 -3.53353 63.546000 Cu 0.980282 0.699505 0.5 192 63.546 2.36101e-05 -3.53546 63.546000 Cu 0.0150125 0.718198 0.5 228 63.546 7.50699e-05 -3.5347 63.546000 Cu 0.0351785 0.704595 2.36989e-16 266 63.546 4.47699e-05 -3.53652 63.546000 Cu 0.145064 0.7148 3.68382e-16 269 63.546 8.47774e-05 -3.53525 63.546000 Cu 0.165251 0.701219 0.5 270 63.546 4.86477e-05 -3.53571 63.546000 Cu 0.0901178 0.709691 0.5 271 63.546 3.87895e-05 -3.5358 63.546000 Cu 0.0699977 0.723292 2.78387e-16 303 63.546 1.5805e-05 -3.53447 63.546000 Cu 0.10487 0.741978 4.79977e-19 304 63.546 3.7799e-05 -3.5339 63.546000 Cu 0.124944 0.728392 0.5 305 63.546 4.1884e-05 -3.53479 63.546000 Cu 0.0498902 0.736882 0.5 306 63.546 4.10448e-05 -3.53379 63.546000 Cu 0.179945 0.733504 1.58752e-16 307 63.546 3.06676e-05 -3.53585 63.546000 Cu 0.159897 0.747088 0.5 310 63.546 3.71462e-06 -3.53541 63.546000 Cu 0.350354 0.702985 0.5 244 63.546 8.39115e-05 -3.53339 63.546000 Cu 0.220241 0.706355 1.37273e-16 272 63.546 1.87114e-05 -3.53549 63.546000 Cu 0.255049 0.725052 5.21015e-16 273 63.546 6.08168e-05 -3.53495 63.546000 Cu 0.275226 0.711476 0.5 274 63.546 5.57649e-05 -3.53504 63.546000 Cu 0.200061 0.719925 0.5 275 63.546 2.77665e-05 -3.53546 63.546000 Cu 0.330164 0.716576 9.39555e-17 276 63.546 7.5741e-05 -3.53364 63.546000 Cu 0.364994 0.735235 2.99985e-16 277 63.546 1.16266e-05 -3.53207 63.546000 Cu 0.385093 0.721654 0.5 278 63.546 5.23177e-05 -3.53276 63.546000 Cu 0.310049 0.730158 0.5 279 63.546 7.67762e-05 -3.53325 63.546000 Cu 0.234964 0.73862 0.5 309 63.546 1.51316e-05 -3.53506 63.546000 Cu 0.28999 0.743732 2.41668e-16 311 63.546 5.11072e-05 -3.53343 63.546000 Cu 0.344939 0.748819 0.5 313 63.546 2.0706e-05 -3.53256 63.546000 Cu 0.405221 0.708053 3.12945e-16 242 63.546 4.29873e-05 -3.53387 63.546000 Cu 0.515013 0.718198 2.27149e-16 246 63.546 7.50699e-05 -3.5347 63.546000 Cu 0.535178 0.704595 0.5 247 63.546 4.47699e-05 -3.53652 63.546000 Cu 0.460099 0.713121 0.5 248 63.546 6.34999e-05 -3.53407 63.546000 Cu 0.590118 0.709691 3.05385e-16 249 63.546 3.87895e-05 -3.5358 63.546000 Cu 0.569998 0.723292 0.5 252 63.546 1.5805e-05 -3.53447 63.546000 Cu 0.440016 0.726721 2.0135e-16 280 63.546 1.82822e-05 -3.53315 63.546000 Cu 0.474908 0.745392 1 281 63.546 1.80821e-05 -3.53343 63.546000 Cu 0.494949 0.731797 0.5 282 63.546 1.27859e-05 -3.53409 63.546000 Cu 0.419957 0.74031 0.5 283 63.546 5.25718e-06 -3.53302 63.546000 Cu 0.54989 0.736882 2.0015e-16 284 63.546 4.10448e-05 -3.53379 63.546000 Cu 0.665251 0.701219 1.07995e-18 215 63.546 4.86477e-05 -3.53571 63.546000 Cu 0.775226 0.711476 2.93146e-16 219 63.546 5.57649e-05 -3.53504 63.546000 Cu 0.720241 0.706355 0.5 221 63.546 1.87114e-05 -3.53549 63.546000 Cu 0.624944 0.728392 3.87941e-16 250 63.546 4.1884e-05 -3.53479 63.546000 Cu 0.645064 0.7148 0.5 251 63.546 8.47774e-05 -3.53525 63.546000 Cu 0.700061 0.719925 1.26354e-16 253 63.546 2.77665e-05 -3.53546 63.546000 Cu 0.734964 0.73862 2.40108e-16 254 63.546 1.51316e-05 -3.53506 63.546000 Cu 0.755049 0.725052 0.5 255 63.546 6.08168e-05 -3.53495 63.546000 Cu 0.679945 0.733504 0.5 256 63.546 3.06676e-05 -3.53585 63.546000 Cu 0.78999 0.743732 0.5 260 63.546 5.11072e-05 -3.53343 63.546000 Cu 0.60487 0.741978 0.5 286 63.546 3.7799e-05 -3.5339 63.546000 Cu 0.659897 0.747088 4.36059e-16 288 63.546 3.71462e-06 -3.53541 63.546000 Cu 0.850354 0.702985 1.14834e-16 222 63.546 8.39115e-05 -3.53339 63.546000 Cu 0.885093 0.721654 2.45028e-16 223 63.546 5.23177e-05 -3.53276 63.546000 Cu 0.905221 0.708053 0.5 224 63.546 4.29873e-05 -3.53387 63.546000 Cu 0.830164 0.716576 0.5 225 63.546 7.5741e-05 -3.53364 63.546000 Cu 0.960099 0.713121 2.90146e-16 226 63.546 6.34999e-05 -3.53407 63.546000 Cu 0.994949 0.731797 3.52543e-16 227 63.546 1.27859e-05 -3.53409 63.546000 Cu 0.940016 0.726721 0.5 229 63.546 1.82822e-05 -3.53315 63.546000 Cu 0.810049 0.730158 1 257 63.546 7.67762e-05 -3.53325 63.546000 Cu 0.844939 0.748819 5.21735e-16 258 63.546 2.0706e-05 -3.53256 63.546000 Cu 0.864994 0.735235 0.5 259 63.546 1.16266e-05 -3.53207 63.546000 Cu 0.919957 0.74031 3.23624e-16 261 63.546 5.25718e-06 -3.53302 63.546000 Cu 0.974908 0.745392 0.5 263 63.546 1.80821e-05 -3.53343 63.546000 Cu 0.0298728 0.750475 7.25965e-17 339 63.546 1.10177e-05 -3.53364 63.546000 Cu 0.00980743 0.764058 0.5 265 63.546 0.000117527 -3.53379 63.546000 Cu 0.0241207 0.79632 1 301 63.546 0.00019478 -3.53427 63.546000 Cu 0.0647704 0.769153 2.0423e-16 340 63.546 0.00021218 -3.53465 63.546000 Cu 0.0848474 0.755561 0.5 341 63.546 4.62411e-05 -3.53387 63.546000 Cu 0.139842 0.760666 1.62472e-16 342 63.546 9.42852e-05 -3.53495 63.546000 Cu 0.174597 0.779369 2.31469e-16 343 63.546 1.17784e-05 -3.53633 63.546000 Cu 0.194835 0.765785 0.5 344 63.546 0.000102623 -3.53524 63.546000 Cu 0.119671 0.774253 0.5 345 63.546 6.65168e-05 -3.53615 63.546000 Cu 0.0444657 0.782732 0.5 376 63.546 3.075e-05 -3.53501 63.546000 Cu 0.0993707 0.787845 2.40828e-16 377 63.546 4.4761e-05 -3.53565 63.546000 Cu 0.154346 0.792955 0.5 379 63.546 2.87377e-05 -3.53564 63.546000 Cu 0.214934 0.752204 1.29234e-16 308 63.546 4.94778e-05 -3.53512 63.546000 Cu 0.324847 0.762409 2.66267e-16 312 63.546 4.46031e-05 -3.534 63.546000 Cu 0.269891 0.757311 0.5 314 63.546 3.22196e-05 -3.53456 63.546000 Cu 0.399873 0.753893 6.63568e-17 315 63.546 1.31591e-05 -3.53339 63.546000 Cu 0.379759 0.767487 0.5 318 63.546 1.93072e-05 -3.53456 63.546000 Cu 0.249769 0.770907 1.91391e-16 346 63.546 6.73004e-05 -3.53544 63.546000 Cu 0.284525 0.78961 4.1806e-16 347 63.546 0.000164172 -3.53613 63.546000 Cu 0.304691 0.776007 0.5 348 63.546 4.35079e-05 -3.5355 63.546000 Cu 0.229552 0.784491 0.5 349 63.546 1.75614e-05 -3.53563 63.546000 Cu 0.3596 0.781088 1.13275e-16 350 63.546 3.92771e-05 -3.53533 63.546000 Cu 0.394224 0.799788 9.59954e-19 351 63.546 2.48757e-05 -3.53515 63.546000 Cu 0.339422 0.79471 0.5 353 63.546 0.000129149 -3.53576 63.546000 Cu 0.209299 0.798067 1.45913e-16 381 63.546 3.35795e-05 -3.53578 63.546000 Cu 0.529873 0.750475 0.5 287 63.546 1.10177e-05 -3.53364 63.546000 Cu 0.584847 0.755561 1 285 63.546 4.62411e-05 -3.53387 63.546000 Cu 0.434706 0.77256 3.18945e-16 316 63.546 0.000112063 -3.53447 63.546000 Cu 0.454829 0.75897 0.5 317 63.546 4.01212e-05 -3.53349 63.546000 Cu 0.509807 0.764058 1.31994e-18 319 63.546 0.000117527 -3.53379 63.546000 Cu 0.544466 0.782732 2.21029e-16 320 63.546 3.075e-05 -3.53501 63.546000 Cu 0.56477 0.769153 0.5 321 63.546 0.00021218 -3.53465 63.546000 Cu 0.489573 0.777637 0.5 322 63.546 0.000117025 -3.53401 63.546000 Cu 0.599371 0.787845 0.5 326 63.546 4.4761e-05 -3.53565 63.546000 Cu 0.414484 0.786167 0.5 352 63.546 5.2209e-05 -3.53466 63.546000 Cu 0.469284 0.79124 1.19994e-18 354 63.546 6.34764e-05 -3.53393 63.546000 Cu 0.524121 0.79632 0.5 356 63.546 0.00019478 -3.53427 63.546000 Cu 0.694835 0.765785 9.69553e-17 289 63.546 0.000102623 -3.53524 63.546000 Cu 0.714934 0.752204 0.5 290 63.546 4.94778e-05 -3.53512 63.546000 Cu 0.639842 0.760666 0.5 291 63.546 9.42852e-05 -3.53495 63.546000 Cu 0.769891 0.757311 2.22589e-16 292 63.546 3.22196e-05 -3.53456 63.546000 Cu 0.749769 0.770907 0.5 295 63.546 6.73004e-05 -3.53544 63.546000 Cu 0.619671 0.774253 5.99971e-19 323 63.546 6.65168e-05 -3.53615 63.546000 Cu 0.654346 0.792955 1.9991e-16 324 63.546 2.87377e-05 -3.53564 63.546000 Cu 0.674597 0.779369 0.5 325 63.546 1.17784e-05 -3.53633 63.546000 Cu 0.729552 0.784491 3.23624e-16 327 63.546 1.75614e-05 -3.53563 63.546000 Cu 0.784525 0.78961 0.5 329 63.546 0.000164172 -3.53613 63.546000 Cu 0.709299 0.798067 0.5 330 63.546 3.35795e-05 -3.53578 63.546000 Cu 0.954829 0.75897 5.43814e-16 262 63.546 4.01212e-05 -3.53349 63.546000 Cu 0.899873 0.753893 0.5 264 63.546 1.31591e-05 -3.53339 63.546000 Cu 0.804691 0.776007 1.77711e-16 293 63.546 4.35079e-05 -3.5355 63.546000 Cu 0.824847 0.762409 0.5 294 63.546 4.46031e-05 -3.534 63.546000 Cu 0.879759 0.767487 1.9979e-16 296 63.546 1.93072e-05 -3.53456 63.546000 Cu 0.914484 0.786167 1.71712e-16 297 63.546 5.2209e-05 -3.53466 63.546000 Cu 0.934706 0.77256 0.5 298 63.546 0.000112063 -3.53447 63.546000 Cu 0.8596 0.781088 0.5 299 63.546 3.92771e-05 -3.53533 63.546000 Cu 0.989573 0.777637 4.37619e-16 300 63.546 0.000117025 -3.53401 63.546000 Cu 0.969284 0.79124 0.5 302 63.546 6.34764e-05 -3.53393 63.546000 Cu 0.839422 0.79471 1 331 63.546 0.000129149 -3.53576 63.546000 Cu 0.894224 0.799788 0.5 333 63.546 2.48757e-05 -3.53515 63.546000 Cu 0.00392395 0.809918 0.5 337 63.546 9.46937e-05 -3.53362 63.546000 Cu 0.0183273 0.842216 2.82226e-16 374 63.546 0.000140791 -3.53297 63.546000 Cu 0.134048 0.806518 3.55183e-16 378 63.546 2.88394e-05 -3.53426 63.546000 Cu 0.0790637 0.801408 0.5 380 63.546 0.000106875 -3.53408 63.546000 Cu 0.189005 0.811649 0.5 384 63.546 4.02033e-05 -3.5353 63.546000 Cu 0.0588313 0.814986 4.87776e-16 412 63.546 0.00019083 -3.53381 63.546000 Cu 0.0934137 0.833659 1.51193e-16 413 63.546 0.000232659 -3.53256 63.546000 Cu 0.113721 0.820081 0.5 414 63.546 0.000150157 -3.53347 63.546000 Cu 0.0385842 0.828592 0.5 415 63.546 0.00013468 -3.53321 63.546000 Cu 0.16865 0.825204 8.68758e-17 416 63.546 6.92623e-05 -3.53389 63.546000 Cu 0.148322 0.838753 0.5 419 63.546 0.0002467 -3.53287 63.546000 Cu 0.0731275 0.847254 0.5 450 63.546 0.000391733 -3.53241 63.546000 Cu 0.243924 0.816788 8.11161e-17 382 63.546 8.53798e-05 -3.53632 63.546000 Cu 0.264238 0.803201 0.5 383 63.546 4.29222e-05 -3.53652 63.546000 Cu 0.319131 0.808324 2.1275e-16 385 63.546 0.000139843 -3.53628 63.546000 Cu 0.353858 0.827032 4.73497e-16 386 63.546 0.000130433 -3.53557 63.546000 Cu 0.374038 0.81342 0.5 387 63.546 0.000120433 -3.53561 63.546000 Cu 0.298885 0.821923 0.5 388 63.546 0.000150584 -3.53646 63.546000 Cu 0.203338 0.84388 2.83546e-16 417 63.546 0.00010443 -3.53451 63.546000 Cu 0.223666 0.830353 0.5 418 63.546 9.13335e-05 -3.5351 63.546000 Cu 0.278702 0.835503 3.15705e-16 420 63.546 0.000253847 -3.53598 63.546000 Cu 0.333685 0.840637 0.5 422 63.546 0.000295486 -3.53625 63.546000 Cu 0.258414 0.849047 0.5 423 63.546 0.000115151 -3.53597 63.546000 Cu 0.388565 0.845749 4.37139e-16 424 63.546 0.000205537 -3.53604 63.546000 Cu 0.503924 0.809918 3.40784e-17 355 63.546 9.46937e-05 -3.53362 63.546000 Cu 0.449055 0.80486 0.5 357 63.546 5.95841e-05 -3.53399 63.546000 Cu 0.579064 0.801408 2.76107e-16 358 63.546 0.000106875 -3.53408 63.546000 Cu 0.558831 0.814986 0.5 361 63.546 0.00019083 -3.53381 63.546000 Cu 0.428923 0.818485 1.75792e-16 389 63.546 2.4423e-05 -3.5346 63.546000 Cu 0.463565 0.837179 2.19229e-16 390 63.546 3.52856e-05 -3.53433 63.546000 Cu 0.483774 0.823537 0.5 391 63.546 6.46769e-05 -3.53399 63.546000 Cu 0.408757 0.832116 0.5 392 63.546 9.96051e-05 -3.53498 63.546000 Cu 0.538584 0.828592 3.46543e-16 393 63.546 0.00013468 -3.53321 63.546000 Cu 0.573127 0.847254 1.05715e-16 394 63.546 0.000391733 -3.53241 63.546000 Cu 0.593414 0.833659 0.5 395 63.546 0.000232659 -3.53256 63.546000 Cu 0.518327 0.842216 0.5 396 63.546 0.000140791 -3.53297 63.546000 Cu 0.764238 0.803201 3.23504e-16 328 63.546 4.29222e-05 -3.53652 63.546000 Cu 0.613721 0.820081 2.84146e-16 359 63.546 0.000150157 -3.53347 63.546000 Cu 0.634048 0.806518 0.5 360 63.546 2.88394e-05 -3.53426 63.546000 Cu 0.689005 0.811649 1.87311e-16 362 63.546 4.02033e-05 -3.5353 63.546000 Cu 0.723666 0.830353 1.89351e-16 363 63.546 9.13335e-05 -3.5351 63.546000 Cu 0.743924 0.816788 0.5 364 63.546 8.53798e-05 -3.53632 63.546000 Cu 0.66865 0.825204 0.5 365 63.546 6.92623e-05 -3.53389 63.546000 Cu 0.798885 0.821923 1.69552e-16 366 63.546 0.000150584 -3.53646 63.546000 Cu 0.778702 0.835503 0.5 369 63.546 0.000253847 -3.53598 63.546000 Cu 0.648322 0.838753 4.68457e-16 397 63.546 0.0002467 -3.53287 63.546000 Cu 0.703338 0.84388 0.5 399 63.546 0.00010443 -3.53451 63.546000 Cu 0.758414 0.849047 2.0963e-16 401 63.546 0.000115151 -3.53597 63.546000 Cu 0.874038 0.81342 2.18269e-16 332 63.546 0.000120433 -3.53561 63.546000 Cu 0.819131 0.808324 0.5 334 63.546 0.000139843 -3.53628 63.546000 Cu 0.949055 0.80486 8.69958e-17 335 63.546 5.95841e-05 -3.53399 63.546000 Cu 0.983774 0.823537 3.60703e-16 336 63.546 6.46769e-05 -3.53399 63.546000 Cu 0.928923 0.818485 0.5 338 63.546 2.4423e-05 -3.5346 63.546000 Cu 0.833685 0.840637 8.59158e-17 367 63.546 0.000295486 -3.53625 63.546000 Cu 0.853858 0.827032 0.5 368 63.546 0.000130433 -3.53557 63.546000 Cu 0.908757 0.832116 3.86861e-16 370 63.546 9.96051e-05 -3.53498 63.546000 Cu 0.963565 0.837179 0.5 372 63.546 3.52856e-05 -3.53433 63.546000 Cu 0.888565 0.845749 0.5 373 63.546 0.000205537 -3.53604 63.546000 Cu 0.0129688 0.888266 3.71982e-17 410 63.546 0.00018506 -3.53521 63.546000 Cu 0.0529874 0.860884 4.45178e-17 449 63.546 0.000259947 -3.53364 63.546000 Cu 0.128026 0.852309 1.52873e-16 451 63.546 0.00053394 -3.53257 63.546000 Cu 0.162671 0.870964 9.03556e-17 452 63.546 0.00101434 -3.5327 63.546000 Cu 0.182991 0.85741 0.5 453 63.546 0.00046574 -3.53375 63.546000 Cu 0.107805 0.865908 0.5 454 63.546 0.000633541 -3.53358 63.546000 Cu 0.0329483 0.874561 0.5 485 63.546 4.61328e-05 -3.53501 63.546000 Cu 0.0877032 0.879564 3.24104e-16 486 63.546 0.000289328 -3.53441 63.546000 Cu 0.122433 0.898235 1.88031e-16 487 63.546 0.00036609 -3.53322 63.546000 Cu 0.142481 0.884571 0.5 488 63.546 0.000899665 -3.53277 63.546000 Cu 0.0677174 0.89326 0.5 489 63.546 4.81153e-05 -3.53439 63.546000 Cu 0.197353 0.889606 3.00825e-16 490 63.546 0.00172622 -3.53111 63.546000 Cu 0.313433 0.854224 9.19156e-17 421 63.546 0.00045738 -3.53721 63.546000 Cu 0.368404 0.859378 0.5 427 63.546 0.000649573 -3.53772 63.546000 Cu 0.238024 0.862567 4.44699e-16 455 63.546 0.000101076 -3.53489 63.546000 Cu 0.272751 0.881246 2.72987e-16 456 63.546 0.000210846 -3.53352 63.546000 Cu 0.293098 0.867762 0.5 457 63.546 0.000215618 -3.53593 63.546000 Cu 0.217627 0.876076 0.5 458 63.546 0.000831729 -3.5322 63.546000 Cu 0.348203 0.872962 1.81431e-16 459 63.546 0.000914593 -3.53739 63.546000 Cu 0.383118 0.891708 4.40979e-16 460 63.546 0.00183151 -3.5386 63.546000 Cu 0.327943 0.886471 0.5 462 63.546 0.000403909 -3.53635 63.546000 Cu 0.252358 0.894715 0.5 492 63.546 0.00147693 -3.53116 63.546000 Cu 0.307565 0.899915 4.237e-16 494 63.546 0.000436828 -3.53424 63.546000 Cu 0.403242 0.878126 0.5 461 63.546 0.0012109 -3.53748 63.546000 Cu 0.423301 0.864491 5.73452e-16 425 63.546 0.000502502 -3.53696 63.546000 Cu 0.443379 0.850831 0.5 426 63.546 0.000177508 -3.53549 63.546000 Cu 0.498182 0.855871 3.45943e-16 428 63.546 9.2511e-05 -3.53441 63.546000 Cu 0.532948 0.874561 1.39913e-16 429 63.546 4.61328e-05 -3.53501 63.546000 Cu 0.552987 0.860884 0.5 430 63.546 0.000259947 -3.53364 63.546000 Cu 0.47816 0.86955 0.5 431 63.546 0.000213847 -3.53589 63.546000 Cu 0.587703 0.879564 0.5 435 63.546 0.000289328 -3.53441 63.546000 Cu 0.458154 0.883229 7.19965e-19 463 63.546 0.000771689 -3.53619 63.546000 Cu 0.512969 0.888266 0.5 465 63.546 0.00018506 -3.53521 63.546000 Cu 0.438149 0.896884 0.5 466 63.546 0.00200672 -3.53819 63.546000 Cu 0.567717 0.89326 8.09961e-17 467 63.546 4.81153e-05 -3.53439 63.546000 Cu 0.682991 0.85741 1.69552e-16 398 63.546 0.00046574 -3.53375 63.546000 Cu 0.628026 0.852309 0.5 400 63.546 0.00053394 -3.53257 63.546000 Cu 0.793098 0.867762 2.65427e-16 402 63.546 0.000215618 -3.53593 63.546000 Cu 0.738024 0.862567 0.5 404 63.546 0.000101076 -3.53489 63.546000 Cu 0.607805 0.865908 4.92816e-16 432 63.546 0.000633541 -3.53358 63.546000 Cu 0.642481 0.884571 2.48508e-16 433 63.546 0.000899665 -3.53277 63.546000 Cu 0.662671 0.870964 0.5 434 63.546 0.00101434 -3.5327 63.546000 Cu 0.717627 0.876076 1.61512e-16 436 63.546 0.000831729 -3.5322 63.546000 Cu 0.752358 0.894715 3.32504e-16 437 63.546 0.00147693 -3.53116 63.546000 Cu 0.772751 0.881246 0.5 438 63.546 0.000210846 -3.53352 63.546000 Cu 0.697353 0.889606 0.5 439 63.546 0.00172622 -3.53111 63.546000 Cu 0.622433 0.898235 0.5 469 63.546 0.00036609 -3.53322 63.546000 Cu 0.943379 0.850831 2.36149e-16 371 63.546 0.000177508 -3.53549 63.546000 Cu 0.998182 0.855871 0.5 375 63.546 9.2511e-05 -3.53441 63.546000 Cu 0.813433 0.854224 0.5 403 63.546 0.00045738 -3.53721 63.546000 Cu 0.868404 0.859378 1.44473e-16 405 63.546 0.000649573 -3.53772 63.546000 Cu 0.903242 0.878126 1.96431e-16 406 63.546 0.0012109 -3.53748 63.546000 Cu 0.923301 0.864491 0.5 407 63.546 0.000502502 -3.53696 63.546000 Cu 0.848203 0.872962 0.5 408 63.546 0.000914593 -3.53739 63.546000 Cu 0.97816 0.86955 1.87431e-16 409 63.546 0.000213847 -3.53589 63.546000 Cu 0.958154 0.883229 0.5 411 63.546 0.000771689 -3.53619 63.546000 Cu 0.827943 0.886471 3.40544e-16 440 63.546 0.000403909 -3.53635 63.546000 Cu 0.883118 0.891708 0.5 442 63.546 0.00183151 -3.5386 63.546000 Cu 0.938149 0.896884 4.25379e-16 444 63.546 0.00200672 -3.53819 63.546000 Cu 0.807565 0.899915 0.5 443 63.546 0.000436828 -3.53424 63.546000 Cu 0.0279397 0.920714 0.5 448 63.546 0.000852695 -3.53527 63.546000 Cu 0.00820113 0.93447 3.02985e-16 483 63.546 0.00583035 -3.5395 63.546000 Cu 0.17718 0.903206 0.5 493 63.546 0.00148464 -3.53105 63.546000 Cu 0.0477858 0.906978 5.53173e-17 522 63.546 0.000136241 -3.53442 63.546000 Cu 0.0826684 0.925686 2.88706e-16 523 63.546 0.000137031 -3.5326 63.546000 Cu 0.1025 0.911944 0.5 524 63.546 0.000114834 -3.53318 63.546000 Cu 0.157159 0.916881 3.29504e-16 525 63.546 0.000615139 -3.53147 63.546000 Cu 0.191789 0.93552 4.24779e-16 526 63.546 0.00103331 -3.52972 63.546000 Cu 0.137272 0.930619 0.5 528 63.546 0.000234582 -3.5318 63.546000 Cu 0.0629136 0.939461 0.5 556 63.546 0.000815659 -3.52964 63.546000 Cu 0.117505 0.944414 2.48748e-16 557 63.546 0.000269336 -3.52738 63.546000 Cu 0.171934 0.949319 0.5 559 63.546 0.000442511 -3.52963 63.546000 Cu 0.232035 0.908217 4.0774e-16 491 63.546 0.00309341 -3.52876 63.546000 Cu 0.342378 0.91859 8.39959e-19 495 63.546 0.000822688 -3.5332 63.546000 Cu 0.362847 0.905203 0.5 496 63.546 0.00123816 -3.53845 63.546000 Cu 0.287068 0.913329 0.5 497 63.546 0.00304779 -3.52908 63.546000 Cu 0.397816 0.923959 0.5 501 63.546 0.00392955 -3.5401 63.546000 Cu 0.211806 0.921805 0.5 527 63.546 0.00305582 -3.52771 63.546000 Cu 0.266597 0.926791 3.05385e-16 529 63.546 0.00636577 -3.52567 63.546000 Cu 0.301168 0.945315 2.89426e-16 530 63.546 0.0122458 -3.52263 63.546000 Cu 0.321697 0.931904 0.5 531 63.546 0.00717937 -3.52488 63.546000 Cu 0.246288 0.940368 0.5 532 63.546 0.00712353 -3.52474 63.546000 Cu 0.3773 0.937245 4.48178e-16 533 63.546 0.00209346 -3.53102 63.546000 Cu 0.493007 0.901972 9.59954e-19 464 63.546 0.000891364 -3.53612 63.546000 Cu 0.547786 0.906978 0.5 470 63.546 0.000136241 -3.53442 63.546000 Cu 0.418049 0.910487 3.77022e-16 498 63.546 0.00410895 -3.5409 63.546000 Cu 0.453177 0.929292 3.61423e-16 499 63.546 0.00926395 -3.54388 63.546000 Cu 0.473091 0.915664 0.5 500 63.546 0.00341008 -3.53962 63.546000 Cu 0.52794 0.920714 4.0414e-16 502 63.546 0.000852695 -3.53527 63.546000 Cu 0.562914 0.939461 1.51433e-16 503 63.546 0.000815659 -3.52964 63.546000 Cu 0.582668 0.925686 0.5 504 63.546 0.000137031 -3.5326 63.546000 Cu 0.508201 0.93447 0.5 505 63.546 0.00583035 -3.5395 63.546000 Cu 0.433044 0.942747 0.5 535 63.546 0.0124356 -3.54317 63.546000 Cu 0.488497 0.948163 2.34109e-16 537 63.546 0.021258 -3.54482 63.546000 Cu 0.6025 0.911944 2.84746e-16 468 63.546 0.000114834 -3.53318 63.546000 Cu 0.67718 0.903206 5.89172e-16 471 63.546 0.00148464 -3.53105 63.546000 Cu 0.711806 0.921805 2.83666e-16 472 63.546 0.00305582 -3.52771 63.546000 Cu 0.732035 0.908217 0.5 473 63.546 0.00309341 -3.52876 63.546000 Cu 0.657159 0.916881 0.5 474 63.546 0.000615139 -3.53147 63.546000 Cu 0.787068 0.913329 6.84687e-16 475 63.546 0.00304779 -3.52908 63.546000 Cu 0.766597 0.926791 0.5 478 63.546 0.00636577 -3.52567 63.546000 Cu 0.637272 0.930619 2.36269e-16 506 63.546 0.000234582 -3.5318 63.546000 Cu 0.691789 0.93552 0.5 508 63.546 0.00103331 -3.52972 63.546000 Cu 0.617505 0.944414 0.5 509 63.546 0.000269336 -3.52738 63.546000 Cu 0.746288 0.940368 3.43783e-16 510 63.546 0.00712353 -3.52474 63.546000 Cu 0.671934 0.949319 4.43379e-16 507 63.546 0.000442511 -3.52963 63.546000 Cu 0.801168 0.945315 0.5 512 63.546 0.0122458 -3.52263 63.546000 Cu 0.862847 0.905203 1 441 63.546 0.00123816 -3.53845 63.546000 Cu 0.973091 0.915664 1.86231e-16 445 63.546 0.00341008 -3.53962 63.546000 Cu 0.993007 0.901972 0.5 446 63.546 0.000891364 -3.53612 63.546000 Cu 0.918049 0.910487 0.5 447 63.546 0.00410895 -3.5409 63.546000 Cu 0.821697 0.931904 4.26339e-16 476 63.546 0.00717937 -3.52488 63.546000 Cu 0.842378 0.91859 0.5 477 63.546 0.000822688 -3.5332 63.546000 Cu 0.897816 0.923959 2.30869e-16 479 63.546 0.00392955 -3.5401 63.546000 Cu 0.933044 0.942747 1.75312e-16 480 63.546 0.0124356 -3.54317 63.546000 Cu 0.953177 0.929292 0.5 481 63.546 0.00926395 -3.54388 63.546000 Cu 0.8773 0.937245 0.5 482 63.546 0.00209346 -3.53102 63.546000 Cu 0.988497 0.948163 0.5 484 63.546 0.021258 -3.54482 63.546000 Cu 0.0238325 0.967194 0.5 520 63.546 0.0550833 -3.5261 63.546000 Cu 0.0433575 0.953339 3.08985e-16 555 63.546 0.00988639 -3.52914 63.546000 Cu 0.152161 0.963211 2.89666e-16 558 63.546 0.00489989 -3.52401 63.546000 Cu 0.0976805 0.958224 0.5 560 63.546 0.00513324 -3.50875 63.546000 Cu 0.0779831 0.972383 4.78057e-16 576 63.546 0.0186582 -3.49162 63.546000 Cu 0.113112 0.991571 5.42734e-16 577 63.546 1.66777 -3.43962 63.546000 Cu 0.131555 0.976956 0.5 578 63.546 0.083569 -3.47499 63.546000 Cu 0.0572322 0.986639 0.5 579 63.546 0.496725 -3.44983 63.546000 Cu 0.188065 0.981983 3.69342e-16 580 63.546 0.240166 -3.42973 63.546000 Cu 0.168518 0.994843 0.5 582 63.546 9.1954 -3.11409 63.546000 Cu 0.00402027 0.981086 3.65982e-16 519 63.546 0.453288 -3.48428 63.546000 Cu 0.356375 0.950392 0.5 536 63.546 0.0208375 -3.51385 63.546000 Cu 0.226368 0.954162 2.45868e-16 561 63.546 0.00213754 -3.52996 63.546000 Cu 0.261476 0.972789 2.52468e-16 562 63.546 0.0124104 -3.49498 63.546000 Cu 0.280832 0.958845 0.5 563 63.546 0.0195029 -3.51184 63.546000 Cu 0.206602 0.968002 0.5 564 63.546 0.00513215 -3.52197 63.546000 Cu 0.335946 0.963787 6.1557e-16 565 63.546 0.0234818 -3.5113 63.546000 Cu 0.371299 0.982296 2.0111e-16 566 63.546 0.290913 -3.42892 63.546000 Cu 0.39094 0.968747 0.5 567 63.546 0.0862344 -3.47296 63.546000 Cu 0.315079 0.977203 0.5 568 63.546 0.110763 -3.46264 63.546000 Cu 0.241413 0.986726 0.5 581 63.546 0.390899 -3.39389 63.546000 Cu 0.296361 0.991815 5.24975e-16 583 63.546 1.59776 -3.46764 63.546000 Cu 0.350645 0.994883 0.5 584 63.546 9.32228 -3.10207 63.546000 Cu 0.412501 0.955885 1.9835e-16 534 63.546 0.00764208 -3.52123 63.546000 Cu 0.523832 0.967194 2.29789e-16 538 63.546 0.0550833 -3.5261 63.546000 Cu 0.543357 0.953339 0.5 539 63.546 0.00988639 -3.52914 63.546000 Cu 0.468579 0.961659 0.5 540 63.546 0.0494584 -3.54059 63.546000 Cu 0.597681 0.958224 3.01545e-16 541 63.546 0.00513324 -3.50875 63.546000 Cu 0.577983 0.972383 0.5 544 63.546 0.0186582 -3.49162 63.546000 Cu 0.448013 0.974572 5.13335e-16 569 63.546 0.049757 -3.46331 63.546000 Cu 0.482655 0.99358 3.46423e-16 570 63.546 1.86103 -3.32894 63.546000 Cu 0.50402 0.981086 0.5 571 63.546 0.453288 -3.48428 63.546000 Cu 0.424268 0.986946 0.5 572 63.546 0.884376 -3.28562 63.546000 Cu 0.557232 0.986639 7.09166e-16 573 63.546 0.496725 -3.44983 63.546000 Cu 0.780832 0.958845 2.81746e-16 511 63.546 0.0195029 -3.51184 63.546000 Cu 0.726368 0.954162 0.5 513 63.546 0.00213754 -3.52996 63.546000 Cu 0.631555 0.976956 3.21224e-16 542 63.546 0.083569 -3.47499 63.546000 Cu 0.652161 0.963211 0.5 543 63.546 0.00489989 -3.52401 63.546000 Cu 0.706602 0.968002 9.73153e-17 545 63.546 0.00513215 -3.52197 63.546000 Cu 0.741413 0.986726 3.49543e-16 546 63.546 0.390899 -3.39389 63.546000 Cu 0.761476 0.972789 0.5 547 63.546 0.0124104 -3.49498 63.546000 Cu 0.688065 0.981983 0.5 548 63.546 0.240166 -3.42973 63.546000 Cu 0.796361 0.991815 0.5 552 63.546 1.59776 -3.46764 63.546000 Cu 0.613112 0.991571 0.5 574 63.546 1.66777 -3.43962 63.546000 Cu 0.668518 0.994843 3.28664e-16 575 63.546 9.1954 -3.11409 63.546000 Cu 0.856375 0.950392 1.50353e-16 514 63.546 0.0208375 -3.51385 63.546000 Cu 0.89094 0.968747 5.71052e-16 515 63.546 0.0862344 -3.47296 63.546000 Cu 0.912501 0.955885 0.5 516 63.546 0.00764208 -3.52123 63.546000 Cu 0.835946 0.963787 0.5 517 63.546 0.0234818 -3.5113 63.546000 Cu 0.968579 0.961659 3.01665e-16 518 63.546 0.0494584 -3.54059 63.546000 Cu 0.948013 0.974572 0.5 521 63.546 0.049757 -3.46331 63.546000 Cu 0.815079 0.977203 2.89306e-16 549 63.546 0.110763 -3.46264 63.546000 Cu 0.850645 0.994883 5.63973e-16 550 63.546 9.32228 -3.10207 63.546000 Cu 0.871299 0.982296 0.5 551 63.546 0.290913 -3.42892 63.546000 Cu 0.924268 0.986946 3.80742e-16 553 63.546 0.884376 -3.28562 63.546000 Cu 0.982655 0.99358 0.5 554 63.546 1.86103 -3.32894