Number of particles = 972 A = 1 Angstrom (basic length-scale) H0(1,1) = 28.2466 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 112.942 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61388 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 0.0384635 0.00544411 1 501 63.546 0.0172232 -3.53334 63.546000 Cu 0.0298797 0.0283026 1 514 63.546 0.00413735 -3.5366 63.546000 Cu 0.119701 0.0293414 1 515 63.546 0.0319634 -3.53699 63.546000 Cu 0.0793831 0.0171881 0.5 516 63.546 0.0161969 -3.53181 63.546000 Cu 0.128662 0.00591662 1 518 63.546 0.0749374 -3.52534 63.546000 Cu 0.168424 0.018563 0.5 520 63.546 0.0798927 -3.52953 63.546000 Cu 0.217076 0.00823882 6.45593e-16 519 63.546 0.224393 -3.51984 63.546000 Cu 0.208633 0.0317706 1 540 63.546 0.0412116 -3.53609 63.546000 Cu 0.298109 0.0357833 2.41839e-16 541 63.546 0.0930785 -3.5172 63.546000 Cu 0.256676 0.0220573 0.5 542 63.546 0.0956113 -3.5299 63.546000 Cu 0.305902 0.0138612 8.96432e-17 544 63.546 0.5497 -3.47174 63.546000 Cu 0.398134 0.0158971 2.21168e-16 545 63.546 0.0353155 -3.53141 63.546000 Cu 0.356579 0.00444797 0.5 546 63.546 0.498369 -3.49289 63.546000 Cu 0.347817 0.0261807 0.5 547 63.546 0.12231 -3.51929 63.546000 Cu 0.447783 0.00506198 0.5 548 63.546 0.0204875 -3.53658 63.546000 Cu 0.389315 0.0380204 4.63936e-16 574 63.546 0.0199173 -3.5325 63.546000 Cu 0.439234 0.0274677 0.5 576 63.546 0.0073242 -3.53588 63.546000 Cu 0.489072 0.0165566 6.39623e-17 578 63.546 0.00566948 -3.53658 63.546000 Cu 0.579375 0.0171539 8.27429e-17 579 63.546 0.0162364 -3.53183 63.546000 Cu 0.538476 0.00539626 0.5 580 63.546 0.0176453 -3.53349 63.546000 Cu 0.529894 0.0282594 0.5 581 63.546 0.00428972 -3.53651 63.546000 Cu 0.628649 0.00588214 0.5 582 63.546 0.0750871 -3.52578 63.546000 Cu 0.619688 0.0293153 0.5 618 63.546 0.0316289 -3.53663 63.546000 Cu 0.668414 0.0185487 1.79556e-16 620 63.546 0.0785737 -3.52956 63.546000 Cu 0.805929 0.013878 0.5 492 63.546 0.554361 -3.47091 63.546000 Cu 0.798117 0.0357894 0.5 494 63.546 0.093032 -3.51715 63.546000 Cu 0.756668 0.022046 3.00011e-20 621 63.546 0.0983136 -3.52969 63.546000 Cu 0.717086 0.00822767 0.5 622 63.546 0.224156 -3.51993 63.546000 Cu 0.708619 0.031757 0.5 623 63.546 0.0413654 -3.53586 63.546000 Cu 0.856619 0.00447594 1 491 63.546 0.502533 -3.49322 63.546000 Cu 0.847826 0.0262069 1.56606e-17 496 63.546 0.12423 -3.5193 63.546000 Cu 0.939236 0.0275129 1 497 63.546 0.00778313 -3.53582 63.546000 Cu 0.898181 0.0159314 0.5 498 63.546 0.0359478 -3.53162 63.546000 Cu 0.88934 0.0380509 0.5 499 63.546 0.020145 -3.53238 63.546000 Cu 0.947821 0.00510302 1 500 63.546 0.0212708 -3.53675 63.546000 Cu 0.989081 0.016603 0.5 502 63.546 0.00565123 -3.53651 63.546000 Cu 0.0209844 0.0510329 0 511 63.546 0.00232969 -3.53822 63.546000 Cu 0.0704618 0.0402185 0.5 517 63.546 0.00877161 -3.53753 63.546000 Cu 0.102194 0.0752699 2.30228e-16 533 63.546 0.00756767 -3.5412 63.546000 Cu 0.0616181 0.0630525 0.5 534 63.546 0.0048064 -3.53982 63.546000 Cu 0.110891 0.0524038 2.45469e-16 536 63.546 0.01634 -3.54049 63.546000 Cu 0.15991 0.0419048 0.5 538 63.546 0.0327412 -3.53962 63.546000 Cu 0.151281 0.0648942 0.5 539 63.546 0.0130455 -3.54196 63.546000 Cu 0.0121953 0.0736722 0 532 63.546 0.00124044 -3.53961 63.546000 Cu 0.20025 0.0547665 4.93517e-17 537 63.546 0.0131529 -3.54113 63.546000 Cu 0.249019 0.0449973 0.5 543 63.546 0.0132539 -3.5388 63.546000 Cu 0.240793 0.067634 0.5 568 63.546 0.00365856 -3.53908 63.546000 Cu 0.289983 0.057969 1.38755e-16 570 63.546 0.0219272 -3.52988 63.546000 Cu 0.331069 0.0703511 0.5 573 63.546 0.0125733 -3.53316 63.546000 Cu 0.339497 0.0481809 0.5 572 63.546 0.0377023 -3.52705 63.546000 Cu 0.380711 0.0602229 1.58796e-16 571 63.546 0.0101467 -3.53476 63.546000 Cu 0.480201 0.0391542 6.72024e-17 575 63.546 0.00255082 -3.53754 63.546000 Cu 0.430441 0.049826 0.5 577 63.546 0.00496434 -3.53647 63.546000 Cu 0.421738 0.0721906 0.5 610 63.546 0.00280807 -3.53794 63.546000 Cu 0.471372 0.0616847 1 612 63.546 0.00145178 -3.53839 63.546000 Cu 0.512191 0.0736545 0.5 615 63.546 0.00114101 -3.53968 63.546000 Cu 0.561609 0.0630263 2.61609e-17 613 63.546 0.00463403 -3.53972 63.546000 Cu 0.520975 0.0510058 0.5 614 63.546 0.00226009 -3.53855 63.546000 Cu 0.570456 0.0401815 1.20004e-19 616 63.546 0.00883109 -3.53784 63.546000 Cu 0.659912 0.0418794 1 617 63.546 0.033192 -3.5394 63.546000 Cu 0.61089 0.0523825 0.5 619 63.546 0.0157582 -3.5405 63.546000 Cu 0.602173 0.0752475 0.5 658 63.546 0.00745893 -3.54113 63.546000 Cu 0.651266 0.0648616 5.7002e-19 660 63.546 0.0139333 -3.54172 63.546000 Cu 0.789969 0.0579773 0.5 495 63.546 0.0228382 -3.52959 63.546000 Cu 0.831058 0.0703628 1.22764e-16 506 63.546 0.0129195 -3.53294 63.546000 Cu 0.740797 0.0676182 4.06634e-16 661 63.546 0.00354037 -3.53893 63.546000 Cu 0.700257 0.0547451 0.5 662 63.546 0.0137764 -3.54074 63.546000 Cu 0.749025 0.0449864 1 664 63.546 0.0132411 -3.53877 63.546000 Cu 0.839498 0.048202 1.54925e-16 493 63.546 0.0386896 -3.52712 63.546000 Cu 0.921728 0.0722142 7.14025e-17 507 63.546 0.00296868 -3.53752 63.546000 Cu 0.880696 0.0602482 0.5 508 63.546 0.0103932 -3.53464 63.546000 Cu 0.930425 0.0498604 1 510 63.546 0.00512533 -3.53646 63.546000 Cu 0.980211 0.0391997 0.5 512 63.546 0.00266272 -3.53725 63.546000 Cu 0.971373 0.0617179 0.5 513 63.546 0.00158812 -3.53832 63.546000 Cu 0.052915 0.085768 0.5 535 63.546 0.00231563 -3.5409 63.546000 Cu 0.0443074 0.108408 0.5 560 63.546 0.00109422 -3.54069 63.546000 Cu 0.0935922 0.0980081 1.22914e-16 562 63.546 0.00318367 -3.54151 63.546000 Cu 0.142747 0.0876852 0.5 564 63.546 0.0052699 -3.54138 63.546000 Cu 0.134246 0.110375 0.5 565 63.546 0.00206866 -3.54147 63.546000 Cu 0.00352457 0.0962589 9.00032e-20 529 63.546 0.000545161 -3.54011 63.546000 Cu 0.183375 0.100195 2.67429e-16 563 63.546 0.00169283 -3.54084 63.546000 Cu 0.19178 0.0775405 1.56606e-17 566 63.546 0.00451819 -3.54068 63.546000 Cu 0.281676 0.080274 1.89727e-16 567 63.546 0.00564971 -3.5348 63.546000 Cu 0.232481 0.0901665 0.5 569 63.546 0.00113848 -3.5391 63.546000 Cu 0.224139 0.112693 0.5 602 63.546 0.00038301 -3.54002 63.546000 Cu 0.273359 0.102663 1 604 63.546 0.00173927 -3.53822 63.546000 Cu 0.322684 0.0926345 0.5 606 63.546 0.00435788 -3.53637 63.546000 Cu 0.314313 0.11501 0.5 607 63.546 0.0017393 -3.5383 63.546000 Cu 0.363702 0.104854 2.17868e-16 605 63.546 0.0021964 -3.53781 63.546000 Cu 0.372155 0.0825082 1.50005e-19 608 63.546 0.00509959 -3.53685 63.546000 Cu 0.462679 0.0841879 1 609 63.546 0.000830834 -3.53927 63.546000 Cu 0.413169 0.0945862 0.5 611 63.546 0.00155135 -3.53841 63.546000 Cu 0.454096 0.106676 2.9365e-16 652 63.546 0.000442893 -3.53917 63.546000 Cu 0.503522 0.0962485 0.5 654 63.546 0.000530416 -3.53984 63.546000 Cu 0.544298 0.108405 2.04427e-16 653 63.546 0.0010273 -3.54096 63.546000 Cu 0.552896 0.0857556 5.45719e-17 656 63.546 0.00216005 -3.54055 63.546000 Cu 0.642728 0.0876608 2.7106e-16 657 63.546 0.00589266 -3.54164 63.546000 Cu 0.593574 0.0979931 0.5 659 63.546 0.00323995 -3.5415 63.546000 Cu 0.634245 0.11036 2.45589e-16 700 63.546 0.00246505 -3.54156 63.546000 Cu 0.822657 0.0926456 1.56606e-17 503 63.546 0.00470087 -3.53633 63.546000 Cu 0.781659 0.0802779 0.5 504 63.546 0.00614138 -3.53492 63.546000 Cu 0.773328 0.102669 0.5 505 63.546 0.00193844 -3.5382 63.546000 Cu 0.814271 0.115019 1.36535e-16 524 63.546 0.00190041 -3.53829 63.546000 Cu 0.691777 0.0775133 0.5 663 63.546 0.00504587 -3.54115 63.546000 Cu 0.724089 0.112696 1 701 63.546 0.000491887 -3.53968 63.546000 Cu 0.68336 0.100181 0.5 702 63.546 0.0019154 -3.54081 63.546000 Cu 0.732464 0.0901645 1.50005e-19 704 63.546 0.00121676 -3.53947 63.546000 Cu 0.87213 0.0825214 0.5 509 63.546 0.00523029 -3.53662 63.546000 Cu 0.863675 0.104858 0.5 526 63.546 0.00219349 -3.53806 63.546000 Cu 0.913157 0.0945942 9.81035e-17 528 63.546 0.00152206 -3.53828 63.546000 Cu 0.962664 0.0841984 0.5 530 63.546 0.00082006 -3.53897 63.546000 Cu 0.954096 0.106674 0.5 531 63.546 0.000365905 -3.53946 63.546000 Cu 0.0850221 0.120665 3.81014e-17 559 63.546 0.00127149 -3.54097 63.546000 Cu 0.0356885 0.130996 0.5 561 63.546 0.00049677 -3.54005 63.546000 Cu 0.0270907 0.153549 0.5 594 63.546 0.000255098 -3.54048 63.546000 Cu 0.076429 0.143255 1.80006e-19 596 63.546 0.000562534 -3.54036 63.546000 Cu 0.166458 0.145364 1.80006e-19 597 63.546 0.000229239 -3.54038 63.546000 Cu 0.125706 0.132993 0.5 598 63.546 0.000870668 -3.54089 63.546000 Cu 0.174973 0.122801 1 600 63.546 0.000643121 -3.54087 63.546000 Cu 0.264984 0.125116 1 601 63.546 0.000758343 -3.53885 63.546000 Cu 0.21573 0.135217 0.5 603 63.546 0.000139943 -3.53969 63.546000 Cu 0.256529 0.147582 2.03557e-16 644 63.546 0.000235821 -3.53911 63.546000 Cu 0.30586 0.137436 0.5 646 63.546 0.000607443 -3.53855 63.546000 Cu 0.346729 0.149699 1.34165e-16 645 63.546 0.000350365 -3.53918 63.546000 Cu 0.355236 0.12725 3.24311e-16 648 63.546 0.000760973 -3.53869 63.546000 Cu 0.445536 0.129163 1.56606e-17 649 63.546 0.000183785 -3.53961 63.546000 Cu 0.404674 0.117007 0.5 650 63.546 0.000725824 -3.53873 63.546000 Cu 0.39611 0.139465 0.5 651 63.546 0.000385693 -3.53953 63.546000 Cu 0.494946 0.118811 0.5 655 63.546 0.000263394 -3.5401 63.546000 Cu 0.436947 0.151666 1.22704e-16 692 63.546 9.01763e-05 -3.5398 63.546000 Cu 0.486319 0.141357 0.5 694 63.546 7.19333e-05 -3.53995 63.546000 Cu 0.527092 0.153575 1.89457e-16 693 63.546 0.000219547 -3.54009 63.546000 Cu 0.53571 0.131009 1 696 63.546 0.000410739 -3.54036 63.546000 Cu 0.625691 0.132996 9.00032e-20 697 63.546 0.00093301 -3.54089 63.546000 Cu 0.585028 0.120666 0.5 698 63.546 0.00122075 -3.5412 63.546000 Cu 0.576433 0.143269 0.5 699 63.546 0.000613675 -3.54025 63.546000 Cu 0.666407 0.145375 0.5 742 63.546 0.000234898 -3.54048 63.546000 Cu 0.674951 0.122796 0.5 703 63.546 0.000801194 -3.54078 63.546000 Cu 0.805815 0.137435 1.22674e-16 522 63.546 0.000642242 -3.53845 63.546000 Cu 0.764941 0.125119 0.5 523 63.546 0.000815891 -3.5387 63.546000 Cu 0.715679 0.135219 1.86607e-17 744 63.546 0.000197005 -3.53975 63.546000 Cu 0.756466 0.147583 0.5 745 63.546 0.00028011 -3.53906 63.546000 Cu 0.904648 0.117013 2.45259e-16 525 63.546 0.000773471 -3.53905 63.546000 Cu 0.855199 0.127253 0.5 527 63.546 0.000829273 -3.53846 63.546000 Cu 0.846672 0.149691 0.5 552 63.546 0.000386762 -3.53901 63.546000 Cu 0.896073 0.139454 6.36023e-17 554 63.546 0.000359323 -3.53921 63.546000 Cu 0.986307 0.141335 9.00032e-20 555 63.546 8.49472e-05 -3.53983 63.546000 Cu 0.945509 0.129156 0.5 556 63.546 0.000163283 -3.5394 63.546000 Cu 0.936913 0.151646 0.5 557 63.546 9.54682e-05 -3.53981 63.546000 Cu 0.994947 0.11881 4.47916e-17 558 63.546 0.000263647 -3.53988 63.546000 Cu 0.0678689 0.165819 1 593 63.546 0.000314048 -3.54079 63.546000 Cu 0.0185953 0.176105 0.5 595 63.546 0.000145718 -3.5405 63.546000 Cu 0.117176 0.155561 0.5 599 63.546 0.000472627 -3.54046 63.546000 Cu 0.0595647 0.188372 3.95414e-17 636 63.546 0.000101015 -3.54047 63.546000 Cu 0.149725 0.190428 1.91857e-16 637 63.546 0.000149559 -3.54033 63.546000 Cu 0.108749 0.178112 0.5 638 63.546 0.00034102 -3.5406 63.546000 Cu 0.157988 0.167903 3.95714e-17 640 63.546 0.000184511 -3.54013 63.546000 Cu 0.248114 0.170073 2.49729e-16 641 63.546 0.000135916 -3.53945 63.546000 Cu 0.207242 0.157732 0.5 642 63.546 6.79783e-05 -3.53985 63.546000 Cu 0.198905 0.180243 0.5 643 63.546 4.34558e-05 -3.53975 63.546000 Cu 0.297386 0.159892 0.5 647 63.546 0.000191684 -3.5393 63.546000 Cu 0.289069 0.182384 0.5 686 63.546 9.34263e-05 -3.53958 63.546000 Cu 0.33828 0.172182 1.22524e-16 688 63.546 0.000235492 -3.53964 63.546000 Cu 0.42846 0.174188 2.66289e-16 689 63.546 0.000138019 -3.54021 63.546000 Cu 0.387563 0.161951 0.5 690 63.546 0.00033201 -3.53973 63.546000 Cu 0.379242 0.184457 0.5 691 63.546 0.000176483 -3.53999 63.546000 Cu 0.477763 0.16389 0.5 695 63.546 7.15839e-05 -3.54004 63.546000 Cu 0.469428 0.18643 0.5 734 63.546 1.45713e-05 -3.5401 63.546000 Cu 0.518633 0.176133 1.22614e-16 736 63.546 0.000137042 -3.54026 63.546000 Cu 0.608755 0.178153 1 737 63.546 0.000150713 -3.54056 63.546000 Cu 0.567867 0.165845 0.5 738 63.546 0.000350185 -3.54066 63.546000 Cu 0.559565 0.188405 0.5 739 63.546 0.000137856 -3.54014 63.546000 Cu 0.617147 0.155583 1.62006e-17 740 63.546 0.000405959 -3.5406 63.546000 Cu 0.657941 0.16793 0.5 743 63.546 0.000131779 -3.5406 63.546000 Cu 0.649669 0.190469 0.5 782 63.546 4.52648e-05 -3.54014 63.546000 Cu 0.788997 0.182367 1 549 63.546 5.60125e-05 -3.53942 63.546000 Cu 0.797307 0.159882 4.80017e-19 550 63.546 0.00023005 -3.53905 63.546000 Cu 0.707176 0.157736 9.00032e-20 741 63.546 0.000121317 -3.54007 63.546000 Cu 0.698864 0.180266 1 784 63.546 2.99519e-05 -3.53988 63.546000 Cu 0.74805 0.170075 0.5 785 63.546 0.000148746 -3.53941 63.546000 Cu 0.838215 0.17216 0.5 553 63.546 0.000213133 -3.53956 63.546000 Cu 0.88752 0.161924 4.22415e-17 551 63.546 0.000254668 -3.53971 63.546000 Cu 0.879193 0.184421 1.20004e-19 588 63.546 0.00013149 -3.53979 63.546000 Cu 0.969391 0.186394 1 589 63.546 2.37306e-05 -3.54001 63.546000 Cu 0.928435 0.174154 0.5 590 63.546 9.33469e-05 -3.53995 63.546000 Cu 0.977729 0.163863 1 592 63.546 9.41713e-05 -3.54019 63.546000 Cu 0.0513504 0.210907 1 633 63.546 0.000108631 -3.54002 63.546000 Cu 0.100549 0.200656 0.5 639 63.546 0.000134015 -3.54009 63.546000 Cu 0.0922738 0.223194 0.5 678 63.546 5.6934e-05 -3.54024 63.546000 Cu 0.141479 0.212955 1.32425e-16 680 63.546 0.000113291 -3.53969 63.546000 Cu 0.0103825 0.198649 0.5 634 63.546 1.72624e-05 -3.54002 63.546000 Cu 0.00212098 0.221184 0.5 635 63.546 1.98281e-05 -3.54047 63.546000 Cu 0.231655 0.215076 9.02432e-17 681 63.546 6.1363e-06 -3.53963 63.546000 Cu 0.190702 0.202754 0.5 682 63.546 3.91522e-05 -3.5401 63.546000 Cu 0.182414 0.225259 0.5 683 63.546 0.000111703 -3.53938 63.546000 Cu 0.239925 0.19257 2.04157e-16 684 63.546 2.78778e-05 -3.53977 63.546000 Cu 0.330062 0.194695 7.85128e-17 685 63.546 0.000182552 -3.53979 63.546000 Cu 0.280891 0.204895 0.5 687 63.546 6.6382e-05 -3.53978 63.546000 Cu 0.272589 0.227402 0.5 726 63.546 2.26622e-05 -3.53972 63.546000 Cu 0.321837 0.217212 1.56606e-17 728 63.546 0.000133192 -3.53994 63.546000 Cu 0.411999 0.219267 3.00011e-20 729 63.546 0.000136964 -3.54008 63.546000 Cu 0.371039 0.206985 0.5 730 63.546 0.000160081 -3.53986 63.546000 Cu 0.362771 0.229514 0.5 731 63.546 0.000137208 -3.5399 63.546000 Cu 0.420215 0.19672 1.42535e-16 732 63.546 6.9763e-05 -3.54001 63.546000 Cu 0.461169 0.208977 0.5 735 63.546 1.19087e-05 -3.54041 63.546000 Cu 0.51036 0.198683 2.8921e-17 733 63.546 5.9548e-05 -3.54022 63.546000 Cu 0.502121 0.221249 9.27033e-18 776 63.546 1.72298e-05 -3.54064 63.546000 Cu 0.592244 0.223246 3.21731e-16 777 63.546 7.6238e-05 -3.54023 63.546000 Cu 0.551315 0.210955 0.5 778 63.546 0.00012797 -3.54048 63.546000 Cu 0.600481 0.200702 3.08111e-17 780 63.546 7.43978e-05 -3.53997 63.546000 Cu 0.64143 0.213004 0.5 783 63.546 3.23453e-05 -3.53972 63.546000 Cu 0.772562 0.227382 1 583 63.546 1.76657e-05 -3.53952 63.546000 Cu 0.780798 0.204875 1 584 63.546 2.08104e-05 -3.54026 63.546000 Cu 0.830005 0.194656 0.5 586 63.546 7.83571e-05 -3.5399 63.546000 Cu 0.821779 0.217165 0.5 587 63.546 4.97017e-05 -3.53966 63.546000 Cu 0.690605 0.202789 1 781 63.546 3.0114e-05 -3.53997 63.546000 Cu 0.739816 0.192573 0.5 786 63.546 1.39591e-05 -3.5398 63.546000 Cu 0.682377 0.225301 1 824 63.546 2.09261e-05 -3.53943 63.546000 Cu 0.731581 0.215081 0.5 825 63.546 1.06018e-05 -3.53985 63.546000 Cu 0.870984 0.20693 1 585 63.546 7.6169e-05 -3.53981 63.546000 Cu 0.920185 0.19667 0.5 591 63.546 2.42958e-05 -3.53996 63.546000 Cu 0.862719 0.229447 1 628 63.546 5.04376e-05 -3.53939 63.546000 Cu 0.911936 0.219199 0.5 630 63.546 5.79657e-05 -3.53989 63.546000 Cu 0.961168 0.20892 8.81131e-17 632 63.546 1.56669e-05 -3.5403 63.546000 Cu 0.0347788 0.256007 2.12738e-16 673 63.546 2.18293e-05 -3.54003 63.546000 Cu 0.0430217 0.233455 1.71786e-16 676 63.546 3.14517e-05 -3.54055 63.546000 Cu 0.133183 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0.231538 0.5 774 63.546 3.77218e-05 -3.54019 63.546000 Cu 0.444646 0.254097 0.5 775 63.546 9.51209e-05 -3.54001 63.546000 Cu 0.485576 0.266372 1.22554e-16 816 63.546 6.88585e-05 -3.54004 63.546000 Cu 0.543001 0.233517 0.5 779 63.546 4.4175e-05 -3.54038 63.546000 Cu 0.575678 0.268334 2.08477e-16 817 63.546 0.0001219 -3.54005 63.546000 Cu 0.534733 0.256078 0.5 818 63.546 1.81263e-05 -3.54013 63.546000 Cu 0.583928 0.245785 7.08025e-18 820 63.546 7.80554e-05 -3.54006 63.546000 Cu 0.633164 0.235531 0.5 822 63.546 3.9493e-05 -3.53966 63.546000 Cu 0.624871 0.258054 0.5 823 63.546 0.000115435 -3.53977 63.546000 Cu 0.674079 0.24781 2.7001e-19 821 63.546 6.94808e-05 -3.5396 63.546000 Cu 0.76428 0.249886 2.10007e-19 624 63.546 1.83406e-05 -3.53981 63.546000 Cu 0.813489 0.239672 0.5 626 63.546 3.3823e-05 -3.53961 63.546000 Cu 0.805289 0.262193 0.5 627 63.546 2.68104e-05 -3.54015 63.546000 Cu 0.723328 0.237585 0.5 826 63.546 3.11225e-05 -3.5396 63.546000 Cu 0.715079 0.260096 0.5 866 63.546 7.47273e-05 -3.53985 63.546000 Cu 0.854467 0.251974 6.07522e-17 625 63.546 6.97782e-05 -3.54053 63.546000 Cu 0.95286 0.23146 7.53927e-17 629 63.546 3.0385e-05 -3.54008 63.546000 Cu 0.903671 0.241726 0.5 631 63.546 4.96349e-05 -3.54016 63.546000 Cu 0.895478 0.264273 0.5 670 63.546 8.88076e-05 -3.54058 63.546000 Cu 0.944651 0.254008 4.26915e-17 672 63.546 2.34698e-05 -3.54032 63.546000 Cu 0.993832 0.243731 0.5 674 63.546 6.716e-06 -3.5402 63.546000 Cu 0.985614 0.266286 0.5 675 63.546 3.08014e-05 -3.54005 63.546000 Cu 0.0186994 0.301103 1 713 63.546 8.85671e-05 -3.54019 63.546000 Cu 0.0266138 0.278553 1 716 63.546 0.000102394 -3.54008 63.546000 Cu 0.116821 0.280521 1 717 63.546 0.000241354 -3.53994 63.546000 Cu 0.0677227 0.290795 0.5 719 63.546 0.000144974 -3.53991 63.546000 Cu 0.165986 0.270284 0.5 723 63.546 0.000229923 -3.53966 63.546000 Cu 0.108933 0.303037 1 760 63.546 0.000298726 -3.53965 63.546000 Cu 0.157976 0.292792 0.5 762 63.546 0.000333916 -3.5399 63.546000 Cu 0.199217 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5.43699e-05 -3.53999 63.546000 Cu 0.657953 0.292833 1.79496e-16 861 63.546 0.000227143 -3.53979 63.546000 Cu 0.616724 0.280582 0.5 862 63.546 0.000291366 -3.54011 63.546000 Cu 0.608892 0.303105 0.5 863 63.546 0.000204569 -3.53997 63.546000 Cu 0.665876 0.270322 1 864 63.546 0.000222053 -3.53995 63.546000 Cu 0.797213 0.284714 0.5 666 63.546 8.32468e-05 -3.5395 63.546000 Cu 0.78941 0.30723 0.5 667 63.546 8.54251e-05 -3.53963 63.546000 Cu 0.756106 0.272395 1.09324e-16 865 63.546 0.000104446 -3.53961 63.546000 Cu 0.707008 0.282598 0.5 867 63.546 0.000220966 -3.53945 63.546000 Cu 0.699176 0.305094 0.5 904 63.546 0.000412962 -3.53905 63.546000 Cu 0.748179 0.294898 4.53616e-17 906 63.546 0.000162052 -3.53903 63.546000 Cu 0.838368 0.297046 1.26484e-16 665 63.546 0.000151266 -3.53964 63.546000 Cu 0.846304 0.274512 6.13522e-16 668 63.546 0.000144451 -3.54023 63.546000 Cu 0.936473 0.276564 1.30835e-16 669 63.546 0.000109313 -3.54028 63.546000 Cu 0.887373 0.286828 0.5 671 63.546 0.000272509 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0.0329928 -3.53155 63.546000 Cu 0.0112151 0.44851 0.5 876 63.546 0.00509466 -3.53645 63.546000 Cu 0.143603 0.46069 3.30012e-19 912 63.546 0.480815 -3.49325 63.546000 Cu 0.202144 0.429338 0.5 885 63.546 0.095093 -3.51721 63.546000 Cu 0.19435 0.451271 0.5 914 63.546 0.541767 -3.47354 63.546000 Cu 0.243571 0.443087 2.45559e-16 916 63.546 0.0936704 -3.52994 63.546000 Cu 0.331863 0.446604 9.00032e-20 917 63.546 0.0770118 -3.52968 63.546000 Cu 0.291634 0.433375 0.5 918 63.546 0.0392436 -3.53656 63.546000 Cu 0.283148 0.456901 0.5 919 63.546 0.21976 -3.51932 63.546000 Cu 0.340331 0.423271 1.07884e-16 920 63.546 0.031602 -3.53873 63.546000 Cu 0.429763 0.425026 1.53395e-16 921 63.546 0.00975066 -3.53771 63.546000 Cu 0.380558 0.435863 0.5 923 63.546 0.0318999 -3.53673 63.546000 Cu 0.371506 0.459281 0.5 943 63.546 0.0733943 -3.52557 63.546000 Cu 0.420891 0.44805 1 945 63.546 0.0163713 -3.53201 63.546000 Cu 0.470382 0.43696 0.5 947 63.546 0.00444835 -3.53672 63.546000 Cu 0.461722 0.459822 0.5 948 63.546 0.0163702 -3.53337 63.546000 Cu 0.511185 0.448666 1 946 63.546 0.00499344 -3.53607 63.546000 Cu 0.520043 0.426065 2.45319e-16 949 63.546 0.00229981 -3.53796 63.546000 Cu 0.610971 0.427154 9.39033e-18 950 63.546 0.0190592 -3.53229 63.546000 Cu 0.561052 0.437739 0.5 952 63.546 0.00657765 -3.53547 63.546000 Cu 0.552403 0.460148 0.5 964 63.546 0.0188066 -3.53599 63.546000 Cu 0.602144 0.44928 1 966 63.546 0.0351758 -3.53138 63.546000 Cu 0.652488 0.438972 0.5 968 63.546 0.117074 -3.51997 63.546000 Cu 0.643688 0.460722 0.5 969 63.546 0.464927 -3.49275 63.546000 Cu 0.791676 0.43324 1.56606e-17 787 63.546 0.0377474 -3.53701 63.546000 Cu 0.783228 0.456758 1.56606e-17 828 63.546 0.214015 -3.51981 63.546000 Cu 0.831913 0.446418 0.5 830 63.546 0.0728311 -3.53031 63.546000 Cu 0.6944 0.451272 1.56606e-17 967 63.546 0.506536 -3.47559 63.546000 Cu 0.70217 0.429316 3.00011e-20 970 63.546 0.0904283 -3.51826 63.546000 Cu 0.743589 0.442979 0.5 972 63.546 0.0853875 -3.53154 63.546000 Cu 0.840387 0.423096 0.5 791 63.546 0.0285178 -3.5391 63.546000 Cu 0.871588 0.459071 1.56606e-17 829 63.546 0.0679602 -3.52538 63.546000 Cu 0.880643 0.435658 9.94835e-17 832 63.546 0.0280099 -3.53688 63.546000 Cu 0.970457 0.436778 9.83735e-17 833 63.546 0.0039899 -3.53678 63.546000 Cu 0.929833 0.424834 0.5 834 63.546 0.00839858 -3.53761 63.546000 Cu 0.920938 0.447846 0.5 835 63.546 0.0149545 -3.53224 63.546000 Cu 0.961776 0.459629 1 874 63.546 0.0154003 -3.53347 63.546000 Cu 0.047668 0.482524 1 908 63.546 0.0805677 -3.54331 63.546000 Cu 0.138183 0.482566 5.00718e-17 909 63.546 3.23101 -3.48081 63.546000 Cu 0.0939798 0.471397 0.5 910 63.546 0.0914704 -3.53172 63.546000 Cu 0.0937281 0.493713 0.5 911 63.546 0.0984553 -3.53201 63.546000 Cu 0.00364298 0.471181 0.5 877 63.546 0.0571764 -3.5366 63.546000 Cu 0.00342659 0.493817 0.5 907 63.546 0.0594811 -3.53635 63.546000 Cu 0.184226 0.492832 0.5 937 63.546 7.50849 -3.26551 63.546000 Cu 0.236968 0.467098 1 913 63.546 5.75564 -3.46718 63.546000 Cu 0.184497 0.472364 0.5 915 63.546 7.50416 -3.26835 63.546000 Cu 0.236746 0.498039 1 938 63.546 5.73896 -3.46751 63.546000 Cu 0.322663 0.49452 1 939 63.546 0.334545 -3.49465 63.546000 Cu 0.270473 0.482601 0.5 940 63.546 4.54086 -3.57512 63.546000 Cu 0.322808 0.470745 4.17915e-17 941 63.546 0.341173 -3.49527 63.546000 Cu 0.413036 0.471172 3.46842e-16 942 63.546 0.0594474 -3.52543 63.546000 Cu 0.364664 0.482653 0.5 944 63.546 0.283781 -3.51478 63.546000 Cu 0.412859 0.49416 1.05094e-16 959 63.546 0.0609332 -3.52498 63.546000 Cu 0.456614 0.48267 0.5 961 63.546 0.114563 -3.54178 63.546000 Cu 0.503457 0.493975 6.30022e-17 960 63.546 0.0597512 -3.53642 63.546000 Cu 0.503666 0.47134 2.9431e-17 962 63.546 0.0558876 -3.53642 63.546000 Cu 0.638184 0.482594 0.5 468 63.546 3.20323 -3.48237 63.546000 Cu 0.59372 0.493783 2.45079e-16 489 63.546 0.0984178 -3.53212 63.546000 Cu 0.593995 0.471463 1 963 63.546 0.092445 -3.53153 63.546000 Cu 0.547699 0.482644 0.5 965 63.546 0.0796833 -3.5427 63.546000 Cu 0.684158 0.49287 1.22314e-16 487 63.546 7.49711 -3.26262 63.546000 Cu 0.73681 0.4979 0.5 13 63.546 5.7525 -3.4652 63.546000 Cu 0.736932 0.466946 0.5 91 63.546 5.75917 -3.46739 63.546000 Cu 0.684661 0.472362 4.84517e-17 466 63.546 7.49786 -3.27292 63.546000 Cu 0.770527 0.482468 7.19726e-17 827 63.546 4.54722 -3.57494 63.546000 Cu 0.822838 0.470558 0.5 831 63.546 0.337451 -3.49618 63.546000 Cu 0.822704 0.494333 0.5 869 63.546 0.338047 -3.49405 63.546000 Cu 0.864721 0.482447 1.22764e-16 870 63.546 0.278894 -3.51446 63.546000 Cu 0.956622 0.482476 7.50627e-17 871 63.546 0.113092 -3.54164 63.546000 Cu 0.913039 0.470962 0.5 872 63.546 0.059713 -3.5254 63.546000 Cu 0.912829 0.493951 0.5 873 63.546 0.0619178 -3.52455 63.546000 Cu 0.143247 0.504464 1.22944e-16 1 63.546 0.502273 -3.49311 63.546000 Cu 0.0519957 0.505026 1 4 63.546 0.0225009 -3.53624 63.546000 Cu 0.0606684 0.527435 2.45709e-16 5 63.546 0.00723668 -3.53577 63.546000 Cu 0.1017 0.515887 0.5 6 63.546 0.035624 -3.53108 63.546000 Cu 0.0107535 0.516496 0.5 7 63.546 0.00587834 -3.53644 63.546000 Cu 0.152076 0.526197 1.79586e-16 8 63.546 0.124408 -3.5192 63.546000 Cu 0.110645 0.538014 0.5 11 63.546 0.0204731 -3.53221 63.546000 Cu 0.19395 0.513902 0.5 2 63.546 0.556006 -3.47212 63.546000 Cu 0.201821 0.535816 0.5 10 63.546 0.094702 -3.51669 63.546000 Cu 0.24317 0.522098 1 92 63.546 0.0968759 -3.53046 63.546000 Cu 0.282788 0.50831 0.5 93 63.546 0.222924 -3.52054 63.546000 Cu 0.29127 0.531835 0.5 97 63.546 0.0401082 -3.53678 63.546000 Cu 0.331459 0.518653 1 94 63.546 0.0758845 -3.52994 63.546000 Cu 0.420509 0.517266 9.56434e-17 57 63.546 0.0157642 -3.53181 63.546000 Cu 0.461393 0.505508 0.5 58 63.546 0.0181447 -3.53332 63.546000 Cu 0.371209 0.506019 0.5 59 63.546 0.071403 -3.52537 63.546000 Cu 0.470023 0.52835 0.5 63 63.546 0.00429814 -3.53683 63.546000 Cu 0.380214 0.529422 0.5 96 63.546 0.0297477 -3.53661 63.546000 Cu 0.601714 0.515964 2.01007e-16 31 63.546 0.0365513 -3.53166 63.546000 Cu 0.643233 0.504499 0.5 32 63.546 0.518115 -3.49269 63.546000 Cu 0.552026 0.505138 0.5 33 63.546 0.0224288 -3.53668 63.546000 Cu 0.652085 0.526233 0.5 37 63.546 0.128589 -3.51928 63.546000 Cu 0.51082 0.516647 4.12695e-16 60 63.546 0.00555614 -3.53679 63.546000 Cu 0.56073 0.527545 0.5 62 63.546 0.00724123 -3.53603 63.546000 Cu 0.610654 0.538085 1.56606e-17 64 63.546 0.020949 -3.53194 63.546000 Cu 0.693915 0.513883 3.67813e-16 34 63.546 0.571523 -3.46864 63.546000 Cu 0.701817 0.5358 2.7661e-16 35 63.546 0.0970217 -3.51669 63.546000 Cu 0.743217 0.522016 0.5 36 63.546 0.102 -3.52987 63.546000 Cu 0.791266 0.531711 1.22374e-16 38 63.546 0.042528 -3.53597 63.546000 Cu 0.782753 0.508174 1 868 63.546 0.226752 -3.52034 63.546000 Cu 0.831438 0.518484 0.5 17 63.546 0.0798177 -3.52922 63.546000 Cu 0.96134 0.505323 1.88137e-16 3 63.546 0.0189652 -3.53345 63.546000 Cu 0.871173 0.505817 1 14 63.546 0.0765806 -3.52549 63.546000 Cu 0.880179 0.529238 1.61076e-16 15 63.546 0.0328421 -3.53648 63.546000 Cu 0.920443 0.517073 0.5 16 63.546 0.0176263 -3.53167 63.546000 Cu 0.969965 0.528178 1 18 63.546 0.0048005 -3.53645 63.546000 Cu 0.019732 0.539094 0.5 20 63.546 0.00246714 -3.53752 63.546000 Cu 0.0695844 0.549787 1.56606e-17 22 63.546 0.00495998 -3.53638 63.546000 Cu 0.0784432 0.572143 2.10487e-16 23 63.546 0.00263524 -3.53774 63.546000 Cu 0.119391 0.560209 0.5 24 63.546 0.0105399 -3.53452 63.546000 Cu 0.0287042 0.561627 0.5 25 63.546 0.0016348 -3.5382 63.546000 Cu 0.160511 0.548192 1.56606e-17 9 63.546 0.0393499 -3.52666 63.546000 Cu 0.210083 0.557984 0.5 12 63.546 0.022029 -3.52926 63.546000 Cu 0.169084 0.570358 4.46206e-16 26 63.546 0.014165 -3.53331 63.546000 Cu 0.25091 0.545029 1 133 63.546 0.0129099 -3.53873 63.546000 Cu 0.25931 0.567643 3.30342e-16 134 63.546 0.0032833 -3.53924 63.546000 Cu 0.299776 0.554803 0.5 135 63.546 0.0127485 -3.54118 63.546000 Cu 0.340055 0.54196 1 95 63.546 0.032029 -3.53962 63.546000 Cu 0.42953 0.540272 2.9263e-16 98 63.546 0.00830323 -3.53756 63.546000 Cu 0.438532 0.563088 2.45349e-16 99 63.546 0.00478325 -3.53956 63.546000 Cu 0.479067 0.551081 0.5 100 63.546 0.00217632 -3.53833 63.546000 Cu 0.389141 0.552456 0.5 101 63.546 0.0154177 -3.54042 63.546000 Cu 0.348845 0.564922 2.25008e-17 136 63.546 0.0129437 -3.542 63.546000 Cu 0.398035 0.575302 0.5 138 63.546 0.00711273 -3.5411 63.546000 Cu 0.488024 0.573707 0.5 105 63.546 0.00121009 -3.53956 63.546000 Cu 0.519793 0.539238 3.85244e-16 61 63.546 0.00252673 -3.53809 63.546000 Cu 0.619416 0.560273 1.11994e-16 65 63.546 0.0107075 -3.5346 63.546000 Cu 0.569631 0.549896 0.5 67 63.546 0.00530472 -3.53653 63.546000 Cu 0.528792 0.561759 1 102 63.546 0.00148522 -3.5383 63.546000 Cu 0.578487 0.572256 0.5 104 63.546 0.00339142 -3.53786 63.546000 Cu 0.66054 0.548221 0.5 66 63.546 0.040034 -3.52635 63.546000 Cu 0.799785 0.554695 5.6105e-16 39 63.546 0.0137705 -3.54064 63.546000 Cu 0.750948 0.544964 0.5 41 63.546 0.0135715 -3.53861 63.546000 Cu 0.710106 0.55797 1 68 63.546 0.022869 -3.52946 63.546000 Cu 0.759342 0.567587 0.5 70 63.546 0.00348967 -3.53906 63.546000 Cu 0.669108 0.570379 0.5 71 63.546 0.0135924 -3.53321 63.546000 Cu 0.987974 0.573553 1.56606e-17 46 63.546 0.00143041 -3.53912 63.546000 Cu 0.97903 0.550911 1.56456e-16 19 63.546 0.00258717 -3.53818 63.546000 Cu 0.929456 0.540093 0.5 21 63.546 0.00995342 -3.53737 63.546000 Cu 0.840041 0.541812 0.5 40 63.546 0.0342011 -3.53942 63.546000 Cu 0.889126 0.552292 1.22434e-16 42 63.546 0.0169646 -3.54045 63.546000 Cu 0.897983 0.575147 4.52296e-16 43 63.546 0.00820896 -3.5413 63.546000 Cu 0.938475 0.562925 0.5 44 63.546 0.00561804 -3.53975 63.546000 Cu 0.8488 0.564782 0.5 45 63.546 0.0147986 -3.54167 63.546000 Cu 0.128085 0.582492 0.5 29 63.546 0.00568387 -3.53686 63.546000 Cu 0.0375649 0.584119 0.5 48 63.546 0.000845252 -3.53926 63.546000 Cu 0.0871712 0.594542 2.24618e-16 50 63.546 0.00161603 -3.53866 63.546000 Cu 0.136675 0.604836 0.5 52 63.546 0.00256152 -3.53768 63.546000 Cu 0.046282 0.606603 0.5 53 63.546 0.000408974 -3.53939 63.546000 Cu 0.177642 0.592637 0 27 63.546 0.00513788 -3.53632 63.546000 Cu 0.218567 0.580281 0.5 28 63.546 0.00598815 -3.53515 63.546000 Cu 0.226977 0.60267 0.5 30 63.546 0.00183355 -3.53781 63.546000 Cu 0.186072 0.615011 1 54 63.546 0.00219255 -3.53783 63.546000 Cu 0.308437 0.577555 0.5 139 63.546 0.00452571 -3.54133 63.546000 Cu 0.267792 0.590181 1 173 63.546 0.00107633 -3.53937 63.546000 Cu 0.276261 0.612696 1 174 63.546 0.000449277 -3.53995 63.546000 Cu 0.316948 0.600207 0.5 175 63.546 0.00165068 -3.54106 63.546000 Cu 0.357544 0.587701 1 137 63.546 0.00558056 -3.54168 63.546000 Cu 0.447374 0.585799 1 140 63.546 0.00226926 -3.54064 63.546000 Cu 0.456088 0.608438 1 141 63.546 0.00100005 -3.54038 63.546000 Cu 0.406772 0.598029 0.5 143 63.546 0.0032266 -3.54115 63.546000 Cu 0.366148 0.610379 1 176 63.546 0.00241227 -3.54134 63.546000 Cu 0.4968 0.596297 0.5 142 63.546 0.000546963 -3.54007 63.546000 Cu 0.537603 0.584247 1.68516e-16 103 63.546 0.000974611 -3.5394 63.546000 Cu 0.628118 0.582554 1 106 63.546 0.0056491 -3.53676 63.546000 Cu 0.636675 0.604894 1.20664e-16 107 63.546 0.0026578 -3.53768 63.546000 Cu 0.587167 0.594642 0.5 109 63.546 0.00194875 -3.53846 63.546000 Cu 0.546306 0.606728 1 144 63.546 0.000503819 -3.53942 63.546000 Cu 0.718547 0.580275 1 69 63.546 0.00661285 -3.53512 63.546000 Cu 0.808394 0.577455 1 72 63.546 0.00510558 -3.54068 63.546000 Cu 0.816952 0.600102 7.96828e-17 73 63.546 0.00217254 -3.54087 63.546000 Cu 0.767787 0.590126 0.5 75 63.546 0.00116738 -3.53922 63.546000 Cu 0.677621 0.592656 0.5 108 63.546 0.00478 -3.5361 63.546000 Cu 0.726987 0.602656 1.91977e-16 110 63.546 0.0021364 -3.53766 63.546000 Cu 0.77627 0.61264 0.5 112 63.546 0.000437008 -3.54008 63.546000 Cu 0.686101 0.61502 0.5 113 63.546 0.00187718 -3.53776 63.546000 Cu 0.996772 0.596146 1.54715e-16 47 63.546 0.000745361 -3.53992 63.546000 Cu 0.947347 0.585637 0.5 49 63.546 0.00291402 -3.54057 63.546000 Cu 0.857497 0.587562 0.5 74 63.546 0.00687005 -3.54153 63.546000 Cu 0.906741 0.597875 2.08837e-16 76 63.546 0.0039663 -3.54151 63.546000 Cu 0.956095 0.608284 0.5 78 63.546 0.00138784 -3.54059 63.546000 Cu 0.866163 0.610245 0.5 79 63.546 0.00318017 -3.54134 63.546000 Cu 0.0957535 0.616969 1.22644e-16 51 63.546 0.000907794 -3.53863 63.546000 Cu 0.145206 0.627231 0.5 56 63.546 0.00109769 -3.53806 63.546000 Cu 0.00547062 0.618708 1.56606e-17 80 63.546 0.000344793 -3.53986 63.546000 Cu 0.0140032 0.64125 1.56606e-17 81 63.546 0.000178544 -3.54044 63.546000 Cu 0.0548741 0.62909 0.5 82 63.546 0.000217992 -3.53953 63.546000 Cu 0.104275 0.639411 2.25578e-16 84 63.546 0.000439252 -3.5391 63.546000 Cu 0.153593 0.649669 0.5 86 63.546 0.000513019 -3.53915 63.546000 Cu 0.0633138 0.651588 0.5 87 63.546 0.000202111 -3.53972 63.546000 Cu 0.19455 0.63743 8.06129e-17 55 63.546 0.00100088 -3.53874 63.546000 Cu 0.235436 0.625108 0.5 213 63.546 0.000691995 -3.53928 63.546000 Cu 0.284706 0.635217 1 214 63.546 0.000194092 -3.54002 63.546000 Cu 0.243821 0.647587 0.5 217 63.546 0.000458519 -3.53936 63.546000 Cu 0.325469 0.622807 0.5 179 63.546 0.000562408 -3.5407 63.546000 Cu 0.374681 0.632997 3.00011e-20 177 63.546 0.00114534 -3.5407 63.546000 Cu 0.415394 0.620672 0.5 178 63.546 0.00160378 -3.5408 63.546000 Cu 0.464693 0.631031 1.56606e-17 180 63.546 0.000402044 -3.54016 63.546000 Cu 0.473175 0.65359 6.02121e-17 181 63.546 0.000269277 -3.54058 63.546000 Cu 0.423884 0.643272 0.5 183 63.546 0.000774029 -3.54055 63.546000 Cu 0.333877 0.645376 0.5 216 63.546 0.000250025 -3.54011 63.546000 Cu 0.554878 0.629208 1 145 63.546 0.000309151 -3.5396 63.546000 Cu 0.595767 0.61706 0.5 146 63.546 0.00116256 -3.53874 63.546000 Cu 0.505468 0.618848 0.5 147 63.546 0.000244455 -3.53996 63.546000 Cu 0.645222 0.627281 2.24708e-16 148 63.546 0.00110578 -3.53843 63.546000 Cu 0.653702 0.649708 8.3223e-17 149 63.546 0.000529873 -3.53912 63.546000 Cu 0.604302 0.639498 0.5 151 63.546 0.000632794 -3.53964 63.546000 Cu 0.51402 0.64138 0.5 182 63.546 9.73089e-05 -3.53995 63.546000 Cu 0.563387 0.651699 1 184 63.546 0.000292721 -3.53987 63.546000 Cu 0.735474 0.625087 1 111 63.546 0.0008379 -3.5392 63.546000 Cu 0.784759 0.635161 0.5 117 63.546 0.000246073 -3.54019 63.546000 Cu 0.694608 0.637432 0.5 150 63.546 0.000740647 -3.53866 63.546000 Cu 0.74391 0.647557 6.64224e-17 152 63.546 0.000509756 -3.53913 63.546000 Cu 0.82552 0.622698 2.45559e-16 114 63.546 0.000981179 -3.54097 63.546000 Cu 0.915417 0.62053 1.28555e-16 77 63.546 0.0019507 -3.54071 63.546000 Cu 0.964685 0.630888 0.5 83 63.546 0.00060473 -3.54042 63.546000 Cu 0.83395 0.645274 1 115 63.546 0.00048088 -3.54027 63.546000 Cu 0.874712 0.632864 0.5 116 63.546 0.00179487 -3.54043 63.546000 Cu 0.923891 0.643138 5.6402e-17 118 63.546 0.00103696 -3.54036 63.546000 Cu 0.973119 0.653463 0.5 120 63.546 0.000352242 -3.54051 63.546000 Cu 0.112527 0.66188 8.04029e-18 85 63.546 0.000189134 -3.53967 63.546000 Cu 0.0223131 0.663792 1 122 63.546 0.000154689 -3.54017 63.546000 Cu 0.03027 0.686338 1 123 63.546 2.89945e-05 -3.53999 63.546000 Cu 0.071443 0.674103 0.5 124 63.546 0.000117578 -3.54008 63.546000 Cu 0.120508 0.684384 5.79021e-18 126 63.546 8.76133e-05 -3.53973 63.546000 Cu 0.161687 0.672146 0.5 90 63.546 0.000290197 -3.53968 63.546000 Cu 0.202825 0.659887 1.20514e-16 88 63.546 0.000539546 -3.53926 63.546000 Cu 0.210766 0.682363 7.87828e-17 89 63.546 0.000127024 -3.53936 63.546000 Cu 0.292983 0.65774 7.50327e-17 215 63.546 0.000168047 -3.5396 63.546000 Cu 0.251931 0.670076 0.5 255 63.546 0.000218447 -3.53904 63.546000 Cu 0.300973 0.680254 1 256 63.546 4.86161e-05 -3.53989 63.546000 Cu 0.383045 0.655579 1.22674e-16 218 63.546 0.000605635 -3.54071 63.546000 Cu 0.391159 0.678146 2.8231e-17 219 63.546 0.000224249 -3.54081 63.546000 Cu 0.432222 0.665846 0.5 220 63.546 0.000437366 -3.54112 63.546000 Cu 0.342092 0.667926 0.5 221 63.546 0.000207868 -3.54031 63.546000 Cu 0.481367 0.676141 1 222 63.546 0.00013588 -3.54057 63.546000 Cu 0.44026 0.688402 0.5 225 63.546 0.000206158 -3.5405 63.546000 Cu 0.350036 0.690464 0.5 258 63.546 5.86634e-05 -3.54063 63.546000 Cu 0.571616 0.674194 9.00032e-20 185 63.546 0.0002425 -3.53987 63.546000 Cu 0.612692 0.66196 0.5 186 63.546 0.000443713 -3.53977 63.546000 Cu 0.522436 0.66391 0.5 187 63.546 0.000192772 -3.54011 63.546000 Cu 0.620691 0.68445 0.5 191 63.546 0.000254117 -3.53947 63.546000 Cu 0.530475 0.686432 0.5 224 63.546 0.000114346 -3.53989 63.546000 Cu 0.661887 0.672172 4.80527e-16 188 63.546 0.000386724 -3.53941 63.546000 Cu 0.752041 0.670055 2.07037e-16 153 63.546 0.000350829 -3.53936 63.546000 Cu 0.793069 0.657681 0.5 154 63.546 0.000240634 -3.53989 63.546000 Cu 0.702952 0.65988 0.5 155 63.546 0.000441664 -3.53898 63.546000 Cu 0.801015 0.680215 0.5 159 63.546 4.65437e-05 -3.5396 63.546000 Cu 0.710888 0.682371 0.5 190 63.546 0.000133724 -3.53928 63.546000 Cu 0.932178 0.66573 1 119 63.546 0.000575002 -3.54073 63.546000 Cu 0.883091 0.655455 0.5 121 63.546 0.00121484 -3.54076 63.546000 Cu 0.981249 0.676024 0.5 125 63.546 0.000222926 -3.54027 63.546000 Cu 0.84211 0.66784 8.98232e-17 156 63.546 0.000277779 -3.54039 63.546000 Cu 0.849981 0.690388 2.8846e-16 157 63.546 0.000142972 -3.54015 63.546000 Cu 0.891094 0.678039 0.5 158 63.546 0.000474433 -3.5407 63.546000 Cu 0.940117 0.688293 1 160 63.546 0.000304298 -3.54035 63.546000 Cu 0.128382 0.706897 1 127 63.546 4.55359e-05 -3.54031 63.546000 Cu 0.0793167 0.696627 0.5 129 63.546 3.87345e-05 -3.53992 63.546000 Cu 0.0381676 0.708876 1.22854e-16 164 63.546 3.63083e-05 -3.54011 63.546000 Cu 0.0872256 0.719167 0.5 166 63.546 5.42048e-05 -3.54029 63.546000 Cu 0.136301 0.729432 3.00011e-20 168 63.546 7.84118e-05 -3.5399 63.546000 Cu 0.16956 0.694639 0.5 128 63.546 0.000112859 -3.5399 63.546000 Cu 0.218614 0.704869 2.40549e-16 130 63.546 6.66517e-05 -3.53973 63.546000 Cu 0.2265 0.727374 2.01067e-16 131 63.546 2.52861e-05 -3.53945 63.546000 Cu 0.177451 0.717156 0.5 132 63.546 0.000103933 -3.53966 63.546000 Cu 0.308819 0.702778 1 257 63.546 2.41486e-05 -3.54009 63.546000 Cu 0.259813 0.692572 0.5 259 63.546 4.02518e-05 -3.53971 63.546000 Cu 0.267676 0.715079 0.5 295 63.546 1.21598e-05 -3.53956 63.546000 Cu 0.316733 0.725302 1 296 63.546 2.80235e-05 -3.54005 63.546000 Cu 0.399084 0.700688 1.86307e-17 260 63.546 0.000158093 -3.5404 63.546000 Cu 0.4069 0.723231 1 261 63.546 0.000136154 -3.54001 63.546000 Cu 0.448045 0.71095 0.5 262 63.546 0.000110578 -3.53981 63.546000 Cu 0.357871 0.712991 0.5 263 63.546 6.94542e-05 -3.54007 63.546000 Cu 0.489282 0.698682 1.45535e-16 223 63.546 6.34414e-05 -3.53994 63.546000 Cu 0.497051 0.721235 8.88031e-18 264 63.546 9.51099e-05 -3.54029 63.546000 Cu 0.579461 0.696712 1.80006e-19 226 63.546 9.34824e-05 -3.53979 63.546000 Cu 0.587269 0.719246 1.00084e-16 227 63.546 0.000119896 -3.54017 63.546000 Cu 0.628439 0.706965 0.5 228 63.546 0.00014066 -3.53988 63.546000 Cu 0.538211 0.708973 0.5 229 63.546 9.8316e-05 -3.54035 63.546000 Cu 0.636332 0.729484 0.5 233 63.546 8.00641e-05 -3.5396 63.546000 Cu 0.669635 0.694667 5.18838e-16 189 63.546 6.48587e-05 -3.53962 63.546000 Cu 0.75985 0.692568 2.59509e-16 192 63.546 0.00016188 -3.53948 63.546000 Cu 0.767671 0.715073 3.50652e-16 193 63.546 6.26381e-05 -3.5395 63.546000 Cu 0.808821 0.702744 0.5 194 63.546 5.06193e-05 -3.53963 63.546000 Cu 0.718646 0.704874 0.5 195 63.546 3.57433e-05 -3.53994 63.546000 Cu 0.816763 0.725256 0.5 199 63.546 2.41749e-05 -3.5398 63.546000 Cu 0.677452 0.717185 1.56606e-17 230 63.546 8.10509e-05 -3.53983 63.546000 Cu 0.726523 0.727385 0.5 232 63.546 4.57539e-05 -3.53977 63.546000 Cu 0.989131 0.698577 0.5 162 63.546 0.000113648 -3.53985 63.546000 Cu 0.997082 0.721143 0.5 167 63.546 1.5481e-05 -3.54057 63.546000 Cu 0.948032 0.710848 1.72836e-16 161 63.546 0.000212215 -3.54027 63.546000 Cu 0.898989 0.700599 0.5 163 63.546 0.000238919 -3.5404 63.546000 Cu 0.85787 0.712921 1.12504e-17 196 63.546 0.000153342 -3.5401 63.546000 Cu 0.906957 0.723147 0.5 198 63.546 0.000204429 -3.54032 63.546000 Cu 0.0461622 0.731437 1 165 63.546 2.45245e-05 -3.54033 63.546000 Cu 0.144316 0.751972 1 169 63.546 0.000124779 -3.53991 63.546000 Cu 0.0951833 0.741719 0.5 171 63.546 0.000119146 -3.54012 63.546000 Cu 0.00505428 0.743719 0.5 202 63.546 4.8957e-05 -3.54034 63.546000 Cu 0.0541711 0.754005 2.8366e-16 204 63.546 6.0988e-05 -3.54018 63.546000 Cu 0.103297 0.764267 0.5 206 63.546 0.00014495 -3.54016 63.546000 Cu 0.0131422 0.766274 0.5 207 63.546 2.04662e-05 -3.54028 63.546000 Cu 0.185357 0.739664 0.5 170 63.546 9.75908e-05 -3.53962 63.546000 Cu 0.193477 0.762173 0.5 172 63.546 7.74379e-05 -3.53975 63.546000 Cu 0.275597 0.737592 0.5 299 63.546 4.6935e-05 -3.54009 63.546000 Cu 0.234528 0.749878 2.34008e-16 335 63.546 1.42809e-05 -3.53971 63.546000 Cu 0.283704 0.76009 0.5 337 63.546 6.20944e-05 -3.53923 63.546000 Cu 0.324764 0.747815 1 297 63.546 2.52189e-05 -3.53919 63.546000 Cu 0.455991 0.733499 0.5 267 63.546 6.46329e-05 -3.54047 63.546000 Cu 0.365812 0.735523 0.5 298 63.546 7.69699e-05 -3.53978 63.546000 Cu 0.41492 0.745774 1 300 63.546 9.19648e-05 -3.53985 63.546000 Cu 0.423014 0.768312 1.51235e-16 301 63.546 6.31126e-05 -3.54011 63.546000 Cu 0.46406 0.756055 0.5 302 63.546 2.28237e-05 -3.54031 63.546000 Cu 0.373902 0.758035 0.5 303 63.546 0.000179072 -3.53907 63.546000 Cu 0.505087 0.743798 1 265 63.546 4.14551e-05 -3.54072 63.546000 Cu 0.546155 0.731519 0.5 266 63.546 6.92504e-05 -3.54056 63.546000 Cu 0.595218 0.741784 2.10007e-19 268 63.546 0.000135509 -3.5402 63.546000 Cu 0.603275 0.764334 3.85214e-17 269 63.546 0.000184326 -3.53971 63.546000 Cu 0.644333 0.752014 0.5 270 63.546 7.70132e-05 -3.54001 63.546000 Cu 0.554211 0.754086 0.5 271 63.546 0.000199524 -3.54014 63.546000 Cu 0.513175 0.766363 1 304 63.546 0.000117785 -3.54019 63.546000 Cu 0.68542 0.739698 1.65756e-16 231 63.546 4.11261e-05 -3.53997 63.546000 Cu 0.775656 0.737572 3.67843e-16 234 63.546 5.19284e-06 -3.53985 63.546000 Cu 0.783659 0.760075 1 235 63.546 6.86443e-05 -3.53942 63.546000 Cu 0.734543 0.74989 0.5 237 63.546 7.38304e-06 -3.53972 63.546000 Cu 0.693455 0.762213 1 272 63.546 3.73273e-05 -3.53965 63.546000 Cu 0.824782 0.747769 0.5 236 63.546 6.57257e-05 -3.53966 63.546000 Cu 0.865863 0.73545 6.19222e-17 197 63.546 0.000196146 -3.53993 63.546000 Cu 0.956013 0.733418 1 200 63.546 5.96482e-05 -3.54058 63.546000 Cu 0.964019 0.755985 4.68167e-16 201 63.546 1.70188e-05 -3.54026 63.546000 Cu 0.914919 0.745701 0.5 203 63.546 0.000136839 -3.54015 63.546000 Cu 0.873859 0.757986 1 238 63.546 0.00018028 -3.53979 63.546000 Cu 0.92299 0.768253 0.5 240 63.546 4.57893e-05 -3.53994 63.546000 Cu 0.0622353 0.776572 1.42745e-16 205 63.546 0.000185819 -3.54031 63.546000 Cu 0.152353 0.7745 1 208 63.546 8.78683e-05 -3.5399 63.546000 Cu 0.1113 0.786833 0.5 211 63.546 0.000226683 -3.54008 63.546000 Cu 0.0212305 0.788852 0.5 244 63.546 0.000123833 -3.54043 63.546000 Cu 0.0702731 0.799162 1 246 63.546 0.000419612 -3.54071 63.546000 Cu 0.160364 0.797053 1 209 63.546 0.00010323 -3.54056 63.546000 Cu 0.201418 0.784698 0.5 210 63.546 7.44775e-05 -3.54015 63.546000 Cu 0.209366 0.80724 0.5 212 63.546 0.000122893 -3.54002 63.546000 Cu 0.242566 0.77238 1.47005e-16 336 63.546 5.64577e-05 -3.53977 63.546000 Cu 0.291638 0.782586 0.5 341 63.546 0.000122131 -3.53946 63.546000 Cu 0.250535 0.794893 1.47245e-16 377 63.546 0.000149418 -3.53967 63.546000 Cu 0.299583 0.805078 0.5 379 63.546 0.000373958 -3.53898 63.546000 Cu 0.332801 0.770309 1.87507e-17 338 63.546 9.54716e-05 -3.5393 63.546000 Cu 0.472137 0.778614 0.5 307 63.546 3.03099e-05 -3.54049 63.546000 Cu 0.340776 0.792805 1 339 63.546 0.000311508 -3.53941 63.546000 Cu 0.381912 0.780553 0.5 340 63.546 0.000199133 -3.54012 63.546000 Cu 0.431046 0.790853 1 342 63.546 6.3588e-05 -3.54039 63.546000 Cu 0.480131 0.801177 0.5 344 63.546 0.000112938 -3.5401 63.546000 Cu 0.389881 0.803069 0.5 345 63.546 0.000271242 -3.53981 63.546000 Cu 0.652439 0.774542 0.5 275 63.546 5.72949e-05 -3.54021 63.546000 Cu 0.521233 0.788928 1.80906e-16 305 63.546 0.000237138 -3.54041 63.546000 Cu 0.562297 0.776649 0.5 306 63.546 0.00037111 -3.54007 63.546000 Cu 0.611398 0.786885 1.21114e-16 308 63.546 0.000237604 -3.54062 63.546000 Cu 0.570279 0.799217 0.5 311 63.546 0.000450299 -3.54074 63.546000 Cu 0.660432 0.797092 0.5 310 63.546 9.87834e-05 -3.54058 63.546000 Cu 0.701584 0.784735 1 273 63.546 0.000161232 -3.54023 63.546000 Cu 0.742627 0.77239 0.5 274 63.546 6.12831e-05 -3.53955 63.546000 Cu 0.791763 0.782574 2.45649e-16 276 63.546 0.000284573 -3.53916 63.546000 Cu 0.799561 0.805068 1 277 63.546 0.000623434 -3.53908 63.546000 Cu 0.75059 0.794909 0.5 279 63.546 8.81711e-05 -3.53941 63.546000 Cu 0.709371 0.807274 1 312 63.546 0.000226356 -3.53977 63.546000 Cu 0.832829 0.770278 0.5 241 63.546 0.000134382 -3.53922 63.546000 Cu 0.881979 0.780512 4.90697e-16 239 63.546 0.000273978 -3.53956 63.546000 Cu 0.972126 0.778544 2.21828e-16 242 63.546 3.02484e-05 -3.54008 63.546000 Cu 0.98013 0.801115 1 243 63.546 6.81512e-05 -3.54058 63.546000 Cu 0.931063 0.790798 0.5 245 63.546 9.47934e-05 -3.54032 63.546000 Cu 0.840807 0.792778 0.5 278 63.546 0.00041371 -3.53937 63.546000 Cu 0.889873 0.803038 1.56606e-17 280 63.546 0.000228692 -3.54009 63.546000 Cu 0.0782542 0.821774 1.56606e-17 247 63.546 0.000920286 -3.54067 63.546000 Cu 0.119268 0.809427 0.5 248 63.546 0.000471024 -3.54111 63.546000 Cu 0.0291841 0.811448 0.5 249 63.546 0.000332128 -3.54052 63.546000 Cu 0.12735 0.832045 0.5 253 63.546 0.0011201 -3.5408 63.546000 Cu 0.0373265 0.834052 0.5 286 63.546 0.000612737 -3.54035 63.546000 Cu 0.0864238 0.844407 1.56606e-17 288 63.546 0.00174716 -3.54101 63.546000 Cu 0.168289 0.819637 1.56606e-17 250 63.546 0.000317801 -3.54048 63.546000 Cu 0.176362 0.842231 1 251 63.546 0.000740447 -3.54022 63.546000 Cu 0.217351 0.829779 0.5 252 63.546 0.000206468 -3.5391 63.546000 Cu 0.258371 0.817394 1 378 63.546 0.00052597 -3.53856 63.546000 Cu 0.307506 0.827551 0.5 383 63.546 0.000963288 -3.53876 63.546000 Cu 0.266419 0.839877 1.10494e-16 415 63.546 0.00123521 -3.53879 63.546000 Cu 0.438988 0.813388 1 343 63.546 0.000106517 -3.53957 63.546000 Cu 0.34865 0.815289 1 380 63.546 0.000758323 -3.53938 63.546000 Cu 0.356727 0.837757 1.22164e-16 381 63.546 0.00108576 -3.5388 63.546000 Cu 0.397845 0.825563 0.5 382 63.546 0.00041766 -3.53949 63.546000 Cu 0.447104 0.835894 1.56606e-17 384 63.546 0.000164017 -3.53956 63.546000 Cu 0.488162 0.823726 0.5 349 63.546 0.0002004 -3.53976 63.546000 Cu 0.619303 0.809464 1 309 63.546 0.0004212 -3.54103 63.546000 Cu 0.529183 0.811505 5.49019e-18 346 63.546 0.000530531 -3.54006 63.546000 Cu 0.537394 0.83408 1 347 63.546 0.00071837 -3.54055 63.546000 Cu 0.578326 0.821812 0.5 348 63.546 0.0008752 -3.54053 63.546000 Cu 0.627441 0.832076 0 350 63.546 0.00105108 -3.54063 63.546000 Cu 0.586497 0.844432 0.5 353 63.546 0.00169677 -3.5409 63.546000 Cu 0.717423 0.829822 1 313 63.546 0.000224764 -3.53963 63.546000 Cu 0.758415 0.817418 0.5 314 63.546 0.000379411 -3.53899 63.546000 Cu 0.668356 0.819676 0.5 315 63.546 0.000334304 -3.54037 63.546000 Cu 0.807595 0.827545 1.61406e-16 316 63.546 0.00119543 -3.53866 63.546000 Cu 0.766517 0.839904 0.5 319 63.546 0.00095848 -3.53894 63.546000 Cu 0.676407 0.842277 0.5 352 63.546 0.00100002 -3.54061 63.546000 Cu 0.98815 0.82368 1 284 63.546 0.000142356 -3.53997 63.546000 Cu 0.897896 0.825538 3.99014e-17 281 63.546 0.000411239 -3.5393 63.546000 Cu 0.938988 0.813341 0.5 282 63.546 0.000136421 -3.54003 63.546000 Cu 0.848673 0.815263 0.5 283 63.546 0.00105681 -3.53926 63.546000 Cu 0.947165 0.835876 0.5 287 63.546 0.000259931 -3.53955 63.546000 Cu 0.85683 0.837734 0.5 318 63.546 0.00166697 -3.53859 63.546000 Cu 0.0943076 0.867099 1 289 63.546 0.00356169 -3.54125 63.546000 Cu 0.135349 0.854699 0.5 290 63.546 0.00247434 -3.5408 63.546000 Cu 0.0453803 0.856694 0.5 291 63.546 0.00152299 -3.54115 63.546000 Cu 0.143171 0.877418 0.5 294 63.546 0.00556282 -3.54135 63.546000 Cu 0.00424003 0.868866 3.00011e-20 324 63.546 0.000804264 -3.54045 63.546000 Cu 0.0533521 0.87938 0.5 326 63.546 0.00320477 -3.54103 63.546000 Cu 0.225273 0.852328 0.5 254 63.546 0.000469948 -3.53976 63.546000 Cu 0.184128 0.864862 1 292 63.546 0.00161239 -3.54047 63.546000 Cu 0.274216 0.862354 1 416 63.546 0.00247019 -3.53852 63.546000 Cu 0.31554 0.850004 0.5 417 63.546 0.00205242 -3.53821 63.546000 Cu 0.232972 0.874886 0.5 445 63.546 0.00133467 -3.5396 63.546000 Cu 0.323288 0.872405 0.5 421 63.546 0.00513294 -3.53693 63.546000 Cu 0.455124 0.858392 1.56606e-17 385 63.546 0.000475143 -3.53978 63.546000 Cu 0.405945 0.848033 0.5 387 63.546 0.00087167 -3.53871 63.546000 Cu 0.36465 0.860181 2.37068e-16 418 63.546 0.00246668 -3.53797 63.546000 Cu 0.372549 0.882559 1.45445e-16 419 63.546 0.00552282 -3.53694 63.546000 Cu 0.413843 0.870483 0.5 420 63.546 0.00165564 -3.53892 63.546000 Cu 0.463104 0.880916 8.61331e-17 422 63.546 0.000922048 -3.53907 63.546000 Cu 0.496342 0.846282 0.5 386 63.546 0.000554955 -3.5404 63.546000 Cu 0.635398 0.854739 1 351 63.546 0.00279574 -3.54109 63.546000 Cu 0.545433 0.856702 1 388 63.546 0.00149107 -3.54101 63.546000 Cu 0.553348 0.879382 1 389 63.546 0.00289963 -3.54104 63.546000 Cu 0.594358 0.867125 0.5 390 63.546 0.0037432 -3.54164 63.546000 Cu 0.504258 0.86886 0.5 391 63.546 0.000648412 -3.5405 63.546000 Cu 0.643216 0.87746 1 392 63.546 0.00694821 -3.54191 63.546000 Cu 0.815614 0.849991 1.56606e-17 317 63.546 0.00275892 -3.53804 63.546000 Cu 0.725329 0.85237 1 354 63.546 0.000529993 -3.53961 63.546000 Cu 0.733065 0.874899 1.87507e-17 355 63.546 0.00124327 -3.53873 63.546000 Cu 0.774301 0.862363 0.5 356 63.546 0.00241211 -3.5374 63.546000 Cu 0.684208 0.864908 0.5 357 63.546 0.00228088 -3.54062 63.546000 Cu 0.823367 0.872386 1 358 63.546 0.00617763 -3.53687 63.546000 Cu 0.996344 0.846262 1 285 63.546 0.00053502 -3.54038 63.546000 Cu 0.906019 0.848016 1 320 63.546 0.00100838 -3.53914 63.546000 Cu 0.913885 0.870483 6.00021e-20 321 63.546 0.00155001 -3.53875 63.546000 Cu 0.955153 0.858402 0.5 322 63.546 0.000340454 -3.53983 63.546000 Cu 0.864709 0.860168 0.5 323 63.546 0.00299092 -3.53836 63.546000 Cu 0.963111 0.880927 0.5 327 63.546 0.000831546 -3.53899 63.546000 Cu 0.872595 0.882555 0.5 360 63.546 0.00558074 -3.53713 63.546000 Cu 0.0124074 0.891496 1 325 63.546 0.00175911 -3.5396 63.546000 Cu 0.102394 0.889874 1 328 63.546 0.00810656 -3.54147 63.546000 Cu 0.110902 0.912764 1.56606e-17 329 63.546 0.0174683 -3.54035 63.546000 Cu 0.151363 0.900242 0.5 330 63.546 0.0134348 -3.54177 63.546000 Cu 0.0616943 0.902131 0.5 331 63.546 0.00617361 -3.54001 63.546000 Cu 0.0209775 0.914157 1 366 63.546 0.00259493 -3.53865 63.546000 Cu 0.192016 0.887553 1 293 63.546 0.004444 -3.5409 63.546000 Cu 0.200225 0.91034 1 332 63.546 0.0124025 -3.53981 63.546000 Cu 0.281971 0.884784 1 446 63.546 0.00664368 -3.53546 63.546000 Cu 0.289989 0.907108 9.33633e-17 447 63.546 0.0223429 -3.52961 63.546000 Cu 0.240904 0.897451 0.5 449 63.546 0.00362172 -3.53851 63.546000 Cu 0.24895 0.92008 0.5 469 63.546 0.0127138 -3.53865 63.546000 Cu 0.331234 0.894713 0.5 448 63.546 0.013892 -3.53348 63.546000 Cu 0.471431 0.903424 1 423 63.546 0.00157817 -3.53814 63.546000 Cu 0.421958 0.892893 0.5 425 63.546 0.00326472 -3.53716 63.546000 Cu 0.38077 0.904851 2.7241e-17 450 63.546 0.0111559 -3.5348 63.546000 Cu 0.4304 0.915271 0.5 452 63.546 0.00539867 -3.53713 63.546000 Cu 0.339458 0.916892 0.5 453 63.546 0.039212 -3.52712 63.546000 Cu 0.651385 0.900258 1 393 63.546 0.0148087 -3.54127 63.546000 Cu 0.602411 0.889895 0.5 395 63.546 0.00880157 -3.54155 63.546000 Cu 0.512401 0.891479 0.5 424 63.546 0.001443 -3.53939 63.546000 Cu 0.561688 0.902127 1 426 63.546 0.00591213 -3.5401 63.546000 Cu 0.610879 0.912764 0.5 428 63.546 0.0181005 -3.54027 63.546000 Cu 0.520951 0.914138 0.5 429 63.546 0.0023559 -3.53881 63.546000 Cu 0.782047 0.88477 0.5 361 63.546 0.00735379 -3.53529 63.546000 Cu 0.692073 0.887581 0.5 394 63.546 0.00528479 -3.54032 63.546000 Cu 0.740955 0.89744 1 396 63.546 0.00334298 -3.53849 63.546000 Cu 0.748984 0.920074 1.52165e-16 397 63.546 0.0119688 -3.53909 63.546000 Cu 0.790052 0.907096 0.5 398 63.546 0.0233343 -3.53047 63.546000 Cu 0.700244 0.910334 0.5 399 63.546 0.0121836 -3.53999 63.546000 Cu 0.831299 0.894708 1 359 63.546 0.0140178 -3.53378 63.546000 Cu 0.921957 0.892906 1 362 63.546 0.00301692 -3.53715 63.546000 Cu 0.930392 0.915291 1 363 63.546 0.00500826 -3.5371 63.546000 Cu 0.97143 0.90344 0.5 364 63.546 0.00148355 -3.53836 63.546000 Cu 0.880783 0.904857 0.5 365 63.546 0.0110721 -3.53449 63.546000 Cu 0.839474 0.916902 5.29219e-17 400 63.546 0.0385812 -3.5272 63.546000 Cu 0.159839 0.923231 0.5 334 63.546 0.0326091 -3.53902 63.546000 Cu 0.0297629 0.936902 1 367 63.546 0.00424922 -3.53629 63.546000 Cu 0.0703961 0.924979 0.5 368 63.546 0.0100894 -3.53767 63.546000 Cu 0.119594 0.935825 1 370 63.546 0.0333523 -3.53674 63.546000 Cu 0.128557 0.959221 1 371 63.546 0.0741368 -3.52553 63.546000 Cu 0.0792502 0.947992 0.5 373 63.546 0.0167002 -3.53187 63.546000 Cu 0.0383049 0.959752 1 408 63.546 0.0155146 -3.53398 63.546000 Cu 0.208544 0.933324 1.56606e-17 333 63.546 0.0382259 -3.5369 63.546000 Cu 0.16829 0.946556 0.5 372 63.546 0.0783333 -3.52997 63.546000 Cu 0.216981 0.956833 1 374 63.546 0.216636 -3.51934 63.546000 Cu 0.298085 0.929296 3.04511e-17 470 63.546 0.0930488 -3.51751 63.546000 Cu 0.30584 0.951224 1 471 63.546 0.537732 -3.47325 63.546000 Cu 0.256646 0.943019 0.5 473 63.546 0.089623 -3.53069 63.546000 Cu 0.38921 0.927067 1 451 63.546 0.0212459 -3.53271 63.546000 Cu 0.480109 0.925976 1 454 63.546 0.00227021 -3.53856 63.546000 Cu 0.439062 0.937654 0.5 457 63.546 0.00663425 -3.53597 63.546000 Cu 0.347732 0.938908 0.5 472 63.546 0.124152 -3.51939 63.546000 Cu 0.398015 0.94921 1.20004e-19 474 63.546 0.0351378 -3.53095 63.546000 Cu 0.447624 0.960055 0.5 476 63.546 0.0191883 -3.53603 63.546000 Cu 0.488904 0.948576 1 455 63.546 0.00495357 -3.53628 63.546000 Cu 0.356469 0.960659 0.5 477 63.546 0.483327 -3.4934 63.546000 Cu 0.659838 0.92322 1 430 63.546 0.0324342 -3.53885 63.546000 Cu 0.570381 0.924968 1.56606e-17 427 63.546 0.0100334 -3.53766 63.546000 Cu 0.619578 0.935799 0.5 433 63.546 0.0324805 -3.53648 63.546000 Cu 0.529752 0.936889 0.5 456 63.546 0.00428219 -3.53664 63.546000 Cu 0.579218 0.947965 1 458 63.546 0.0163072 -3.53203 63.546000 Cu 0.62856 0.959177 0.5 460 63.546 0.0715315 -3.52564 63.546000 Cu 0.538291 0.959729 0.5 461 63.546 0.0153516 -3.53392 63.546000 Cu 0.798082 0.929299 0.5 403 63.546 0.0923644 -3.51761 63.546000 Cu 0.668291 0.946517 1 431 63.546 0.0752743 -3.53038 63.546000 Cu 0.708559 0.933303 0.5 432 63.546 0.0373255 -3.53672 63.546000 Cu 0.756627 0.943014 1 434 63.546 0.0902264 -3.53045 63.546000 Cu 0.805793 0.951238 0.5 436 63.546 0.536199 -3.47402 63.546000 Cu 0.716998 0.956822 0.5 437 63.546 0.217654 -3.51977 63.546000 Cu 0.988934 0.948594 0.5 406 63.546 0.00522426 -3.53626 63.546000 Cu 0.980119 0.925993 0.5 369 63.546 0.00221819 -3.53802 63.546000 Cu 0.847709 0.938923 7.67727e-17 401 63.546 0.122714 -3.51992 63.546000 Cu 0.889212 0.92708 0.5 402 63.546 0.0211467 -3.53288 63.546000 Cu 0.939097 0.937671 1 404 63.546 0.00661306 -3.53596 63.546000 Cu 0.947642 0.960079 1 405 63.546 0.0192858 -3.53626 63.546000 Cu 0.898025 0.949233 0.5 407 63.546 0.034582 -3.53161 63.546000 Cu 0.85648 0.960678 1 438 63.546 0.483652 -3.49365 63.546000 Cu 0.0432916 0.982594 1 409 63.546 0.112249 -3.54178 63.546000 Cu 0.0869573 0.971095 0.5 410 63.546 0.0586318 -3.52527 63.546000 Cu 0.13524 0.982551 1.22584e-16 412 63.546 0.277177 -3.51448 63.546000 Cu 0.0870232 0.994071 0.5 414 63.546 0.0594363 -3.52478 63.546000 Cu 0.263112 0.997991 0.5 521 63.546 5.75378 -3.46627 63.546000 Cu 0.229496 0.982511 1.56606e-17 375 63.546 4.55916 -3.57544 63.546000 Cu 0.177232 0.970654 0.5 376 63.546 0.338408 -3.49552 63.546000 Cu 0.177237 0.99441 0.5 413 63.546 0.345304 -3.49485 63.546000 Cu 0.263086 0.967021 0.5 483 63.546 5.76558 -3.46663 63.546000 Cu 0.315506 0.972313 1 484 63.546 7.49369 -3.26916 63.546000 Cu 0.315613 0.9928 2.41209e-16 485 63.546 7.50221 -3.26571 63.546000 Cu 0.406025 0.971392 1 475 63.546 0.0942699 -3.53177 63.546000 Cu 0.452197 0.982564 0.5 481 63.546 0.0784475 -3.54355 63.546000 Cu 0.361715 0.98255 0.5 486 63.546 3.23945 -3.48155 63.546000 Cu 0.406087 0.993718 2.64609e-17 488 63.546 0.0939484 -3.53199 63.546000 Cu 0.496318 0.971253 1.56606e-17 478 63.546 0.0563992 -3.53694 63.546000 Cu 0.496402 0.993885 5.13918e-17 479 63.546 0.0573684 -3.53683 63.546000 Cu 0.586976 0.971054 1 459 63.546 0.059333 -3.52488 63.546000 Cu 0.635234 0.982503 0.5 465 63.546 0.277088 -3.5146 63.546000 Cu 0.543324 0.982554 0.5 480 63.546 0.114095 -3.54152 63.546000 Cu 0.587049 0.994024 1 482 63.546 0.0609238 -3.52449 63.546000 Cu 0.763126 0.997983 1 490 63.546 5.75539 -3.46598 63.546000 Cu 0.763099 0.967032 1 435 63.546 5.75117 -3.467 63.546000 Cu 0.815531 0.972336 0.5 441 63.546 7.5067 -3.27011 63.546000 Cu 0.677218 0.970614 1 462 63.546 0.332574 -3.49541 63.546000 Cu 0.677233 0.99439 1 463 63.546 0.341532 -3.49526 63.546000 Cu 0.72951 0.982514 0.5 464 63.546 4.55497 -3.5752 63.546000 Cu 0.81566 0.992824 0.5 467 63.546 7.50045 -3.26528 63.546000 Cu 0.996315 0.971283 0.5 411 63.546 0.0558154 -3.53703 63.546000 Cu 0.996407 0.993924 0.5 443 63.546 0.0575191 -3.53679 63.546000 Cu 0.861759 0.982574 3.64303e-16 439 63.546 3.23215 -3.4815 63.546000 Cu 0.906045 0.971423 0.5 440 63.546 0.0939388 -3.53146 63.546000 Cu 0.952205 0.982597 1 442 63.546 0.0778052 -3.54333 63.546000 Cu 0.906121 0.993751 0.5 444 63.546 0.0942027 -3.53199