Number of particles = 916 A = 1 Angstrom (basic length-scale) H0(1,1) = 27.5245 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 110.295 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60281 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 0.00554313 0.0241252 2.60969e-16 476 63.546 0.158657 -3.5014 63.546000 Cu 0.0403045 4.14752e-06 0 479 63.546 9.59329 -3.3801 63.546000 Cu 0.0640903 0.0169109 0.5 481 63.546 5.72228 -3.42518 63.546000 Cu 0.122984 0.0113745 1 480 63.546 10.4395 -3.44316 63.546000 Cu 0.182069 0.00337481 0.5 483 63.546 7.71261 -3.23275 63.546000 Cu 0.208234 0.0198281 1.12669e-16 499 63.546 0.169874 -3.52502 63.546000 Cu 0.149816 0.0259936 0.5 497 63.546 0.0566823 -3.53051 63.546000 Cu 0.269278 0.0144625 0.5 501 63.546 1.70816 -3.45482 63.546000 Cu 0.331534 0.0101806 1 503 63.546 8.8766 -3.38234 63.546000 Cu 0.418301 0.0160018 2.27746e-16 504 63.546 2.17552 -3.4329 63.546000 Cu 0.357906 0.0231896 0.5 506 63.546 0.150885 -3.49586 63.546000 Cu 0.540315 1.63868e-06 7.27053e-17 507 63.546 9.59309 -3.38008 63.546000 Cu 0.477883 0.0105611 0.5 508 63.546 9.39136 -3.38878 63.546000 Cu 0.505554 0.0241257 0 534 63.546 0.158923 -3.50131 63.546000 Cu 0.564097 0.0169116 0.5 536 63.546 5.72274 -3.42509 63.546000 Cu 0.622977 0.0113741 1 538 63.546 10.4395 -3.44325 63.546000 Cu 0.649811 0.0259954 0.5 541 63.546 0.0565212 -3.53054 63.546000 Cu 0.769256 0.0144617 0.5 468 63.546 1.70685 -3.45486 63.546000 Cu 0.708223 0.01983 1 539 63.546 0.169087 -3.52508 63.546000 Cu 0.682054 0.00338077 0.5 540 63.546 7.70709 -3.23295 63.546000 Cu 0.831506 0.0101781 1 467 63.546 8.87865 -3.38236 63.546000 Cu 0.857887 0.0231903 0.5 473 63.546 0.150632 -3.49599 63.546000 Cu 0.918278 0.016002 1 475 63.546 2.17479 -3.43293 63.546000 Cu 0.977862 0.0105606 0.5 477 63.546 9.3926 -3.38879 63.546000 Cu 0.0305714 0.0392541 0.5 493 63.546 0.0247191 -3.53637 63.546000 Cu 0.0901394 0.0328072 1.0641e-16 495 63.546 0.0175917 -3.53575 63.546000 Cu 0.055934 0.0546518 2.73969e-16 492 63.546 0.00191708 -3.53922 63.546000 Cu 0.175486 0.0417861 2.21486e-16 496 63.546 0.00624557 -3.53688 63.546000 Cu 0.11601 0.0480856 0.5 498 63.546 0.00614348 -3.5376 63.546000 Cu 0.294103 0.0301399 0 500 63.546 0.252075 -3.51515 63.546000 Cu 0.234513 0.0355313 0.5 502 63.546 0.0347033 -3.53371 63.546000 Cu 0.260849 0.0511976 0 526 63.546 0.0437083 -3.53478 63.546000 Cu 0.32184 0.0445394 0.5 528 63.546 0.0191443 -3.53792 63.546000 Cu 0.38292 0.0379037 1 530 63.546 0.0102932 -3.53728 63.546000 Cu 0.443419 0.0314412 0.5 532 63.546 0.0513673 -3.53266 63.546000 Cu 0.408819 0.0529485 0.5 533 63.546 0.00441108 -3.53939 63.546000 Cu 0.470027 0.0460424 4.52603e-17 531 63.546 0.0137935 -3.53719 63.546000 Cu 0.53057 0.0392549 0.5 537 63.546 0.0246953 -3.53635 63.546000 Cu 0.590139 0.032808 1 535 63.546 0.0175909 -3.53575 63.546000 Cu 0.616003 0.0480874 0.5 570 63.546 0.00612517 -3.5376 63.546000 Cu 0.555924 0.0546538 1 568 63.546 0.00191512 -3.53921 63.546000 Cu 0.760848 0.0511994 1.9693e-16 470 63.546 0.0438949 -3.53476 63.546000 Cu 0.675479 0.0417886 0 572 63.546 0.00626585 -3.53688 63.546000 Cu 0.734506 0.035533 0.5 573 63.546 0.0346475 -3.53371 63.546000 Cu 0.794089 0.030141 2.93229e-16 471 63.546 0.252078 -3.51519 63.546000 Cu 0.882913 0.037905 3.35119e-16 472 63.546 0.0102689 -3.53729 63.546000 Cu 0.821837 0.0445407 0.5 474 63.546 0.019062 -3.53792 63.546000 Cu 0.943409 0.0314422 0.5 478 63.546 0.0515139 -3.53267 63.546000 Cu 0.908827 0.0529491 0.5 489 63.546 0.00443782 -3.53939 63.546000 Cu 0.970031 0.0460423 1 491 63.546 0.0137863 -3.53721 63.546000 Cu 0.0213514 0.0764243 6.50015e-17 518 63.546 0.0013283 -3.53949 63.546000 Cu 0.0815778 0.0699359 0.5 520 63.546 0.00145463 -3.53911 63.546000 Cu 0.141528 0.0635666 0 522 63.546 0.00113982 -3.5389 63.546000 Cu 0.201248 0.057284 0.5 524 63.546 0.00455011 -3.53842 63.546000 Cu 0.167241 0.0789358 0.5 525 63.546 0.00127138 -3.53941 63.546000 Cu 0.227237 0.0726532 2.88895e-18 523 63.546 0.00882514 -3.53919 63.546000 Cu 0.287659 0.0661284 0.5 529 63.546 0.00302807 -3.53979 63.546000 Cu 0.31392 0.0811718 1 560 63.546 0.000189416 -3.5399 63.546000 Cu 0.348151 0.0595192 0 527 63.546 0.000538484 -3.5398 63.546000 Cu 0.374428 0.074569 0.5 562 63.546 0.000399713 -3.53987 63.546000 Cu 0.4351 0.0678614 5.10382e-17 564 63.546 0.00253397 -3.53921 63.546000 Cu 0.521335 0.0764267 1 565 63.546 0.00129341 -3.53949 63.546000 Cu 0.49563 0.0611812 0.5 566 63.546 0.0051163 -3.53885 63.546000 Cu 0.461015 0.0829881 0.5 567 63.546 0.00148959 -3.53949 63.546000 Cu 0.641519 0.0635687 0 569 63.546 0.00115425 -3.53891 63.546000 Cu 0.581567 0.0699377 0.5 571 63.546 0.0014319 -3.53912 63.546000 Cu 0.667245 0.0789336 0.5 605 63.546 0.00127209 -3.53942 63.546000 Cu 0.701245 0.0572849 0.5 574 63.546 0.00460912 -3.53843 63.546000 Cu 0.727242 0.0726522 1 607 63.546 0.00888096 -3.53918 63.546000 Cu 0.813938 0.0811686 2.08486e-16 484 63.546 0.000191477 -3.5399 63.546000 Cu 0.787669 0.0661265 0.5 485 63.546 0.00301531 -3.53978 63.546000 Cu 0.848161 0.0595191 1.58892e-17 487 63.546 0.000526888 -3.5398 63.546000 Cu 0.874446 0.0745661 0.5 490 63.546 0.00040099 -3.53987 63.546000 Cu 0.935117 0.0678593 4.16009e-16 488 63.546 0.0025753 -3.53922 63.546000 Cu 0.995644 0.0611792 0.5 494 63.546 0.00516529 -3.53886 63.546000 Cu 0.961034 0.0829852 0.5 516 63.546 0.00153903 -3.53949 63.546000 Cu 0.107208 0.0852852 7.75203e-17 519 63.546 0.000247296 -3.53946 63.546000 Cu 0.0470721 0.0916907 0.5 521 63.546 0.000662741 -3.53948 63.546000 Cu 0.0727526 0.106979 1 552 63.546 0.000107469 -3.53963 63.546000 Cu 0.132929 0.100578 0.5 554 63.546 0.000474775 -3.5397 63.546000 Cu 0.193135 0.0942022 0 556 63.546 0.00218932 -3.53976 63.546000 Cu 0.219142 0.109334 0.5 559 63.546 0.000605936 -3.53991 63.546000 Cu 0.279599 0.10281 1.69004e-16 557 63.546 0.000195546 -3.53991 63.546000 Cu 0.253496 0.0877295 0.5 558 63.546 0.00131066 -3.53988 63.546000 Cu 0.400566 0.0896071 1 561 63.546 0.000685843 -3.53968 63.546000 Cu 0.340058 0.0962378 0.5 563 63.546 0.000137636 -3.53987 63.546000 Cu 0.426483 0.104739 0.5 597 63.546 0.000639384 -3.53966 63.546000 Cu 0.486814 0.098187 0 599 63.546 0.000720206 -3.53958 63.546000 Cu 0.547063 0.09169 0.5 601 63.546 0.000649709 -3.53949 63.546000 Cu 0.572764 0.106974 3.98194e-16 600 63.546 0.000109184 -3.53964 63.546000 Cu 0.607205 0.0852841 4.28528e-17 603 63.546 0.000250344 -3.53948 63.546000 Cu 0.632941 0.100572 0.5 606 63.546 0.000454143 -3.5397 63.546000 Cu 0.753517 0.0877239 0.5 486 63.546 0.00126785 -3.53988 63.546000 Cu 0.693152 0.094197 1 604 63.546 0.00213144 -3.53976 63.546000 Cu 0.719168 0.109328 0.5 639 63.546 0.000587781 -3.5399 63.546000 Cu 0.779623 0.102805 4.95937e-17 510 63.546 0.000196976 -3.53991 63.546000 Cu 0.840082 0.0962334 0.5 512 63.546 0.000144178 -3.53987 63.546000 Cu 0.900588 0.0896043 3.70749e-16 514 63.546 0.000713395 -3.53968 63.546000 Cu 0.986827 0.0981872 1 515 63.546 0.000736312 -3.53957 63.546000 Cu 0.926499 0.104738 0.5 517 63.546 0.00066583 -3.53965 63.546000 Cu 0.0382774 0.128676 0 549 63.546 8.40711e-05 -3.5397 63.546000 Cu 0.0125567 0.113428 0.5 550 63.546 0.000255025 -3.5396 63.546000 Cu 0.0985177 0.122235 0.5 555 63.546 0.000232233 -3.53977 63.546000 Cu 0.158769 0.115799 3.27896e-16 553 63.546 0.000694784 -3.53985 63.546000 Cu 0.124404 0.137438 8.76316e-17 587 63.546 0.000332186 -3.53986 63.546000 Cu 0.184734 0.130954 0.5 589 63.546 0.000259624 -3.53991 63.546000 Cu 0.24515 0.124439 2.02227e-17 591 63.546 8.71108e-05 -3.53991 63.546000 Cu 0.331567 0.133013 2.88895e-17 592 63.546 0.000163686 -3.53983 63.546000 Cu 0.305607 0.1179 0.5 593 63.546 6.39585e-05 -3.53988 63.546000 Cu 0.366077 0.111322 2.40746e-17 595 63.546 0.000301875 -3.53977 63.546000 Cu 0.391947 0.126468 0.5 598 63.546 0.000256908 -3.53973 63.546000 Cu 0.452283 0.119928 3.23563e-16 596 63.546 0.000324815 -3.53965 63.546000 Cu 0.512561 0.113426 0.5 602 63.546 0.000249295 -3.53961 63.546000 Cu 0.478052 0.135149 0.5 632 63.546 0.000112102 -3.53968 63.546000 Cu 0.538311 0.128671 2.08486e-16 634 63.546 7.33916e-05 -3.53971 63.546000 Cu 0.624447 0.137431 4.94011e-16 635 63.546 0.000264206 -3.53986 63.546000 Cu 0.598547 0.12223 0.5 636 63.546 0.000220204 -3.53977 63.546000 Cu 0.658802 0.115792 0 638 63.546 0.000620031 -3.53986 63.546000 Cu 0.745177 0.124434 1.55522e-16 509 63.546 8.5478e-05 -3.53991 63.546000 Cu 0.684765 0.130951 0.5 640 63.546 0.000276842 -3.5399 63.546000 Cu 0.866094 0.11132 3.80379e-16 511 63.546 0.00030265 -3.53977 63.546000 Cu 0.805628 0.117896 0.5 513 63.546 6.47249e-05 -3.53987 63.546000 Cu 0.831576 0.133008 2.4845e-16 544 63.546 0.000166753 -3.53983 63.546000 Cu 0.891952 0.126464 0.5 546 63.546 0.000272694 -3.53972 63.546000 Cu 0.952278 0.119928 3.29341e-16 548 63.546 0.00032398 -3.53964 63.546000 Cu 0.978033 0.135148 0.5 551 63.546 0.000125905 -3.53966 63.546000 Cu 0.00390106 0.150381 0 583 63.546 5.84778e-05 -3.53975 63.546000 Cu 0.0901334 0.159095 0 584 63.546 0.000121499 -3.53987 63.546000 Cu 0.0641221 0.1439 0.5 585 63.546 0.00017985 -3.5398 63.546000 Cu 0.0298715 0.165589 0.5 586 63.546 0.000127405 -3.53982 63.546000 Cu 0.210784 0.146084 2.79747e-16 588 63.546 4.13269e-05 -3.5399 63.546000 Cu 0.150436 0.152592 0.5 590 63.546 7.59029e-05 -3.5399 63.546000 Cu 0.271162 0.139561 0.5 594 63.546 3.98971e-05 -3.53989 63.546000 Cu 0.236847 0.161227 0.5 624 63.546 2.62955e-05 -3.53989 63.546000 Cu 0.297182 0.154696 1 626 63.546 0.000113527 -3.53985 63.546000 Cu 0.383442 0.163368 1 627 63.546 5.80404e-05 -3.53977 63.546000 Cu 0.357513 0.148178 0.5 628 63.546 0.000127494 -3.5398 63.546000 Cu 0.417799 0.141656 6.88534e-16 630 63.546 0.000128661 -3.53972 63.546000 Cu 0.443693 0.156872 0.5 633 63.546 3.52497e-05 -3.53975 63.546000 Cu 0.503929 0.150378 1.71411e-16 631 63.546 4.61886e-05 -3.53975 63.546000 Cu 0.529889 0.165583 0.5 667 63.546 8.94926e-05 -3.53983 63.546000 Cu 0.564155 0.143897 0.5 637 63.546 0.000149128 -3.5398 63.546000 Cu 0.590145 0.159092 2.98525e-17 669 63.546 0.000115391 -3.53986 63.546000 Cu 0.65045 0.152591 0.5 671 63.546 8.03315e-05 -3.5399 63.546000 Cu 0.771179 0.139557 0.5 543 63.546 3.76221e-05 -3.53988 63.546000 Cu 0.710802 0.146079 2.11857e-17 673 63.546 4.13825e-05 -3.53989 63.546000 Cu 0.736844 0.161225 0.5 674 63.546 2.66362e-05 -3.53989 63.546000 Cu 0.797179 0.154691 1 542 63.546 0.000135912 -3.53985 63.546000 Cu 0.857513 0.148173 0.5 547 63.546 0.000145442 -3.53979 63.546000 Cu 0.883429 0.163366 3.9675e-16 579 63.546 6.25505e-05 -3.53977 63.546000 Cu 0.917787 0.141653 2.60006e-17 545 63.546 0.000143504 -3.53971 63.546000 Cu 0.943674 0.156873 0.5 581 63.546 3.55918e-05 -3.53973 63.546000 Cu 0.0559897 0.180763 3.3223e-17 618 63.546 1.67867e-05 -3.53987 63.546000 Cu 0.142385 0.189425 3.98194e-16 619 63.546 2.36911e-05 -3.53987 63.546000 Cu 0.116246 0.174258 0.5 620 63.546 1.91821e-05 -3.53987 63.546000 Cu 0.176532 0.167751 0 622 63.546 2.80827e-05 -3.53988 63.546000 Cu 0.202667 0.182901 0.5 625 63.546 4.29555e-05 -3.53987 63.546000 Cu 0.262941 0.176384 1 623 63.546 6.99272e-05 -3.53984 63.546000 Cu 0.323194 0.169871 0.5 629 63.546 8.47508e-05 -3.53981 63.546000 Cu 0.289046 0.191569 0.5 659 63.546 5.86004e-05 -3.53981 63.546000 Cu 0.349251 0.185069 1.47818e-16 661 63.546 2.50921e-05 -3.53978 63.546000 Cu 0.435554 0.193771 1 662 63.546 3.55031e-05 -3.53981 63.546000 Cu 0.409463 0.178571 0.5 663 63.546 2.49499e-05 -3.53978 63.546000 Cu 0.46966 0.172077 2.35931e-17 665 63.546 7.30815e-05 -3.53979 63.546000 Cu 0.495769 0.187263 0.5 668 63.546 2.74849e-05 -3.53983 63.546000 Cu 0.555974 0.180765 0 666 63.546 4.94017e-05 -3.53985 63.546000 Cu 0.616235 0.174256 0.5 672 63.546 2.9666e-05 -3.53988 63.546000 Cu 0.64237 0.189425 1 704 63.546 3.98641e-05 -3.53987 63.546000 Cu 0.762921 0.176382 1 575 63.546 8.52262e-05 -3.53983 63.546000 Cu 0.676519 0.167749 2.73488e-16 670 63.546 3.83385e-05 -3.53988 63.546000 Cu 0.702647 0.1829 0.5 706 63.546 4.8287e-05 -3.53988 63.546000 Cu 0.849232 0.185069 6.88534e-17 576 63.546 2.84628e-05 -3.53977 63.546000 Cu 0.823177 0.16987 0.5 577 63.546 9.23735e-05 -3.53981 63.546000 Cu 0.789022 0.19157 0.5 578 63.546 5.61146e-05 -3.5398 63.546000 Cu 0.96965 0.17208 1.28558e-16 580 63.546 7.15975e-05 -3.5398 63.546000 Cu 0.909432 0.178578 0.5 582 63.546 5.50945e-05 -3.53978 63.546000 Cu 0.935546 0.193771 1 614 63.546 4.04143e-05 -3.53982 63.546000 Cu 0.99575 0.187269 0.5 616 63.546 4.87298e-05 -3.53984 63.546000 Cu 0.0219296 0.202437 1.84893e-16 615 63.546 3.39402e-05 -3.53984 63.546000 Cu 0.0821424 0.195931 0.5 621 63.546 2.18091e-05 -3.53985 63.546000 Cu 0.0481545 0.217625 0.5 651 63.546 5.988e-06 -3.53983 63.546000 Cu 0.108332 0.211104 3.10081e-16 653 63.546 2.71871e-05 -3.53985 63.546000 Cu 0.194755 0.21978 2.63858e-16 654 63.546 1.22767e-05 -3.53981 63.546000 Cu 0.168579 0.204586 0.5 655 63.546 5.82061e-05 -3.53984 63.546000 Cu 0.228807 0.198083 2.20042e-16 657 63.546 3.77983e-05 -3.53982 63.546000 Cu 0.315164 0.206786 1 658 63.546 4.44192e-05 -3.53979 63.546000 Cu 0.254969 0.213274 0.5 660 63.546 1.47164e-05 -3.5398 63.546000 Cu 0.375369 0.200278 0.5 664 63.546 2.10452e-05 -3.5398 63.546000 Cu 0.341316 0.221973 0.5 694 63.546 1.36863e-05 -3.53983 63.546000 Cu 0.401534 0.215475 4.71862e-17 696 63.546 3.44124e-05 -3.53983 63.546000 Cu 0.461732 0.208962 0.5 698 63.546 1.55389e-05 -3.53983 63.546000 Cu 0.521918 0.202443 1 700 63.546 2.46747e-05 -3.53985 63.546000 Cu 0.54814 0.217623 0.5 703 63.546 4.28497e-06 -3.53984 63.546000 Cu 0.608342 0.211101 3.70749e-16 701 63.546 1.57677e-05 -3.53986 63.546000 Cu 0.582138 0.195928 0.5 702 63.546 2.83951e-05 -3.53985 63.546000 Cu 0.668575 0.204581 0.5 707 63.546 7.29897e-05 -3.53984 63.546000 Cu 0.754972 0.213272 0.5 609 63.546 1.65467e-05 -3.5398 63.546000 Cu 0.728805 0.198081 1 705 63.546 4.42245e-05 -3.53982 63.546000 Cu 0.694777 0.219776 1 739 63.546 1.92528e-05 -3.53981 63.546000 Cu 0.815164 0.206785 0 610 63.546 4.30384e-05 -3.53978 63.546000 Cu 0.875345 0.200282 0.5 612 63.546 5.35869e-05 -3.53981 63.546000 Cu 0.841332 0.22197 0.5 613 63.546 1.48373e-05 -3.53984 63.546000 Cu 0.901543 0.21547 1.74782e-16 611 63.546 2.06966e-05 -3.53983 63.546000 Cu 0.96174 0.208958 0.5 617 63.546 9.10084e-06 -3.53984 63.546000 Cu 0.0743775 0.232802 4.12157e-16 650 63.546 1.34315e-05 -3.53984 63.546000 Cu 0.014162 0.239319 0.5 652 63.546 8.93699e-06 -3.53985 63.546000 Cu 0.100541 0.247986 0.5 686 63.546 1.47633e-05 -3.53981 63.546000 Cu 0.134587 0.226284 0.5 656 63.546 4.5986e-05 -3.53981 63.546000 Cu 0.160736 0.241477 1 688 63.546 3.93264e-06 -3.53981 63.546000 Cu 0.220921 0.234971 0.5 690 63.546 3.4851e-06 -3.5398 63.546000 Cu 0.281107 0.228474 1 692 63.546 2.0139e-05 -3.53982 63.546000 Cu 0.307287 0.243654 0.5 695 63.546 2.51811e-05 -3.53984 63.546000 Cu 0.367508 0.237152 1 693 63.546 8.06928e-06 -3.53985 63.546000 Cu 0.427714 0.230652 0.5 699 63.546 1.39795e-05 -3.53985 63.546000 Cu 0.487944 0.22414 2.9371e-17 697 63.546 7.69475e-06 -3.53985 63.546000 Cu 0.453942 0.245825 1 731 63.546 1.13525e-05 -3.53985 63.546000 Cu 0.514145 0.239316 0.5 733 63.546 1.23366e-05 -3.53986 63.546000 Cu 0.574386 0.232795 1 735 63.546 2.81842e-05 -3.53985 63.546000 Cu 0.660747 0.241472 2.1956e-16 736 63.546 7.64224e-06 -3.53981 63.546000 Cu 0.634591 0.226279 0.5 737 63.546 4.95225e-05 -3.53982 63.546000 Cu 0.600558 0.247979 0.5 738 63.546 2.69234e-05 -3.53981 63.546000 Cu 0.720937 0.234971 0.5 740 63.546 6.49166e-06 -3.5398 63.546000 Cu 0.78111 0.228478 9.14835e-17 608 63.546 5.56104e-05 -3.53982 63.546000 Cu 0.807303 0.243651 0.5 643 63.546 1.72862e-05 -3.53985 63.546000 Cu 0.867511 0.237151 0 645 63.546 1.42574e-05 -3.53985 63.546000 Cu 0.953939 0.245826 1 646 63.546 1.61756e-05 -3.53984 63.546000 Cu 0.927761 0.230642 0.5 647 63.546 1.16395e-05 -3.53986 63.546000 Cu 0.987964 0.224135 1 649 63.546 6.211e-06 -3.53983 63.546000 Cu 0.00644925 0.276184 1 681 63.546 6.05605e-05 -3.5398 63.546000 Cu 0.0403615 0.254492 1.07373e-16 684 63.546 3.12397e-05 -3.53983 63.546000 Cu 0.0665625 0.269688 0.5 687 63.546 1.28312e-05 -3.53978 63.546000 Cu 0.126721 0.263178 3.7749e-16 685 63.546 1.93798e-05 -3.5398 63.546000 Cu 0.186873 0.256677 0.5 691 63.546 8.72466e-05 -3.53981 63.546000 Cu 0.213136 0.27185 1.63707e-16 723 63.546 2.02911e-05 -3.53985 63.546000 Cu 0.247089 0.250163 1 689 63.546 3.02632e-05 -3.53984 63.546000 Cu 0.273329 0.265341 0.5 725 63.546 1.83667e-05 -3.53985 63.546000 Cu 0.333558 0.258832 1.18929e-16 727 63.546 7.15385e-06 -3.53985 63.546000 Cu 0.420034 0.267509 1.99819e-16 728 63.546 1.42898e-05 -3.53984 63.546000 Cu 0.393737 0.252329 0.5 729 63.546 1.15684e-05 -3.53984 63.546000 Cu 0.359821 0.274006 0.5 730 63.546 6.93981e-06 -3.53985 63.546000 Cu 0.540377 0.254486 1.01595e-16 732 63.546 4.06286e-05 -3.53982 63.546000 Cu 0.480207 0.261001 0.5 734 63.546 9.95227e-06 -3.53983 63.546000 Cu 0.506462 0.276189 4.95937e-17 766 63.546 2.77138e-05 -3.53981 63.546000 Cu 0.566612 0.269683 0.5 768 63.546 8.69446e-06 -3.53978 63.546000 Cu 0.626727 0.263172 1 770 63.546 2.77955e-05 -3.53978 63.546000 Cu 0.747065 0.250166 2.40746e-18 641 63.546 8.36079e-05 -3.53985 63.546000 Cu 0.773328 0.265338 0.5 644 63.546 1.29586e-05 -3.53984 63.546000 Cu 0.713139 0.271847 4.33825e-16 771 63.546 2.17934e-05 -3.53985 63.546000 Cu 0.686884 0.256674 0.5 772 63.546 8.35059e-05 -3.5398 63.546000 Cu 0.833526 0.258831 1 642 63.546 1.54784e-05 -3.53985 63.546000 Cu 0.859799 0.274005 0.5 678 63.546 7.08456e-06 -3.53983 63.546000 Cu 0.893744 0.252322 0.5 648 63.546 1.65582e-05 -3.53984 63.546000 Cu 0.919994 0.267508 1 680 63.546 5.1873e-06 -3.53983 63.546000 Cu 0.980165 0.261002 0.5 682 63.546 1.2916e-05 -3.53984 63.546000 Cu 0.0326265 0.291392 0.5 717 63.546 4.9288e-05 -3.5398 63.546000 Cu 0.0928117 0.284882 0 719 63.546 4.65051e-05 -3.53981 63.546000 Cu 0.179219 0.293529 1.41559e-16 720 63.546 1.8553e-05 -3.53986 63.546000 Cu 0.152946 0.278376 0.5 721 63.546 0.000103876 -3.53982 63.546000 Cu 0.119007 0.300064 0.5 722 63.546 5.40063e-05 -3.53985 63.546000 Cu 0.299619 0.280502 1 724 63.546 2.17719e-05 -3.53985 63.546000 Cu 0.239421 0.287012 0.5 726 63.546 1.74489e-05 -3.53986 63.546000 Cu 0.265657 0.302177 5.9705e-17 758 63.546 2.35289e-05 -3.53984 63.546000 Cu 0.325872 0.295676 0.5 760 63.546 1.15092e-05 -3.53985 63.546000 Cu 0.386077 0.289181 1 762 63.546 9.74262e-06 -3.53984 63.546000 Cu 0.412323 0.304368 0.5 765 63.546 1.71311e-05 -3.53983 63.546000 Cu 0.446278 0.28269 0.5 764 63.546 1.81616e-05 -3.53983 63.546000 Cu 0.472492 0.29788 1 763 63.546 1.33759e-05 -3.53981 63.546000 Cu 0.532639 0.29139 0.5 769 63.546 3.23083e-05 -3.5398 63.546000 Cu 0.592802 0.284881 2.0319e-16 767 63.546 4.4162e-05 -3.53981 63.546000 Cu 0.652966 0.278373 0.5 773 63.546 0.00010336 -3.53983 63.546000 Cu 0.619002 0.300061 0.5 802 63.546 5.05565e-05 -3.53985 63.546000 Cu 0.765682 0.302178 1 675 63.546 3.79517e-05 -3.53984 63.546000 Cu 0.679238 0.293527 1 804 63.546 3.29389e-05 -3.53986 63.546000 Cu 0.739439 0.287015 0.5 805 63.546 2.14123e-05 -3.53986 63.546000 Cu 0.799642 0.280503 1.32892e-16 676 63.546 3.81733e-05 -3.53984 63.546000 Cu 0.886079 0.289181 1.10743e-16 677 63.546 1.29178e-05 -3.53984 63.546000 Cu 0.825863 0.295677 0.5 679 63.546 1.49317e-05 -3.53985 63.546000 Cu 0.946242 0.282687 0.5 683 63.546 1.7713e-05 -3.53983 63.546000 Cu 0.91231 0.304359 0.5 713 63.546 2.62078e-05 -3.53983 63.546000 Cu 0.972491 0.297875 1 715 63.546 2.32395e-05 -3.5398 63.546000 Cu 0.0588401 0.30658 1 716 63.546 5.58028e-05 -3.53981 63.546000 Cu 0.0248767 0.328269 3.61119e-17 750 63.546 5.80311e-05 -3.53981 63.546000 Cu 0.0850655 0.321759 0.5 752 63.546 5.09271e-05 -3.53983 63.546000 Cu 0.145246 0.315226 4.27565e-16 754 63.546 2.35325e-05 -3.53983 63.546000 Cu 0.205463 0.308693 0.5 756 63.546 4.41251e-05 -3.53984 63.546000 Cu 0.17144 0.330405 0.5 757 63.546 2.3345e-05 -3.53983 63.546000 Cu 0.231643 0.323872 1.61781e-16 755 63.546 4.20626e-05 -3.53986 63.546000 Cu 0.291915 0.317349 0.5 761 63.546 3.32378e-05 -3.53987 63.546000 Cu 0.318123 0.332507 2.07523e-16 792 63.546 0.000111798 -3.53988 63.546000 Cu 0.35213 0.310848 1 759 63.546 2.77153e-05 -3.53984 63.546000 Cu 0.378376 0.326023 0.5 794 63.546 6.65946e-05 -3.53985 63.546000 Cu 0.438575 0.319552 7.94462e-17 796 63.546 5.87678e-05 -3.53981 63.546000 Cu 0.524905 0.328268 3.77008e-16 797 63.546 6.33434e-05 -3.53981 63.546000 Cu 0.498695 0.313079 0.5 798 63.546 5.11436e-05 -3.53979 63.546000 Cu 0.558841 0.306575 0 800 63.546 3.52638e-05 -3.53982 63.546000 Cu 0.645248 0.315223 1.613e-16 801 63.546 2.4578e-05 -3.53982 63.546000 Cu 0.585063 0.32175 0.5 803 63.546 3.49146e-05 -3.53982 63.546000 Cu 0.671411 0.330397 0.5 837 63.546 3.34394e-05 -3.53983 63.546000 Cu 0.705445 0.308697 0.5 806 63.546 1.74512e-05 -3.53985 63.546000 Cu 0.73161 0.323875 0 839 63.546 5.61858e-05 -3.53985 63.546000 Cu 0.818091 0.332512 1.30003e-16 708 63.546 9.45978e-05 -3.53988 63.546000 Cu 0.791874 0.317349 0.5 709 63.546 1.8103e-05 -3.53988 63.546000 Cu 0.852137 0.310844 2.27746e-16 711 63.546 4.76253e-05 -3.53985 63.546000 Cu 0.878355 0.326015 0.5 714 63.546 8.4677e-05 -3.53986 63.546000 Cu 0.938577 0.319544 0 712 63.546 8.12351e-05 -3.53981 63.546000 Cu 0.998701 0.313079 0.5 718 63.546 6.39001e-05 -3.53979 63.546000 Cu 0.051042 0.343466 0.5 753 63.546 8.80921e-05 -3.53977 63.546000 Cu 0.0771889 0.358669 1.54559e-16 784 63.546 0.000319953 -3.53977 63.546000 Cu 0.111196 0.336947 1.52633e-16 751 63.546 0.000101044 -3.5398 63.546000 Cu 0.137435 0.352118 0.5 786 63.546 0.000127541 -3.53983 63.546000 Cu 0.197635 0.345569 2.98044e-16 788 63.546 0.000131321 -3.53988 63.546000 Cu 0.223998 0.360693 0.5 791 63.546 4.18495e-05 -3.53992 63.546000 Cu 0.284246 0.354152 2.17634e-16 789 63.546 0.000232157 -3.53987 63.546000 Cu 0.257894 0.339025 0.5 790 63.546 6.99995e-05 -3.53989 63.546000 Cu 0.404576 0.341206 3.3223e-17 793 63.546 0.000106868 -3.53978 63.546000 Cu 0.344431 0.347663 0.5 795 63.546 0.000250727 -3.53981 63.546000 Cu 0.430803 0.35642 0.5 829 63.546 9.18467e-05 -3.5397 63.546000 Cu 0.464711 0.334754 0.5 799 63.546 5.1375e-05 -3.5398 63.546000 Cu 0.490894 0.349964 5.68161e-17 831 63.546 0.000124558 -3.53974 63.546000 Cu 0.551036 0.343462 0.5 833 63.546 6.70963e-05 -3.53977 63.546000 Cu 0.57717 0.358664 1 832 63.546 0.000299637 -3.53978 63.546000 Cu 0.611221 0.336941 2.58561e-16 835 63.546 6.97058e-05 -3.53979 63.546000 Cu 0.637413 0.352107 0.5 838 63.546 0.000102147 -3.53984 63.546000 Cu 0.757868 0.339028 0.5 710 63.546 6.07241e-05 -3.53988 63.546000 Cu 0.697641 0.345564 0 836 63.546 9.34037e-05 -3.53987 63.546000 Cu 0.723986 0.36069 0.5 871 63.546 4.83684e-05 -3.53991 63.546000 Cu 0.78423 0.35416 3.2597e-16 742 63.546 0.000148884 -3.53988 63.546000 Cu 0.844421 0.347668 0.5 744 63.546 0.000195845 -3.53982 63.546000 Cu 0.904558 0.3412 2.05597e-16 746 63.546 0.000124624 -3.53979 63.546000 Cu 0.990883 0.349957 2.91784e-16 747 63.546 9.44253e-05 -3.53973 63.546000 Cu 0.964711 0.334744 0.5 748 63.546 2.4221e-05 -3.5398 63.546000 Cu 0.930818 0.356411 0.5 749 63.546 0.000105076 -3.53971 63.546000 Cu 0.0432312 0.380412 1 781 63.546 0.00069996 -3.5397 63.546000 Cu 0.0170698 0.365189 0.5 782 63.546 0.00027713 -3.53969 63.546000 Cu 0.103416 0.373839 0.5 787 63.546 0.000402851 -3.53981 63.546000 Cu 0.163692 0.367254 2.1956e-16 785 63.546 0.000126649 -3.5399 63.546000 Cu 0.190078 0.382356 0.5 821 63.546 0.000102916 -3.53993 63.546000 Cu 0.250395 0.375796 1 823 63.546 0.000346657 -3.53988 63.546000 Cu 0.310613 0.369298 0.5 825 63.546 0.000515314 -3.5398 63.546000 Cu 0.337014 0.384475 4.47788e-16 824 63.546 0.0010858 -3.53964 63.546000 Cu 0.370745 0.362845 2.1956e-16 827 63.546 0.000368011 -3.53971 63.546000 Cu 0.397051 0.378085 0.5 830 63.546 0.000267749 -3.53956 63.546000 Cu 0.457011 0.371669 1 828 63.546 0.000207329 -3.53959 63.546000 Cu 0.517025 0.36519 0.5 834 63.546 0.000350173 -3.53968 63.546000 Cu 0.483172 0.386939 0.5 864 63.546 0.0008586 -3.53956 63.546000 Cu 0.54325 0.380406 1 866 63.546 0.000605598 -3.5397 63.546000 Cu 0.603414 0.37383 0.5 868 63.546 0.000334392 -3.53981 63.546000 Cu 0.663683 0.367251 0 870 63.546 0.000129075 -3.5399 63.546000 Cu 0.750373 0.375799 1 741 63.546 0.000289678 -3.53988 63.546000 Cu 0.690085 0.382351 0.5 872 63.546 0.000110805 -3.53992 63.546000 Cu 0.870713 0.362845 1 743 63.546 0.000343856 -3.53973 63.546000 Cu 0.810605 0.369301 0.5 745 63.546 0.000444338 -3.5398 63.546000 Cu 0.836978 0.384472 2.96599e-16 776 63.546 0.00107094 -3.53964 63.546000 Cu 0.897043 0.378075 0.5 778 63.546 0.000362337 -3.53957 63.546000 Cu 0.956999 0.371664 1 780 63.546 0.000193675 -3.53959 63.546000 Cu 0.983193 0.386935 0.5 783 63.546 0.000787669 -3.53956 63.546000 Cu 0.00924589 0.402172 1.87782e-16 815 63.546 0.00132661 -3.53962 63.546000 Cu 0.0957625 0.410689 5.59494e-16 816 63.546 0.000903734 -3.53978 63.546000 Cu 0.0694838 0.395593 0.5 817 63.546 0.00107214 -3.53975 63.546000 Cu 0.129753 0.388959 1 819 63.546 0.000274399 -3.53987 63.546000 Cu 0.216541 0.397428 1 820 63.546 0.000510556 -3.5399 63.546000 Cu 0.156192 0.404018 0.5 822 63.546 0.000264149 -3.53993 63.546000 Cu 0.276829 0.390913 0.5 826 63.546 0.00116386 -3.53979 63.546000 Cu 0.243054 0.412502 0.5 856 63.546 0.00241574 -3.53973 63.546000 Cu 0.303229 0.406067 0 858 63.546 0.00325134 -3.53941 63.546000 Cu 0.389171 0.415087 4.76677e-17 859 63.546 0.000765237 -3.5391 63.546000 Cu 0.36322 0.399736 0.5 860 63.546 0.000719178 -3.53942 63.546000 Cu 0.423182 0.393374 0 862 63.546 0.00035577 -3.53946 63.546000 Cu 0.449144 0.408696 0.5 865 63.546 0.00178498 -3.53935 63.546000 Cu 0.509275 0.402173 6.40385e-17 863 63.546 0.00133579 -3.53961 63.546000 Cu 0.629755 0.38895 1.13151e-16 867 63.546 0.000278326 -3.53987 63.546000 Cu 0.569506 0.395586 0.5 869 63.546 0.000948803 -3.53974 63.546000 Cu 0.595765 0.410686 1 898 63.546 0.000944874 -3.53978 63.546000 Cu 0.65622 0.404015 0.5 900 63.546 0.000267216 -3.53993 63.546000 Cu 0.776836 0.390919 0.5 775 63.546 0.00100898 -3.53978 63.546000 Cu 0.716533 0.397423 1.17966e-16 902 63.546 0.000549918 -3.53989 63.546000 Cu 0.743038 0.412502 0.5 903 63.546 0.00234812 -3.53973 63.546000 Cu 0.803227 0.406065 0 774 63.546 0.00338196 -3.53941 63.546000 Cu 0.86323 0.399735 0.5 779 63.546 0.000819948 -3.5394 63.546000 Cu 0.889181 0.41509 1 811 63.546 0.000782721 -3.53911 63.546000 Cu 0.923151 0.393372 0 777 63.546 0.000331824 -3.53945 63.546000 Cu 0.949139 0.408696 0.5 813 63.546 0.00177031 -3.53932 63.546000 Cu 0.0353488 0.417357 0.5 818 63.546 0.00244535 -3.53952 63.546000 Cu 0.0614995 0.432421 1 850 63.546 0.00344487 -3.53917 63.546000 Cu 0.000863699 0.439179 0.5 848 63.546 0.00782283 -3.53865 63.546000 Cu 0.148839 0.440653 4.47306e-16 851 63.546 0.00117467 -3.53962 63.546000 Cu 0.122273 0.425671 0.5 852 63.546 0.000866651 -3.5398 63.546000 Cu 0.182739 0.419052 1.30966e-16 854 63.546 0.000546317 -3.53989 63.546000 Cu 0.209363 0.434071 0.5 857 63.546 0.00494276 -3.53955 63.546000 Cu 0.269595 0.427587 1 855 63.546 0.0128757 -3.53846 63.546000 Cu 0.329402 0.421377 0.5 861 63.546 0.00228384 -3.53891 63.546000 Cu 0.295817 0.443017 0.5 888 63.546 0.00855548 -3.53729 63.546000 Cu 0.355177 0.436835 1 890 63.546 0.00312871 -3.53791 63.546000 Cu 0.414905 0.430503 0.5 892 63.546 0.00482565 -3.53843 63.546000 Cu 0.535361 0.417358 0.5 896 63.546 0.00248953 -3.53953 63.546000 Cu 0.475043 0.423959 0 894 63.546 0.00265032 -3.53939 63.546000 Cu 0.500868 0.439172 0.5 897 63.546 0.00769984 -3.53866 63.546000 Cu 0.561511 0.432418 0 895 63.546 0.00339085 -3.53917 63.546000 Cu 0.648851 0.440653 1 463 63.546 0.00121709 -3.53963 63.546000 Cu 0.622271 0.425668 0.5 901 63.546 0.000850034 -3.5398 63.546000 Cu 0.709348 0.434071 0.5 454 63.546 0.00494636 -3.53956 63.546000 Cu 0.769585 0.427586 2.45561e-17 807 63.546 0.0128662 -3.53845 63.546000 Cu 0.682748 0.419049 1 899 63.546 0.00059446 -3.53988 63.546000 Cu 0.855197 0.436833 1 808 63.546 0.00307947 -3.53794 63.546000 Cu 0.829398 0.421381 0.5 809 63.546 0.00217287 -3.53891 63.546000 Cu 0.795774 0.443014 0.5 810 63.546 0.00851312 -3.5373 63.546000 Cu 0.975036 0.423961 0 812 63.546 0.00263678 -3.53937 63.546000 Cu 0.9149 0.430507 0.5 814 63.546 0.0048818 -3.53842 63.546000 Cu 0.0266176 0.454201 1.3867e-16 847 63.546 0.0142611 -3.53659 63.546000 Cu 0.0880457 0.447224 0.5 853 63.546 0.00689216 -3.53884 63.546000 Cu 0.0534717 0.468668 0.5 880 63.546 0.0597208 -3.531 63.546000 Cu 0.114016 0.462168 1 882 63.546 0.010203 -3.53643 63.546000 Cu 0.203229 0.469916 1 883 63.546 0.295847 -3.51035 63.546000 Cu 0.175386 0.45556 0.5 884 63.546 0.0235617 -3.53683 63.546000 Cu 0.236421 0.448995 1 886 63.546 0.0577837 -3.5323 63.546000 Cu 0.321561 0.458662 1.84893e-16 887 63.546 0.0128423 -3.53376 63.546000 Cu 0.263044 0.464735 0.5 889 63.546 0.0616745 -3.52853 63.546000 Cu 0.440503 0.44579 7.51128e-17 891 63.546 0.00505628 -3.53883 63.546000 Cu 0.380552 0.452481 0.5 893 63.546 0.0215964 -3.53498 63.546000 Cu 0.406418 0.46775 1 911 63.546 0.0237316 -3.53499 63.546000 Cu 0.55346 0.468662 0.5 464 63.546 0.0597003 -3.53099 63.546000 Cu 0.465951 0.461126 0.5 913 63.546 0.0321603 -3.53516 63.546000 Cu 0.52663 0.454191 1 915 63.546 0.0138663 -3.53659 63.546000 Cu 0.588051 0.447219 0.5 465 63.546 0.00695162 -3.53884 63.546000 Cu 0.614024 0.462166 1 916 63.546 0.0102714 -3.53641 63.546000 Cu 0.675385 0.455562 0.5 452 63.546 0.0234515 -3.53681 63.546000 Cu 0.703182 0.469923 0 5 63.546 0.290372 -3.51084 63.546000 Cu 0.736426 0.448989 6.21125e-17 456 63.546 0.0591009 -3.53238 63.546000 Cu 0.763032 0.464739 0.5 841 63.546 0.0622129 -3.52863 63.546000 Cu 0.821548 0.458659 1.83449e-16 842 63.546 0.0130567 -3.53379 63.546000 Cu 0.880562 0.452481 0.5 844 63.546 0.0213393 -3.53503 63.546000 Cu 0.940494 0.445795 1 846 63.546 0.00513374 -3.53882 63.546000 Cu 0.906419 0.467748 7.36683e-17 843 63.546 0.0240465 -3.53497 63.546000 Cu 0.965967 0.461135 0.5 849 63.546 0.0323024 -3.53516 63.546000 Cu 0.0786241 0.484011 1 879 63.546 2.43637 -3.4236 63.546000 Cu 0.0199364 0.489563 0.5 881 63.546 9.15123 -3.40131 63.546000 Cu 0.139228 0.476739 0.5 885 63.546 0.162066 -3.49254 63.546000 Cu 0.164782 0.489689 1 905 63.546 8.61114 -3.39264 63.546000 Cu 0.227698 0.485416 0.5 906 63.546 2.40923 -3.43668 63.546000 Cu 0.289483 0.480682 2.50376e-16 907 63.546 0.607177 -3.4618 63.546000 Cu 0.346842 0.474782 0.5 909 63.546 0.234839 -3.4863 63.546000 Cu 0.373472 0.489274 1 908 63.546 10.3464 -3.39489 63.546000 Cu 0.432838 0.48364 0.5 914 63.546 5.65578 -3.41868 63.546000 Cu 0.519938 0.489558 0.5 432 63.546 9.15427 -3.40174 63.546000 Cu 0.491161 0.476106 0 912 63.546 0.175813 -3.50628 63.546000 Cu 0.639195 0.476731 0.5 17 63.546 0.161123 -3.49312 63.546000 Cu 0.66475 0.489703 2.96118e-16 19 63.546 8.61727 -3.3908 63.546000 Cu 0.578595 0.484005 1 44 63.546 2.43897 -3.42379 63.546000 Cu 0.727652 0.485418 0.5 2 63.546 2.40988 -3.43668 63.546000 Cu 0.84681 0.474782 0.5 845 63.546 0.237226 -3.48594 63.546000 Cu 0.789484 0.480678 1 840 63.546 0.61218 -3.46173 63.546000 Cu 0.873429 0.48926 1 875 63.546 10.3649 -3.39515 63.546000 Cu 0.932818 0.483646 0.5 877 63.546 5.65217 -3.41844 63.546000 Cu 0.99116 0.476113 2.05116e-16 878 63.546 0.175892 -3.50637 63.546000 Cu 0.106019 0.500119 0.5 904 63.546 9.09592 -3.44401 63.546000 Cu 0.0201586 0.510666 0.5 8 63.546 9.16647 -3.40035 63.546000 Cu 0.0789487 0.516229 4.47788e-17 10 63.546 2.41765 -3.42407 63.546000 Cu 0.164994 0.510553 2.76858e-16 1 63.546 8.60327 -3.39111 63.546000 Cu 0.13965 0.523491 0.5 12 63.546 0.16122 -3.49105 63.546000 Cu 0.313147 0.500063 0.5 910 63.546 9.20269 -3.29877 63.546000 Cu 0.227991 0.514801 0.5 3 63.546 2.4038 -3.43737 63.546000 Cu 0.245813 0.500096 1 42 63.546 8.83866 -3.47252 63.546000 Cu 0.289778 0.519501 0 43 63.546 0.623288 -3.46078 63.546000 Cu 0.373577 0.510927 1 45 63.546 10.3626 -3.39301 63.546000 Cu 0.433044 0.51658 0.5 47 63.546 5.65229 -3.41953 63.546000 Cu 0.347139 0.525428 0.5 48 63.546 0.238808 -3.48475 63.546000 Cu 0.460089 0.500107 1.06891e-16 436 63.546 9.43034 -3.40396 63.546000 Cu 0.520148 0.510669 0.5 20 63.546 9.17119 -3.40079 63.546000 Cu 0.491509 0.524099 4.81492e-18 49 63.546 0.177135 -3.50501 63.546000 Cu 0.605969 0.500114 0.5 6 63.546 9.1198 -3.44394 63.546000 Cu 0.578879 0.516233 1 18 63.546 2.42966 -3.42462 63.546000 Cu 0.63967 0.523499 0.5 24 63.546 0.158104 -3.49192 63.546000 Cu 0.665034 0.510528 1.48781e-16 21 63.546 8.60221 -3.38916 63.546000 Cu 0.727941 0.514802 0.5 23 63.546 2.40313 -3.43735 63.546000 Cu 0.745741 0.500104 1 873 63.546 8.81691 -3.47267 63.546000 Cu 0.813157 0.500071 0.5 874 63.546 9.21252 -3.2985 63.546000 Cu 0.873597 0.510922 1.26151e-16 4 63.546 10.3633 -3.39334 63.546000 Cu 0.789788 0.519502 5.34456e-17 25 63.546 0.622067 -3.46104 63.546000 Cu 0.847162 0.525417 0.5 27 63.546 0.2399 -3.48493 63.546000 Cu 0.960088 0.500108 2.36894e-16 876 63.546 9.42993 -3.40405 63.546000 Cu 0.991546 0.524105 2.38339e-16 7 63.546 0.174933 -3.5053 63.546000 Cu 0.933094 0.516579 0.5 9 63.546 5.65043 -3.41969 63.546000 Cu 0.053958 0.531557 0.5 13 63.546 0.0605001 -3.53087 63.546000 Cu 0.0272529 0.545998 4.47788e-17 33 63.546 0.0153197 -3.53616 63.546000 Cu 0.0887462 0.552974 0.5 35 63.546 0.00613993 -3.53871 63.546000 Cu 0.11464 0.538059 1 11 63.546 0.0094704 -3.53631 63.546000 Cu 0.203686 0.530309 1 14 63.546 0.300405 -3.51097 63.546000 Cu 0.176068 0.544663 0.5 16 63.546 0.0243041 -3.53683 63.546000 Cu 0.237048 0.551236 1 15 63.546 0.0602569 -3.5326 63.546000 Cu 0.26354 0.535476 0.5 75 63.546 0.0622476 -3.5287 63.546000 Cu 0.322022 0.541534 1.8393e-16 76 63.546 0.0136278 -3.5338 63.546000 Cu 0.406801 0.532456 1 46 63.546 0.0232397 -3.53509 63.546000 Cu 0.381136 0.547726 0.5 78 63.546 0.0209388 -3.53497 63.546000 Cu 0.441239 0.5544 0 80 63.546 0.00490555 -3.53864 63.546000 Cu 0.527263 0.546 2.94673e-16 50 63.546 0.0148431 -3.53619 63.546000 Cu 0.466459 0.539065 0.5 52 63.546 0.0333499 -3.53499 63.546000 Cu 0.553979 0.531545 0.5 51 63.546 0.0592604 -3.53077 63.546000 Cu 0.614656 0.538055 1 53 63.546 0.00960499 -3.53626 63.546000 Cu 0.588722 0.552974 0.5 56 63.546 0.00584544 -3.53876 63.546000 Cu 0.703668 0.530286 1 22 63.546 0.289046 -3.51158 63.546000 Cu 0.76356 0.535476 0.5 28 63.546 0.0619774 -3.52879 63.546000 Cu 0.676053 0.544665 0.5 55 63.546 0.023349 -3.53689 63.546000 Cu 0.737084 0.551237 1.26151e-16 57 63.546 0.0615574 -3.53279 63.546000 Cu 0.822042 0.541531 1 26 63.546 0.0136778 -3.5337 63.546000 Cu 0.881114 0.547714 0.5 32 63.546 0.0221821 -3.53491 63.546000 Cu 0.90681 0.53245 1 29 63.546 0.0234294 -3.53511 63.546000 Cu 0.966468 0.539068 0.5 31 63.546 0.0327289 -3.53498 63.546000 Cu 0.941207 0.554395 3.85194e-17 30 63.546 0.00511042 -3.53864 63.546000 Cu 0.0624362 0.567777 1.34336e-16 34 63.546 0.00330065 -3.53894 63.546000 Cu 0.00167275 0.561022 0.5 36 63.546 0.00750288 -3.53841 63.546000 Cu 0.0365011 0.582841 0.5 67 63.546 0.00239295 -3.53933 63.546000 Cu 0.1496 0.559558 0 37 63.546 0.00100593 -3.53964 63.546000 Cu 0.183839 0.581146 8.18537e-17 38 63.546 0.000613141 -3.53982 63.546000 Cu 0.210119 0.566158 0.5 39 63.546 0.00569772 -3.53957 63.546000 Cu 0.123219 0.574529 0.5 40 63.546 0.000711676 -3.53975 63.546000 Cu 0.296486 0.5572 0.5 79 63.546 0.00921432 -3.53746 63.546000 Cu 0.270567 0.572616 6.93349e-17 108 63.546 0.0132966 -3.53868 63.546000 Cu 0.330526 0.57881 0.5 110 63.546 0.00219528 -3.53913 63.546000 Cu 0.356016 0.563359 1.91634e-16 77 63.546 0.00329897 -3.53808 63.546000 Cu 0.415881 0.569694 0.5 83 63.546 0.00442466 -3.53834 63.546000 Cu 0.476131 0.576235 2.40746e-18 81 63.546 0.00256489 -3.53919 63.546000 Cu 0.501691 0.56102 0.5 82 63.546 0.00778172 -3.53836 63.546000 Cu 0.536514 0.582841 0.5 87 63.546 0.00242675 -3.53932 63.546000 Cu 0.649599 0.559559 0 54 63.546 0.000936736 -3.53962 63.546000 Cu 0.562421 0.56778 1 84 63.546 0.00330489 -3.53897 63.546000 Cu 0.623212 0.574527 0.5 86 63.546 0.000727957 -3.53974 63.546000 Cu 0.770596 0.572605 1.24706e-16 58 63.546 0.0128511 -3.53866 63.546000 Cu 0.710146 0.566144 0.5 60 63.546 0.00543552 -3.53957 63.546000 Cu 0.683854 0.581141 1.4204e-16 88 63.546 0.000602633 -3.53983 63.546000 Cu 0.796477 0.557196 0.5 59 63.546 0.00952518 -3.53743 63.546000 Cu 0.856025 0.563356 2.69636e-17 61 63.546 0.00322733 -3.53802 63.546000 Cu 0.830531 0.578811 0.5 64 63.546 0.00228688 -3.53912 63.546000 Cu 0.915826 0.569691 0.5 63 63.546 0.00473544 -3.53828 63.546000 Cu 0.976117 0.576227 1 65 63.546 0.00286534 -3.5392 63.546000 Cu 0.0108217 0.598007 1 66 63.546 0.00139414 -3.53943 63.546000 Cu 0.0970964 0.589505 1 69 63.546 0.000808158 -3.5396 63.546000 Cu 0.0711923 0.604592 0.5 72 63.546 0.00104127 -3.53959 63.546000 Cu 0.15771 0.596154 0.5 71 63.546 0.000227424 -3.53983 63.546000 Cu 0.218266 0.602729 1 73 63.546 0.000443484 -3.53987 63.546000 Cu 0.244367 0.58768 0.5 41 63.546 0.00243305 -3.53977 63.546000 Cu 0.304712 0.594113 9.67799e-17 109 63.546 0.00359153 -3.53959 63.546000 Cu 0.278722 0.609236 0.5 142 63.546 0.00105503 -3.53986 63.546000 Cu 0.390452 0.585097 1 111 63.546 0.000809022 -3.5392 63.546000 Cu 0.424961 0.606801 1 112 63.546 0.000343829 -3.53957 63.546000 Cu 0.364848 0.600437 0.5 114 63.546 0.000735412 -3.53958 63.546000 Cu 0.450521 0.5915 0.5 113 63.546 0.00150411 -3.53927 63.546000 Cu 0.510814 0.598019 1 115 63.546 0.00115055 -3.53947 63.546000 Cu 0.597088 0.5895 1 85 63.546 0.000962285 -3.53961 63.546000 Cu 0.657704 0.596149 0.5 91 63.546 0.000254497 -3.53983 63.546000 Cu 0.571219 0.604592 0.5 117 63.546 0.000939082 -3.53959 63.546000 Cu 0.718253 0.602727 1 89 63.546 0.000420291 -3.53986 63.546000 Cu 0.744362 0.58768 0.5 90 63.546 0.00249606 -3.53979 63.546000 Cu 0.804706 0.594115 1.45411e-16 92 63.546 0.00357822 -3.53961 63.546000 Cu 0.864835 0.600437 0.5 94 63.546 0.000698992 -3.53959 63.546000 Cu 0.778686 0.609243 0.5 95 63.546 0.0011749 -3.53987 63.546000 Cu 0.890467 0.585102 9.62984e-17 62 63.546 0.000794921 -3.5392 63.546000 Cu 0.950513 0.591495 0.5 68 63.546 0.0016201 -3.53925 63.546000 Cu 0.924981 0.606799 1 96 63.546 0.000308364 -3.53958 63.546000 Cu 0.0455598 0.619762 1.17966e-16 100 63.546 0.000343473 -3.53962 63.546000 Cu 0.0197847 0.634949 0.5 103 63.546 0.000235498 -3.53971 63.546000 Cu 0.105949 0.626306 0.5 102 63.546 0.000281645 -3.53971 63.546000 Cu 0.131733 0.611191 5.24827e-17 70 63.546 0.000448337 -3.53973 63.546000 Cu 0.192246 0.617779 0.5 74 63.546 0.000134712 -3.53985 63.546000 Cu 0.166393 0.632869 0 104 63.546 0.000122647 -3.53981 63.546000 Cu 0.252764 0.624337 1 141 63.546 0.000346978 -3.53988 63.546000 Cu 0.313164 0.630828 0.5 146 63.546 0.000473368 -3.53987 63.546000 Cu 0.339064 0.615674 0 143 63.546 0.000961979 -3.53979 63.546000 Cu 0.373479 0.637281 0 144 63.546 0.000438704 -3.53984 63.546000 Cu 0.399257 0.622067 0.5 145 63.546 0.00016253 -3.53973 63.546000 Cu 0.545564 0.61976 1 116 63.546 0.000321103 -3.53965 63.546000 Cu 0.485179 0.613243 0.5 118 63.546 0.000584873 -3.53959 63.546000 Cu 0.459491 0.628469 1.90671e-16 147 63.546 0.00027419 -3.53974 63.546000 Cu 0.519815 0.634943 0.5 149 63.546 0.000232906 -3.53973 63.546000 Cu 0.631757 0.61119 5.82606e-17 119 63.546 0.000378432 -3.53973 63.546000 Cu 0.605947 0.626306 0.5 122 63.546 0.000242032 -3.53969 63.546000 Cu 0.666374 0.632867 1.19892e-16 120 63.546 0.000140083 -3.5398 63.546000 Cu 0.692253 0.61778 0.5 121 63.546 8.68076e-05 -3.53984 63.546000 Cu 0.752755 0.624341 1 123 63.546 0.000377009 -3.53988 63.546000 Cu 0.839064 0.615677 1 93 63.546 0.000990929 -3.5398 63.546000 Cu 0.81319 0.63083 0.5 125 63.546 0.000496291 -3.53988 63.546000 Cu 0.873503 0.637286 1 127 63.546 0.0005066 -3.53983 63.546000 Cu 0.959504 0.628475 1 97 63.546 0.000244585 -3.53973 63.546000 Cu 0.98517 0.613232 0.5 98 63.546 0.000774489 -3.53956 63.546000 Cu 0.899271 0.622067 0.5 99 63.546 0.000164747 -3.53974 63.546000 Cu 0.0801545 0.641466 0 101 63.546 0.000118636 -3.53976 63.546000 Cu 0.0543356 0.656633 0.5 133 63.546 0.000113578 -3.53977 63.546000 Cu 0.20094 0.654523 1.28077e-16 105 63.546 0.000124395 -3.53984 63.546000 Cu 0.140502 0.647998 0.5 107 63.546 9.96604e-05 -3.53978 63.546000 Cu 0.114692 0.663151 1 135 63.546 3.92145e-05 -3.53983 63.546000 Cu 0.226811 0.639421 0.5 106 63.546 3.89678e-05 -3.53985 63.546000 Cu 0.287245 0.645951 1.92597e-18 175 63.546 0.000185802 -3.53988 63.546000 Cu 0.261301 0.661062 0.5 178 63.546 5.01765e-05 -3.53987 63.546000 Cu 0.433807 0.643695 0.5 150 63.546 0.000136848 -3.53981 63.546000 Cu 0.347612 0.652432 0.5 177 63.546 0.000174764 -3.53989 63.546000 Cu 0.407973 0.658892 1.83449e-16 179 63.546 0.000161894 -3.53987 63.546000 Cu 0.494065 0.650146 1.65152e-16 148 63.546 9.78788e-05 -3.53977 63.546000 Cu 0.468259 0.665342 0.5 181 63.546 7.99257e-05 -3.53982 63.546000 Cu 0.554369 0.656631 0.5 154 63.546 0.000136717 -3.53977 63.546000 Cu 0.580171 0.64146 1 151 63.546 0.000144235 -3.53975 63.546000 Cu 0.614669 0.663152 2.04634e-16 152 63.546 4.86437e-05 -3.53982 63.546000 Cu 0.64053 0.648002 0.5 153 63.546 6.45255e-05 -3.53978 63.546000 Cu 0.726814 0.639424 0.5 126 63.546 5.54421e-05 -3.53986 63.546000 Cu 0.700919 0.654531 1 155 63.546 7.58722e-05 -3.53984 63.546000 Cu 0.761286 0.661066 0.5 157 63.546 3.49293e-05 -3.53987 63.546000 Cu 0.787256 0.64595 1 124 63.546 0.000155154 -3.53989 63.546000 Cu 0.847618 0.652433 0.5 130 63.546 0.000175037 -3.53989 63.546000 Cu 0.907989 0.658895 1.10743e-16 128 63.546 0.000238723 -3.53987 63.546000 Cu 0.933773 0.643698 0.5 129 63.546 7.88185e-05 -3.53979 63.546000 Cu 0.994034 0.65015 0 131 63.546 8.57203e-05 -3.53978 63.546000 Cu 0.968282 0.665339 0.5 134 63.546 0.000157076 -3.5398 63.546000 Cu 0.0285003 0.671809 0 132 63.546 7.13274e-05 -3.53982 63.546000 Cu 0.0888065 0.67831 0.5 138 63.546 3.44109e-05 -3.53981 63.546000 Cu 0.00262836 0.686991 0.5 165 63.546 3.73387e-05 -3.53983 63.546000 Cu 0.06288 0.693469 1 167 63.546 0.000102925 -3.53983 63.546000 Cu 0.149123 0.684812 1.54078e-16 136 63.546 6.78606e-05 -3.53986 63.546000 Cu 0.175061 0.669675 0.5 137 63.546 3.51842e-05 -3.53982 63.546000 Cu 0.209474 0.691344 0.5 140 63.546 2.62933e-05 -3.53985 63.546000 Cu 0.235423 0.676192 1 139 63.546 3.0306e-05 -3.53985 63.546000 Cu 0.321712 0.667571 1 176 63.546 9.33034e-05 -3.53989 63.546000 Cu 0.295743 0.682713 0.5 209 63.546 3.46605e-05 -3.53986 63.546000 Cu 0.382016 0.674055 0.5 182 63.546 5.13342e-05 -3.53987 63.546000 Cu 0.356075 0.689206 4.23713e-17 210 63.546 2.62527e-05 -3.53988 63.546000 Cu 0.442304 0.68052 1.62263e-16 180 63.546 1.99893e-05 -3.53986 63.546000 Cu 0.528494 0.671813 1 183 63.546 5.32229e-05 -3.53981 63.546000 Cu 0.502603 0.686996 0.5 186 63.546 1.88762e-05 -3.53983 63.546000 Cu 0.56289 0.69348 1 184 63.546 2.47394e-05 -3.53984 63.546000 Cu 0.5888 0.678313 0.5 185 63.546 3.48291e-05 -3.53982 63.546000 Cu 0.649119 0.684812 4.16491e-16 187 63.546 8.42677e-05 -3.53984 63.546000 Cu 0.735356 0.676192 2.71562e-16 156 63.546 2.77247e-05 -3.53985 63.546000 Cu 0.675033 0.669678 0.5 158 63.546 2.25527e-05 -3.53982 63.546000 Cu 0.709476 0.691344 0.5 189 63.546 2.22124e-05 -3.53985 63.546000 Cu 0.821672 0.667573 0 159 63.546 7.03627e-05 -3.5399 63.546000 Cu 0.856057 0.689208 4.04453e-17 160 63.546 4.67173e-05 -3.53988 63.546000 Cu 0.882024 0.67405 0.5 161 63.546 4.54614e-05 -3.53988 63.546000 Cu 0.795714 0.682712 0.5 162 63.546 3.54283e-05 -3.53987 63.546000 Cu 0.942308 0.680514 1 163 63.546 2.5457e-05 -3.53987 63.546000 Cu 0.0973755 0.715139 1.30003e-17 168 63.546 2.01029e-05 -3.5398 63.546000 Cu 0.0370853 0.708653 0.5 170 63.546 7.49051e-05 -3.53984 63.546000 Cu 0.123232 0.699977 0.5 169 63.546 3.48748e-05 -3.53983 63.546000 Cu 0.183543 0.706478 1.06891e-16 171 63.546 6.9229e-05 -3.53983 63.546000 Cu 0.15767 0.721644 0.5 174 63.546 1.39293e-05 -3.53983 63.546000 Cu 0.243884 0.713005 0.5 173 63.546 2.49697e-05 -3.53986 63.546000 Cu 0.269815 0.697851 2.46043e-16 208 63.546 1.07174e-05 -3.53986 63.546000 Cu 0.304195 0.719506 1 241 63.546 4.37356e-05 -3.53986 63.546000 Cu 0.330142 0.704358 0.5 213 63.546 3.21086e-05 -3.53987 63.546000 Cu 0.390462 0.710835 1 211 63.546 2.17017e-05 -3.53988 63.546000 Cu 0.416391 0.695685 0.5 212 63.546 1.65487e-05 -3.53986 63.546000 Cu 0.476686 0.702159 2.28709e-16 214 63.546 3.62565e-05 -3.53986 63.546000 Cu 0.537033 0.708659 0.5 216 63.546 2.94887e-05 -3.53984 63.546000 Cu 0.450835 0.717327 0.5 217 63.546 2.54066e-05 -3.53987 63.546000 Cu 0.623226 0.699981 0.5 190 63.546 2.51752e-05 -3.53984 63.546000 Cu 0.597349 0.715142 1 218 63.546 1.32901e-05 -3.53982 63.546000 Cu 0.657662 0.721642 0.5 220 63.546 2.12261e-05 -3.53985 63.546000 Cu 0.683554 0.706481 1 188 63.546 4.15111e-05 -3.53984 63.546000 Cu 0.769816 0.697852 1.04002e-16 191 63.546 8.07792e-06 -3.53985 63.546000 Cu 0.743904 0.713003 0.5 194 63.546 1.37515e-05 -3.53986 63.546000 Cu 0.804239 0.719506 1.613e-16 192 63.546 2.73351e-05 -3.53985 63.546000 Cu 0.830153 0.704357 0.5 193 63.546 3.00251e-05 -3.53987 63.546000 Cu 0.976693 0.702152 1 164 63.546 7.21948e-05 -3.53986 63.546000 Cu 0.916406 0.695685 0.5 166 63.546 2.97171e-05 -3.53986 63.546000 Cu 0.890479 0.710835 1.54078e-17 195 63.546 1.23776e-05 -3.53988 63.546000 Cu 0.950866 0.71732 0.5 197 63.546 5.58664e-05 -3.53988 63.546000 Cu 0.0111801 0.723803 3.94824e-16 199 63.546 5.29415e-05 -3.53984 63.546000 Cu 0.0455278 0.745469 0 200 63.546 1.8447e-05 -3.53986 63.546000 Cu 0.0714911 0.730315 0.5 201 63.546 3.99046e-05 -3.53986 63.546000 Cu 0.13179 0.736813 1 203 63.546 2.11563e-05 -3.53982 63.546000 Cu 0.192106 0.743302 0.5 205 63.546 1.96415e-05 -3.53985 63.546000 Cu 0.217953 0.728146 1.59374e-16 172 63.546 4.85327e-05 -3.53983 63.546000 Cu 0.278322 0.73465 0.5 244 63.546 5.71603e-06 -3.53987 63.546000 Cu 0.252437 0.749803 1 274 63.546 1.43447e-05 -3.53984 63.546000 Cu 0.338668 0.741148 2.88414e-16 242 63.546 1.47233e-05 -3.53986 63.546000 Cu 0.364576 0.725994 0.5 243 63.546 8.10722e-06 -3.53988 63.546000 Cu 0.424913 0.732476 0 245 63.546 1.27981e-05 -3.53987 63.546000 Cu 0.39897 0.747631 0.5 248 63.546 1.17292e-05 -3.53987 63.546000 Cu 0.511169 0.723811 1 215 63.546 3.90669e-05 -3.53984 63.546000 Cu 0.485233 0.738973 0.5 247 63.546 5.54429e-06 -3.53988 63.546000 Cu 0.545553 0.745475 1.75263e-16 249 63.546 1.91215e-05 -3.53985 63.546000 Cu 0.631793 0.736807 1 219 63.546 6.06073e-06 -3.53982 63.546000 Cu 0.571486 0.730317 0.5 221 63.546 3.49861e-05 -3.53985 63.546000 Cu 0.717991 0.728143 1.92597e-17 222 63.546 1.5901e-05 -3.53984 63.546000 Cu 0.752425 0.749801 0 223 63.546 1.83306e-05 -3.53985 63.546000 Cu 0.6921 0.743294 0.5 225 63.546 4.56068e-05 -3.53985 63.546000 Cu 0.864589 0.725987 0.5 198 63.546 1.55541e-05 -3.53988 63.546000 Cu 0.778341 0.734648 0.5 224 63.546 1.06931e-05 -3.53987 63.546000 Cu 0.838676 0.741152 1 226 63.546 5.5301e-05 -3.53985 63.546000 Cu 0.924909 0.73247 0 196 63.546 2.11212e-05 -3.53987 63.546000 Cu 0.985205 0.738964 0.5 202 63.546 8.63548e-06 -3.53988 63.546000 Cu 0.898931 0.74763 0.5 228 63.546 2.44436e-05 -3.53986 63.546000 Cu 0.0195457 0.760603 0.5 232 63.546 8.15219e-05 -3.53988 63.546000 Cu 0.0799209 0.767116 8.95576e-17 234 63.546 2.17629e-05 -3.53988 63.546000 Cu 0.105859 0.751968 0.5 206 63.546 2.01885e-05 -3.53988 63.546000 Cu 0.166215 0.758478 0 204 63.546 8.29747e-05 -3.53985 63.546000 Cu 0.140238 0.773619 0.5 236 63.546 1.4664e-05 -3.53987 63.546000 Cu 0.226511 0.764963 0.5 207 63.546 1.19474e-05 -3.53985 63.546000 Cu 0.286864 0.771459 9.1002e-17 275 63.546 1.80706e-05 -3.53986 63.546000 Cu 0.312746 0.756294 0.5 276 63.546 1.32207e-05 -3.53986 63.546000 Cu 0.373092 0.762788 1 277 63.546 1.46509e-05 -3.53985 63.546000 Cu 0.433398 0.769264 0.5 279 63.546 7.10531e-05 -3.53985 63.546000 Cu 0.459287 0.754123 1 246 63.546 1.62923e-05 -3.53985 63.546000 Cu 0.519606 0.760612 0.5 252 63.546 3.11652e-05 -3.53987 63.546000 Cu 0.493701 0.775765 1 281 63.546 4.18967e-05 -3.53985 63.546000 Cu 0.579944 0.767126 1 250 63.546 3.34522e-05 -3.53987 63.546000 Cu 0.605879 0.751969 0.5 251 63.546 2.04318e-05 -3.53987 63.546000 Cu 0.640227 0.773625 0.5 256 63.546 2.04429e-05 -3.53986 63.546000 Cu 0.666202 0.758473 3.60638e-16 253 63.546 4.7105e-05 -3.53984 63.546000 Cu 0.726465 0.76496 0.5 255 63.546 2.57062e-05 -3.53984 63.546000 Cu 0.873039 0.762798 1.88745e-16 227 63.546 4.31295e-05 -3.53986 63.546000 Cu 0.812704 0.756299 0.5 229 63.546 2.4269e-05 -3.53986 63.546000 Cu 0.786802 0.771461 9.67799e-17 257 63.546 9.8948e-06 -3.53986 63.546000 Cu 0.959234 0.754119 1 230 63.546 4.24169e-05 -3.53986 63.546000 Cu 0.993678 0.775756 1 231 63.546 5.09274e-05 -3.53985 63.546000 Cu 0.933345 0.769267 0.5 233 63.546 3.30037e-05 -3.53984 63.546000 Cu 0.0539572 0.782247 0.5 237 63.546 7.91502e-05 -3.53985 63.546000 Cu 0.0280155 0.79741 1 265 63.546 3.11733e-05 -3.53985 63.546000 Cu 0.0883143 0.803903 0.5 267 63.546 4.09482e-05 -3.53985 63.546000 Cu 0.114262 0.788758 4.11676e-16 235 63.546 1.7826e-05 -3.53988 63.546000 Cu 0.20059 0.780131 1 238 63.546 7.40406e-05 -3.53988 63.546000 Cu 0.174596 0.795266 0.5 240 63.546 5.07644e-06 -3.53988 63.546000 Cu 0.234949 0.801778 1 239 63.546 2.84566e-05 -3.53988 63.546000 Cu 0.26091 0.786625 0.5 307 63.546 2.46708e-05 -3.53985 63.546000 Cu 0.32122 0.793117 1 308 63.546 9.87614e-06 -3.53985 63.546000 Cu 0.407485 0.784437 2.96599e-16 278 63.546 3.10186e-05 -3.53984 63.546000 Cu 0.347187 0.777944 0.5 280 63.546 3.93413e-05 -3.53985 63.546000 Cu 0.381486 0.799613 0.5 310 63.546 2.51359e-05 -3.53983 63.546000 Cu 0.527998 0.797422 8.23352e-17 282 63.546 3.5195e-05 -3.53987 63.546000 Cu 0.467718 0.790927 0.5 284 63.546 2.46783e-05 -3.53983 63.546000 Cu 0.553954 0.78226 0.5 283 63.546 4.22717e-05 -3.53985 63.546000 Cu 0.614257 0.788771 1 285 63.546 2.24345e-05 -3.53988 63.546000 Cu 0.588331 0.803913 0.5 288 63.546 2.62789e-05 -3.53987 63.546000 Cu 0.700555 0.780132 1 254 63.546 6.27483e-05 -3.53987 63.546000 Cu 0.7609 0.786622 0.5 260 63.546 1.12743e-05 -3.53985 63.546000 Cu 0.674617 0.795269 0.5 287 63.546 2.2823e-06 -3.53988 63.546000 Cu 0.734984 0.801775 3.59193e-16 289 63.546 3.08215e-05 -3.53988 63.546000 Cu 0.821243 0.793114 1.35299e-16 258 63.546 1.93675e-05 -3.53986 63.546000 Cu 0.847151 0.777948 0.5 259 63.546 1.4527e-05 -3.53986 63.546000 Cu 0.881532 0.799609 0.5 264 63.546 5.16445e-06 -3.53984 63.546000 Cu 0.907498 0.784439 0 261 63.546 5.81689e-05 -3.53986 63.546000 Cu 0.967762 0.790923 0.5 263 63.546 9.46639e-06 -3.53982 63.546000 Cu 0.062371 0.819063 1 266 63.546 3.85499e-05 -3.53985 63.546000 Cu 0.00212071 0.81259 0.5 268 63.546 2.89729e-05 -3.53984 63.546000 Cu 0.148632 0.810402 1.613e-16 269 63.546 4.14184e-05 -3.53988 63.546000 Cu 0.183028 0.832059 1 270 63.546 2.73513e-05 -3.53989 63.546000 Cu 0.208992 0.816919 0.5 271 63.546 2.08482e-06 -3.53988 63.546000 Cu 0.122681 0.825555 0.5 272 63.546 3.67407e-05 -3.53988 63.546000 Cu 0.295269 0.808288 0.5 311 63.546 4.31849e-05 -3.53984 63.546000 Cu 0.269352 0.823439 1 340 63.546 3.10828e-05 -3.53985 63.546000 Cu 0.329692 0.82996 0.5 342 63.546 6.6512e-05 -3.53982 63.546000 Cu 0.355576 0.814787 1 309 63.546 2.21428e-05 -3.53982 63.546000 Cu 0.415894 0.821284 0.5 315 63.546 1.68244e-05 -3.53982 63.546000 Cu 0.441789 0.806105 1.85856e-16 312 63.546 7.49292e-06 -3.53985 63.546000 Cu 0.476167 0.827767 2.80228e-16 313 63.546 3.68569e-05 -3.53982 63.546000 Cu 0.502111 0.812593 0.5 314 63.546 2.43194e-05 -3.53985 63.546000 Cu 0.648667 0.810407 0 286 63.546 3.0811e-05 -3.53988 63.546000 Cu 0.562382 0.819068 3.10562e-16 316 63.546 4.07573e-05 -3.53986 63.546000 Cu 0.622687 0.825558 0.5 318 63.546 3.40624e-05 -3.53989 63.546000 Cu 0.769352 0.823437 1 290 63.546 2.9853e-05 -3.53985 63.546000 Cu 0.709016 0.816919 0.5 292 63.546 7.62275e-06 -3.53988 63.546000 Cu 0.683023 0.832061 2.07042e-16 320 63.546 2.08705e-05 -3.53989 63.546000 Cu 0.795302 0.808282 0.5 291 63.546 2.97141e-05 -3.53984 63.546000 Cu 0.855586 0.814782 0 293 63.546 2.07442e-05 -3.53982 63.546000 Cu 0.829674 0.829958 0.5 296 63.546 6.62474e-05 -3.53982 63.546000 Cu 0.941815 0.806099 0 262 63.546 3.72672e-06 -3.53985 63.546000 Cu 0.915891 0.82128 0.5 295 63.546 1.81263e-05 -3.53982 63.546000 Cu 0.976152 0.827762 1 297 63.546 4.30431e-05 -3.53982 63.546000 Cu 0.0104635 0.849437 1 298 63.546 0.000116237 -3.53975 63.546000 Cu 0.0364244 0.834237 0.5 299 63.546 5.37755e-05 -3.53985 63.546000 Cu 0.096706 0.840707 0 301 63.546 0.000147264 -3.53987 63.546000 Cu 0.0706733 0.855895 0.5 304 63.546 0.000234816 -3.5398 63.546000 Cu 0.157012 0.847197 0.5 303 63.546 0.000131 -3.5399 63.546000 Cu 0.217355 0.8537 9.5817e-17 305 63.546 0.000119502 -3.53991 63.546000 Cu 0.24338 0.83858 0.5 273 63.546 2.59281e-05 -3.53988 63.546000 Cu 0.303772 0.845116 1.33855e-16 341 63.546 0.00011321 -3.53984 63.546000 Cu 0.27775 0.860239 0.5 374 63.546 0.000118936 -3.53989 63.546000 Cu 0.390017 0.836475 1 343 63.546 9.06041e-05 -3.53977 63.546000 Cu 0.424405 0.85819 2.7734e-16 344 63.546 0.000309226 -3.53966 63.546000 Cu 0.364156 0.851657 0.5 346 63.546 0.000316269 -3.53976 63.546000 Cu 0.536425 0.834239 0.5 319 63.546 6.47747e-05 -3.53984 63.546000 Cu 0.450283 0.842968 0.5 345 63.546 7.51473e-05 -3.53973 63.546000 Cu 0.510465 0.849439 0 347 63.546 0.000105965 -3.53975 63.546000 Cu 0.596692 0.840707 1 317 63.546 0.000164383 -3.53987 63.546000 Cu 0.656991 0.847197 0.5 323 63.546 0.000122589 -3.5399 63.546000 Cu 0.570665 0.855896 0.5 349 63.546 0.000226021 -3.5398 63.546000 Cu 0.717339 0.8537 1.52152e-16 321 63.546 0.000112458 -3.53991 63.546000 Cu 0.743361 0.838582 0.5 322 63.546 3.31134e-05 -3.53988 63.546000 Cu 0.777747 0.860242 0.5 327 63.546 0.000126989 -3.53989 63.546000 Cu 0.803752 0.845118 4.56455e-16 324 63.546 0.000116954 -3.53983 63.546000 Cu 0.864142 0.851658 0.5 326 63.546 0.000305974 -3.53975 63.546000 Cu 0.889993 0.836472 1 294 63.546 7.98586e-05 -3.53977 63.546000 Cu 0.950268 0.842965 0.5 300 63.546 6.66057e-05 -3.53974 63.546000 Cu 0.924401 0.858189 0 328 63.546 0.00029865 -3.53965 63.546000 Cu 0.044668 0.87114 1 332 63.546 0.000210936 -3.53963 63.546000 Cu 0.0188074 0.88644 0.5 335 63.546 0.000549324 -3.53939 63.546000 Cu 0.104782 0.877551 0.5 334 63.546 0.000626781 -3.53969 63.546000 Cu 0.130901 0.862344 1 302 63.546 0.000452992 -3.53984 63.546000 Cu 0.19119 0.868813 0.5 306 63.546 0.000449909 -3.5399 63.546000 Cu 0.164944 0.883946 1 336 63.546 0.00147712 -3.53974 63.546000 Cu 0.251591 0.875331 1.30966e-16 373 63.546 0.000325995 -3.53993 63.546000 Cu 0.311999 0.881922 0.5 378 63.546 0.000273128 -3.53989 63.546000 Cu 0.338157 0.866814 0 375 63.546 0.000367259 -3.5398 63.546000 Cu 0.372398 0.888549 1.62744e-16 376 63.546 0.000883831 -3.53974 63.546000 Cu 0.398455 0.873399 0.5 377 63.546 0.000687559 -3.53965 63.546000 Cu 0.544669 0.87114 4.67047e-17 348 63.546 0.000198164 -3.53964 63.546000 Cu 0.484564 0.864686 0.5 350 63.546 0.000145452 -3.5396 63.546000 Cu 0.458672 0.879948 1 379 63.546 0.000705761 -3.53951 63.546000 Cu 0.518809 0.886442 0.5 381 63.546 0.000583269 -3.5394 63.546000 Cu 0.630889 0.862341 1 351 63.546 0.000503877 -3.53985 63.546000 Cu 0.604791 0.877552 0.5 354 63.546 0.000589863 -3.53969 63.546000 Cu 0.664952 0.883946 1 352 63.546 0.00152074 -3.53974 63.546000 Cu 0.691189 0.868812 0.5 353 63.546 0.000482277 -3.5399 63.546000 Cu 0.751599 0.875332 2.49894e-16 355 63.546 0.000345494 -3.53993 63.546000 Cu 0.838166 0.866817 1 325 63.546 0.000411562 -3.5398 63.546000 Cu 0.812016 0.881926 0.5 357 63.546 0.000291621 -3.53989 63.546000 Cu 0.872417 0.888554 8.90761e-17 359 63.546 0.00094244 -3.53973 63.546000 Cu 0.958678 0.879949 1 329 63.546 0.000688269 -3.5395 63.546000 Cu 0.984564 0.864685 0.5 330 63.546 0.000134741 -3.5396 63.546000 Cu 0.898465 0.873401 0.5 331 63.546 0.000705798 -3.53964 63.546000 Cu 0.0787813 0.892834 1 333 63.546 0.000475821 -3.53939 63.546000 Cu 0.0529796 0.908213 0.5 365 63.546 0.00144284 -3.53895 63.546000 Cu 0.198827 0.905507 4.75233e-16 337 63.546 0.00477677 -3.53942 63.546000 Cu 0.13877 0.899167 0.5 339 63.546 0.00194795 -3.53943 63.546000 Cu 0.112783 0.914529 1 367 63.546 0.00119196 -3.53887 63.546000 Cu 0.225254 0.890412 0.5 338 63.546 0.00117179 -3.53986 63.546000 Cu 0.285651 0.896969 1 407 63.546 0.000402995 -3.5399 63.546000 Cu 0.259152 0.911988 0.5 410 63.546 0.00259695 -3.53974 63.546000 Cu 0.432738 0.895179 0.5 382 63.546 0.00185242 -3.5395 63.546000 Cu 0.346094 0.903607 0.5 409 63.546 0.000381011 -3.53986 63.546000 Cu 0.406634 0.910308 3.80379e-17 411 63.546 0.00203687 -3.53954 63.546000 Cu 0.492945 0.901748 5.68161e-17 380 63.546 0.00209761 -3.53924 63.546000 Cu 0.552973 0.908212 0.5 386 63.546 0.00146296 -3.53897 63.546000 Cu 0.578784 0.892836 2.68191e-16 383 63.546 0.000452332 -3.5394 63.546000 Cu 0.612782 0.914528 1 384 63.546 0.00117413 -3.53889 63.546000 Cu 0.638778 0.89917 0.5 385 63.546 0.0018616 -3.53944 63.546000 Cu 0.725264 0.890413 0.5 358 63.546 0.00120164 -3.53986 63.546000 Cu 0.698837 0.90551 1 387 63.546 0.00472393 -3.53942 63.546000 Cu 0.759165 0.911992 0.5 389 63.546 0.00259358 -3.53973 63.546000 Cu 0.785664 0.896973 1.39633e-17 356 63.546 0.000399577 -3.5399 63.546000 Cu 0.846112 0.903613 0.5 362 63.546 0.000390636 -3.53986 63.546000 Cu 0.906655 0.910315 1 360 63.546 0.00213157 -3.53954 63.546000 Cu 0.932753 0.895183 0.5 361 63.546 0.00189513 -3.53949 63.546000 Cu 0.992957 0.90175 1 363 63.546 0.00209619 -3.53922 63.546000 Cu 0.0272956 0.9236 1.20373e-16 364 63.546 0.00515218 -3.53854 63.546000 Cu 0.087167 0.930046 0.5 370 63.546 0.0045152 -3.53757 63.546000 Cu 0.00167391 0.938921 0.5 397 63.546 0.0142539 -3.53753 63.546000 Cu 0.146635 0.936206 6.74089e-18 368 63.546 0.00571812 -3.53729 63.546000 Cu 0.172584 0.920779 0.5 369 63.546 0.0046108 -3.53891 63.546000 Cu 0.206218 0.942334 0.5 372 63.546 0.0132729 -3.53795 63.546000 Cu 0.23252 0.926993 0 371 63.546 0.0153443 -3.53843 63.546000 Cu 0.31962 0.918592 8.04092e-17 408 63.546 0.000516855 -3.53981 63.546000 Cu 0.293028 0.93353 0.5 438 63.546 0.00535311 -3.5394 63.546000 Cu 0.380248 0.925287 0.5 414 63.546 0.000768956 -3.53967 63.546000 Cu 0.353767 0.940202 2.69636e-16 439 63.546 0.000785321 -3.5394 63.546000 Cu 0.441085 0.932104 0 412 63.546 0.00588403 -3.53856 63.546000 Cu 0.467087 0.917 0.5 413 63.546 0.00479734 -3.53905 63.546000 Cu 0.52728 0.923595 1 415 63.546 0.00508511 -3.53856 63.546000 Cu 0.501658 0.938915 0.5 418 63.546 0.0140875 -3.53753 63.546000 Cu 0.587159 0.930041 0.5 417 63.546 0.00447595 -3.53761 63.546000 Cu 0.646636 0.936201 1.78152e-17 419 63.546 0.00576891 -3.53731 63.546000 Cu 0.732534 0.926994 0 388 63.546 0.0152193 -3.53842 63.546000 Cu 0.672591 0.920779 0.5 390 63.546 0.00455827 -3.53892 63.546000 Cu 0.706226 0.94233 0.5 421 63.546 0.013317 -3.53796 63.546000 Cu 0.819638 0.918597 2.60969e-16 391 63.546 0.000509487 -3.53981 63.546000 Cu 0.853786 0.940204 1 392 63.546 0.00077638 -3.53939 63.546000 Cu 0.880267 0.925292 0.5 393 63.546 0.000781865 -3.53967 63.546000 Cu 0.793045 0.933531 0.5 394 63.546 0.00532797 -3.53939 63.546000 Cu 0.967107 0.917006 0.5 366 63.546 0.00491747 -3.53904 63.546000 Cu 0.941104 0.93211 1 395 63.546 0.00599392 -3.53857 63.546000 Cu 0.0618042 0.945555 1 399 63.546 0.0123474 -3.53688 63.546000 Cu 0.0958659 0.967709 1 400 63.546 0.0430933 -3.53199 63.546000 Cu 0.0364388 0.961046 0.5 402 63.546 0.0505304 -3.53193 63.546000 Cu 0.121266 0.952035 0.5 401 63.546 0.0198429 -3.53472 63.546000 Cu 0.180183 0.95779 1.9693e-16 403 63.546 0.0218515 -3.53323 63.546000 Cu 0.239588 0.963903 0.5 405 63.546 0.0502077 -3.53402 63.546000 Cu 0.26597 0.948342 1 437 63.546 0.0551158 -3.5334 63.546000 Cu 0.299608 0.969274 1 457 63.546 0.221794 -3.51653 63.546000 Cu 0.327292 0.955021 0.5 442 63.546 0.0187631 -3.53648 63.546000 Cu 0.388548 0.961824 1 440 63.546 0.0109237 -3.53715 63.546000 Cu 0.414661 0.946906 0.5 441 63.546 0.00493973 -3.53884 63.546000 Cu 0.475975 0.954008 5.27715e-16 443 63.546 0.0211928 -3.53538 63.546000 Cu 0.53643 0.961042 0.5 445 63.546 0.0503487 -3.53192 63.546000 Cu 0.448826 0.968488 0.5 446 63.546 0.059195 -3.53001 63.546000 Cu 0.561795 0.945549 1.41077e-16 416 63.546 0.012239 -3.53688 63.546000 Cu 0.62126 0.952027 0.5 422 63.546 0.019616 -3.53475 63.546000 Cu 0.59586 0.967704 4.52603e-17 447 63.546 0.0430269 -3.53197 63.546000 Cu 0.680184 0.957783 1 420 63.546 0.0219301 -3.53325 63.546000 Cu 0.765983 0.948339 1 423 63.546 0.055043 -3.53336 63.546000 Cu 0.739589 0.963899 0.5 426 63.546 0.0501026 -3.53402 63.546000 Cu 0.799605 0.96927 1.97893e-16 424 63.546 0.221909 -3.5165 63.546000 Cu 0.827304 0.955019 0.5 425 63.546 0.0187209 -3.53646 63.546000 Cu 0.888554 0.961823 1 427 63.546 0.0109301 -3.53716 63.546000 Cu 0.975986 0.954011 3.27415e-16 396 63.546 0.0212426 -3.53539 63.546000 Cu 0.914676 0.946908 0.5 398 63.546 0.00496154 -3.53883 63.546000 Cu 0.948828 0.968487 0.5 429 63.546 0.0593951 -3.52998 63.546000 Cu 0.0112079 0.976113 1.52152e-16 431 63.546 0.207365 -3.50753 63.546000 Cu 0.0703812 0.983802 0.5 433 63.546 5.71837 -3.40296 63.546000 Cu 0.154936 0.973933 0.5 406 63.546 0.775805 -3.4537 63.546000 Cu 0.13215 0.98944 0 435 63.546 11.305 -3.34863 63.546000 Cu 0.213977 0.979014 1.58892e-17 404 63.546 2.18431 -3.41118 63.546000 Cu 0.249612 0.999478 1 482 63.546 10.8573 -3.43466 63.546000 Cu 0.274543 0.984808 0.5 460 63.546 3.47782 -3.37768 63.546000 Cu 0.393175 0.999858 0.5 505 63.546 9.27112 -3.43418 63.546000 Cu 0.335279 0.989411 1 458 63.546 8.6845 -3.3988 63.546000 Cu 0.362669 0.976394 0.5 459 63.546 0.159223 -3.50264 63.546000 Cu 0.422358 0.983842 1 461 63.546 2.50456 -3.42313 63.546000 Cu 0.511208 0.976112 2.55191e-17 444 63.546 0.207059 -3.50752 63.546000 Cu 0.481581 0.989417 0.5 462 63.546 9.02156 -3.40365 63.546000 Cu 0.654928 0.973923 0.5 449 63.546 0.7784 -3.45378 63.546000 Cu 0.632158 0.989438 2.91784e-16 448 63.546 11.3073 -3.34842 63.546000 Cu 0.57039 0.983797 0.5 450 63.546 5.71971 -3.40296 63.546000 Cu 0.749581 0.999475 1 466 63.546 10.8632 -3.43457 63.546000 Cu 0.713968 0.979008 5.58531e-17 451 63.546 2.1899 -3.41126 63.546000 Cu 0.774524 0.984805 0.5 453 63.546 3.47904 -3.37762 63.546000 Cu 0.86266 0.976391 0.5 430 63.546 0.159178 -3.50273 63.546000 Cu 0.835256 0.989409 1 455 63.546 8.6863 -3.39878 63.546000 Cu 0.893147 0.999857 0.5 469 63.546 9.27286 -3.43407 63.546000 Cu 0.922342 0.983839 1 428 63.546 2.50437 -3.42318 63.546000 Cu 0.981563 0.989415 0.5 434 63.546 9.02382 -3.40355