Number of particles = 928 A = 1 Angstrom (basic length-scale) H0(1,1) = 27.5255 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 110.736 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60898 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 0.0498992 0.00423777 1 465 63.546 10.4153 -3.30057 63.546000 Cu 0.0711148 0.0237905 0.5 471 63.546 0.765487 -3.45317 63.546000 Cu 0.115483 0.0042608 0.5 467 63.546 8.47472 -3.44781 63.546000 Cu 0.132369 0.0189357 1.59822e-16 473 63.546 2.45655 -3.42674 63.546000 Cu 0.194993 0.0147025 0.5 475 63.546 8.64836 -3.36528 63.546000 Cu 0.219794 0.027676 1 474 63.546 0.162948 -3.49492 63.546000 Cu 0.2533 0.0042682 1 477 63.546 9.00571 -3.4234 63.546000 Cu 0.280313 0.0204258 0.5 479 63.546 2.50541 -3.40046 63.546000 Cu 0.338268 0.0149286 2.90805e-17 478 63.546 6.14991 -3.39831 63.546000 Cu 0.393502 0.00425254 0.5 481 63.546 8.42661 -3.32778 63.546000 Cu 0.422205 0.0232138 1 497 63.546 0.89295 -3.41388 63.546000 Cu 0.45852 0.00426088 1 480 63.546 11.9442 -3.33976 63.546000 Cu 0.488444 0.0162651 0.5 499 63.546 2.36097 -3.38016 63.546000 Cu 0.549651 0.00423777 1.20167e-19 501 63.546 10.4217 -3.3001 63.546000 Cu 0.632192 0.0189312 1.61865e-16 502 63.546 2.45076 -3.42639 63.546000 Cu 0.615292 0.0042652 0.5 503 63.546 8.47697 -3.44774 63.546000 Cu 0.570942 0.023801 0.5 504 63.546 0.770607 -3.45288 63.546000 Cu 0.753248 0.00426073 1.18124e-16 505 63.546 9.01815 -3.42399 63.546000 Cu 0.694843 0.0146885 0.5 506 63.546 8.6467 -3.36377 63.546000 Cu 0.719709 0.0276555 1.15361e-17 532 63.546 0.161861 -3.49498 63.546000 Cu 0.780256 0.0203938 0.5 534 63.546 2.49568 -3.40095 63.546000 Cu 0.838278 0.0149172 5.04703e-17 536 63.546 6.16082 -3.39761 63.546000 Cu 0.958747 0.00425614 1 464 63.546 11.9536 -3.33931 63.546000 Cu 0.98863 0.0162522 0.5 466 63.546 2.37236 -3.37921 63.546000 Cu 0.922271 0.0231811 2.9441e-17 537 63.546 0.888641 -3.41399 63.546000 Cu 0.89364 0.00424721 0.5 538 63.546 8.44019 -3.32971 63.546000 Cu 0.0124374 0.0305615 1 469 63.546 0.370301 -3.4751 63.546000 Cu 0.0963795 0.0395804 1.62106e-16 470 63.546 0.0604416 -3.5318 63.546000 Cu 0.0374539 0.0458845 0.5 472 63.546 0.0130029 -3.53724 63.546000 Cu 0.156359 0.0344573 0.5 476 63.546 0.272185 -3.51695 63.546000 Cu 0.122223 0.0552369 0.5 487 63.546 0.0454757 -3.53425 63.546000 Cu 0.183408 0.0487514 1 489 63.546 0.0190173 -3.53721 63.546000 Cu 0.244566 0.0422594 0.5 491 63.546 0.0156449 -3.53677 63.546000 Cu 0.304597 0.0359311 1 493 63.546 0.0434092 -3.5354 63.546000 Cu 0.330778 0.0505502 0.5 496 63.546 0.0186434 -3.53817 63.546000 Cu 0.390661 0.0444517 3.19645e-17 494 63.546 0.0721209 -3.53552 63.546000 Cu 0.365665 0.0288772 0.5 495 63.546 0.296761 -3.49716 63.546000 Cu 0.512342 0.0305845 3.60502e-19 498 63.546 0.370185 -3.47521 63.546000 Cu 0.451539 0.0372759 0.5 500 63.546 0.0548586 -3.53702 63.546000 Cu 0.477472 0.0522356 1.71959e-16 524 63.546 0.0275592 -3.53852 63.546000 Cu 0.537442 0.0459007 0.5 526 63.546 0.0131934 -3.53729 63.546000 Cu 0.59633 0.039584 1 528 63.546 0.0599293 -3.53169 63.546000 Cu 0.656239 0.034446 0.5 530 63.546 0.274917 -3.51669 63.546000 Cu 0.62226 0.0552307 0.5 531 63.546 0.0452909 -3.53415 63.546000 Cu 0.683409 0.0487254 6.8255e-17 529 63.546 0.0194514 -3.53721 63.546000 Cu 0.744515 0.0422257 0.5 535 63.546 0.0161825 -3.53671 63.546000 Cu 0.804528 0.0358975 9.78162e-17 533 63.546 0.0444922 -3.53524 63.546000 Cu 0.865672 0.0288423 0.5 539 63.546 0.295936 -3.49752 63.546000 Cu 0.830763 0.0505084 0.5 568 63.546 0.0193533 -3.53817 63.546000 Cu 0.977453 0.0522057 0 468 63.546 0.028294 -3.53846 63.546000 Cu 0.890643 0.0444098 0 570 63.546 0.0705095 -3.53556 63.546000 Cu 0.951576 0.0372398 0.5 571 63.546 0.0566747 -3.53694 63.546000 Cu 0.0282006 0.082665 1 482 63.546 0.000904289 -3.5397 63.546000 Cu 0.00272853 0.0674631 0.5 483 63.546 0.00487471 -3.53925 63.546000 Cu 0.0626461 0.0612247 2.27116e-17 485 63.546 0.00402536 -3.53884 63.546000 Cu 0.0882513 0.0764712 0.5 488 63.546 0.00736217 -3.53926 63.546000 Cu 0.148695 0.0700661 1 486 63.546 0.00229564 -3.53979 63.546000 Cu 0.209227 0.0636102 0.5 492 63.546 0.00109964 -3.53978 63.546000 Cu 0.269799 0.0572367 1.40716e-16 490 63.546 0.00413449 -3.53951 63.546000 Cu 0.235114 0.0785675 3.17242e-17 516 63.546 0.00038076 -3.53988 63.546000 Cu 0.295744 0.072049 0.5 518 63.546 0.00161291 -3.5397 63.546000 Cu 0.356093 0.0656815 1.22571e-17 520 63.546 0.00676816 -3.53933 63.546000 Cu 0.417109 0.0590175 0.5 522 63.546 0.00705308 -3.53832 63.546000 Cu 0.382115 0.0804897 0.5 523 63.546 0.000975203 -3.53972 63.546000 Cu 0.442592 0.073944 1 521 63.546 0.00441383 -3.53931 63.546000 Cu 0.502781 0.0674776 0.5 527 63.546 0.00484582 -3.53932 63.546000 Cu 0.528276 0.0826665 0 558 63.546 0.000844974 -3.53974 63.546000 Cu 0.562708 0.0612296 1 525 63.546 0.00410367 -3.53886 63.546000 Cu 0.588351 0.0764661 0.5 560 63.546 0.00713094 -3.53925 63.546000 Cu 0.648797 0.0700519 1 562 63.546 0.00221953 -3.5398 63.546000 Cu 0.735215 0.0785512 1.23051e-16 563 63.546 0.000383747 -3.5399 63.546000 Cu 0.709289 0.0635852 0.5 564 63.546 0.00114945 -3.5398 63.546000 Cu 0.769815 0.057206 1.37231e-16 566 63.546 0.00418535 -3.53952 63.546000 Cu 0.856113 0.0656498 1 567 63.546 0.00660465 -3.53938 63.546000 Cu 0.795809 0.0720234 0.5 569 63.546 0.00174068 -3.5397 63.546000 Cu 0.882148 0.0804728 0.5 603 63.546 0.00106132 -3.53972 63.546000 Cu 0.917097 0.0589818 0.5 572 63.546 0.0070238 -3.53833 63.546000 Cu 0.942575 0.0739253 3.43678e-17 605 63.546 0.00446687 -3.53926 63.546000 Cu 0.0538883 0.0978017 0.5 510 63.546 0.0013155 -3.53984 63.546000 Cu 0.114222 0.0914246 8.05121e-18 512 63.546 0.000841365 -3.53991 63.546000 Cu 0.200518 0.0999492 0 513 63.546 9.37577e-05 -3.53995 63.546000 Cu 0.174653 0.0849921 0.5 514 63.546 6.28634e-05 -3.53995 63.546000 Cu 0.140109 0.106384 0.5 515 63.546 0.000105223 -3.53997 63.546000 Cu 0.321486 0.0870323 1 517 63.546 0.000519906 -3.53989 63.546000 Cu 0.261011 0.0934729 0.5 519 63.546 0.000129695 -3.53994 63.546000 Cu 0.286843 0.108434 1.34227e-16 550 63.546 6.98383e-05 -3.53996 63.546000 Cu 0.347373 0.101941 0.5 552 63.546 0.000263002 -3.53992 63.546000 Cu 0.407832 0.0954502 1 554 63.546 0.00114544 -3.53988 63.546000 Cu 0.433525 0.11049 0.5 557 63.546 0.000354114 -3.53995 63.546000 Cu 0.493773 0.104113 2.47064e-16 555 63.546 0.000160938 -3.53994 63.546000 Cu 0.468145 0.0890155 0.5 556 63.546 0.00108416 -3.53983 63.546000 Cu 0.553984 0.0977892 0.5 561 63.546 0.00120126 -3.53984 63.546000 Cu 0.614342 0.0914138 1 559 63.546 0.000754983 -3.5399 63.546000 Cu 0.640227 0.106369 0.5 595 63.546 8.08793e-05 -3.53996 63.546000 Cu 0.674774 0.0849797 0.5 565 63.546 6.21661e-05 -3.53995 63.546000 Cu 0.700636 0.0999392 1 597 63.546 8.29889e-05 -3.53995 63.546000 Cu 0.761114 0.0934646 0.5 599 63.546 0.000130912 -3.53994 63.546000 Cu 0.78692 0.108434 4.75862e-17 598 63.546 7.68064e-05 -3.53997 63.546000 Cu 0.821558 0.087021 1.18124e-16 601 63.546 0.000507553 -3.53991 63.546000 Cu 0.847422 0.101943 0.5 604 63.546 0.000319673 -3.53991 63.546000 Cu 0.993713 0.104129 2.13898e-17 508 63.546 0.000166846 -3.53991 63.546000 Cu 0.968113 0.0890147 0.5 484 63.546 0.00105743 -3.53977 63.546000 Cu 0.907843 0.095451 1.20167e-19 602 63.546 0.00117929 -3.53985 63.546000 Cu 0.933494 0.11051 0.5 637 63.546 0.000333401 -3.53991 63.546000 Cu 0.079741 0.112805 2.59561e-16 509 63.546 0.00028537 -3.53997 63.546000 Cu 0.0193786 0.119202 0.5 511 63.546 0.000343747 -3.53997 63.546000 Cu 0.0451391 0.134206 1.28699e-16 542 63.546 8.44799e-05 -3.53999 63.546000 Cu 0.105524 0.127789 0.5 544 63.546 0.000109116 -3.53998 63.546000 Cu 0.16597 0.12135 1 546 63.546 7.59738e-05 -3.53996 63.546000 Cu 0.191762 0.136295 0.5 549 63.546 3.60162e-05 -3.53996 63.546000 Cu 0.25218 0.129853 3.05826e-16 547 63.546 4.7147e-05 -3.53997 63.546000 Cu 0.226395 0.114882 0.5 548 63.546 6.27818e-05 -3.53996 63.546000 Cu 0.312664 0.123385 0.5 553 63.546 7.43789e-05 -3.53996 63.546000 Cu 0.373116 0.116916 1.57659e-16 551 63.546 0.00036436 -3.53995 63.546000 Cu 0.33843 0.138363 1 585 63.546 0.000111229 -3.53998 63.546000 Cu 0.398834 0.131937 0.5 587 63.546 0.000107829 -3.53998 63.546000 Cu 0.45914 0.125531 9.56532e-17 589 63.546 0.000100955 -3.53998 63.546000 Cu 0.545278 0.134162 1 590 63.546 4.81009e-05 -3.53998 63.546000 Cu 0.519479 0.119169 0.5 591 63.546 0.000261443 -3.53996 63.546000 Cu 0.579851 0.11278 8.24348e-17 593 63.546 0.000212636 -3.53995 63.546000 Cu 0.605652 0.127761 0.5 596 63.546 8.38377e-05 -3.53998 63.546000 Cu 0.66609 0.121332 1 594 63.546 4.9767e-05 -3.53996 63.546000 Cu 0.726494 0.114875 0.5 600 63.546 7.40193e-05 -3.53997 63.546000 Cu 0.691883 0.136288 0.5 630 63.546 4.46797e-05 -3.53998 63.546000 Cu 0.752271 0.129856 8.66406e-17 632 63.546 3.11557e-05 -3.53998 63.546000 Cu 0.838434 0.138402 1 633 63.546 0.000102562 -3.53996 63.546000 Cu 0.812704 0.1234 0.5 634 63.546 0.000104139 -3.53996 63.546000 Cu 0.873116 0.116937 3.24452e-18 636 63.546 0.000372424 -3.53993 63.546000 Cu 0.959058 0.125574 1 507 63.546 9.57111e-05 -3.53997 63.546000 Cu 0.898785 0.13198 0.5 638 63.546 7.20794e-05 -3.53996 63.546000 Cu 0.0105486 0.155632 1 540 63.546 5.45772e-05 -3.53999 63.546000 Cu 0.0709049 0.149208 0.5 545 63.546 0.000127746 -3.53998 63.546000 Cu 0.0967213 0.164183 1 577 63.546 7.41179e-05 -3.53998 63.546000 Cu 0.131311 0.142763 4.80669e-19 543 63.546 7.96592e-05 -3.53997 63.546000 Cu 0.157143 0.157716 0.5 579 63.546 3.15307e-05 -3.53998 63.546000 Cu 0.217578 0.151265 8.33961e-17 581 63.546 2.00653e-05 -3.53998 63.546000 Cu 0.303823 0.159787 3.71317e-17 582 63.546 5.85485e-05 -3.53999 63.546000 Cu 0.278036 0.144802 0.5 583 63.546 9.76498e-05 -3.53997 63.546000 Cu 0.243454 0.166227 0.5 584 63.546 5.48852e-05 -3.53999 63.546000 Cu 0.424556 0.146952 2.48145e-16 586 63.546 2.82651e-05 -3.53999 63.546000 Cu 0.364209 0.153357 0.5 588 63.546 6.06143e-05 -3.53999 63.546000 Cu 0.484913 0.140561 0.5 592 63.546 3.07338e-05 -3.53999 63.546000 Cu 0.450364 0.161966 0.5 622 63.546 9.95154e-06 -3.53999 63.546000 Cu 0.51073 0.155568 6.00836e-18 624 63.546 1.96738e-05 -3.53999 63.546000 Cu 0.596909 0.164146 1 625 63.546 2.54052e-05 -3.53998 63.546000 Cu 0.57108 0.149164 0.5 626 63.546 7.54183e-05 -3.53998 63.546000 Cu 0.631466 0.142738 1.67033e-17 628 63.546 3.88e-05 -3.53998 63.546000 Cu 0.657298 0.157707 0.5 631 63.546 3.90082e-05 -3.53999 63.546000 Cu 0.717693 0.151278 8.00314e-17 629 63.546 2.92932e-05 -3.53999 63.546000 Cu 0.743499 0.166275 0.5 665 63.546 5.94891e-05 -3.53999 63.546000 Cu 0.778093 0.144833 0.5 635 63.546 0.000114271 -3.53998 63.546000 Cu 0.803819 0.159849 0 667 63.546 3.03261e-05 -3.53998 63.546000 Cu 0.864146 0.153427 0.5 669 63.546 2.24635e-05 -3.53998 63.546000 Cu 0.984777 0.140618 0.5 541 63.546 7.40662e-05 -3.53999 63.546000 Cu 0.924444 0.14702 1 671 63.546 2.49157e-05 -3.53998 63.546000 Cu 0.950194 0.162052 0.5 672 63.546 4.84311e-05 -3.53999 63.546000 Cu 0.0622183 0.185604 1 574 63.546 5.20796e-05 -3.53998 63.546000 Cu 0.036332 0.170636 0.5 575 63.546 0.000174693 -3.53999 63.546000 Cu 0.00183707 0.192062 0.5 576 63.546 0.000102104 -3.53999 63.546000 Cu 0.183039 0.172686 1.17403e-16 578 63.546 1.47382e-05 -3.53998 63.546000 Cu 0.122622 0.179139 0.5 580 63.546 9.44035e-06 -3.53998 63.546000 Cu 0.14856 0.194096 1 612 63.546 4.36422e-05 -3.53998 63.546000 Cu 0.208942 0.18765 0.5 614 63.546 2.56513e-05 -3.53998 63.546000 Cu 0.269317 0.181214 5.68391e-17 616 63.546 2.53735e-05 -3.53999 63.546000 Cu 0.329668 0.174777 0.5 618 63.546 6.00457e-05 -3.53999 63.546000 Cu 0.355573 0.18978 1 617 63.546 2.67587e-05 -3.53998 63.546000 Cu 0.389994 0.168363 2.26035e-16 620 63.546 5.64357e-05 -3.53999 63.546000 Cu 0.415887 0.183377 0.5 623 63.546 1.00836e-05 -3.53998 63.546000 Cu 0.476193 0.176968 0 621 63.546 4.00346e-05 -3.53998 63.546000 Cu 0.536545 0.170566 0.5 627 63.546 5.71728e-05 -3.53998 63.546000 Cu 0.502105 0.19197 0.5 657 63.546 2.00487e-05 -3.53998 63.546000 Cu 0.562432 0.185552 4.19384e-17 659 63.546 2.34995e-05 -3.53999 63.546000 Cu 0.648653 0.194122 1 660 63.546 7.13086e-05 -3.53999 63.546000 Cu 0.622788 0.17912 0.5 661 63.546 5.62281e-05 -3.53999 63.546000 Cu 0.68314 0.172706 4.28997e-17 663 63.546 4.31196e-05 -3.53999 63.546000 Cu 0.769251 0.181303 3.18443e-17 664 63.546 1.41789e-05 -3.53999 63.546000 Cu 0.708941 0.187712 0.5 666 63.546 3.57226e-05 -3.53998 63.546000 Cu 0.829558 0.174877 0.5 670 63.546 1.49264e-05 -3.53998 63.546000 Cu 0.855357 0.18991 1.01902e-16 702 63.546 1.36069e-05 -3.53999 63.546000 Cu 0.97598 0.177061 1.80491e-16 573 63.546 7.03172e-05 -3.53999 63.546000 Cu 0.889855 0.16846 0 668 63.546 3.48771e-05 -3.53998 63.546000 Cu 0.915664 0.183495 0.5 704 63.546 7.18842e-05 -3.53999 63.546000 Cu 0.0277377 0.207036 0 608 63.546 6.97851e-05 -3.53998 63.546000 Cu 0.0881596 0.200563 0.5 610 63.546 6.14076e-06 -3.53998 63.546000 Cu 0.0536645 0.221988 0.5 611 63.546 1.15152e-05 -3.53998 63.546000 Cu 0.114057 0.21552 2.52471e-16 609 63.546 2.84664e-05 -3.53998 63.546000 Cu 0.174451 0.209068 0.5 615 63.546 1.30202e-05 -3.53999 63.546000 Cu 0.234831 0.202622 1 613 63.546 3.01439e-05 -3.53998 63.546000 Cu 0.295206 0.196199 0.5 619 63.546 2.2723e-05 -3.53999 63.546000 Cu 0.260745 0.217602 0.5 649 63.546 1.5939e-05 -3.53998 63.546000 Cu 0.321137 0.211181 7.60659e-17 651 63.546 2.82798e-05 -3.53997 63.546000 Cu 0.40743 0.219766 1.0791e-16 652 63.546 3.28211e-05 -3.53996 63.546000 Cu 0.381471 0.204783 0.5 653 63.546 2.7167e-05 -3.53996 63.546000 Cu 0.441804 0.198379 0 655 63.546 1.23725e-05 -3.53997 63.546000 Cu 0.52806 0.206972 5.90021e-17 656 63.546 3.04331e-05 -3.53998 63.546000 Cu 0.467761 0.213375 0.5 658 63.546 2.66512e-05 -3.53996 63.546000 Cu 0.553994 0.221967 0.5 692 63.546 0.000124965 -3.53999 63.546000 Cu 0.58837 0.20054 0.5 662 63.546 6.01046e-05 -3.53999 63.546000 Cu 0.614259 0.215555 1.45402e-16 694 63.546 7.57396e-05 -3.53998 63.546000 Cu 0.674492 0.209148 0.5 696 63.546 1.3361e-05 -3.53998 63.546000 Cu 0.734722 0.202739 1 698 63.546 3.19922e-05 -3.53998 63.546000 Cu 0.760565 0.217775 0.5 701 63.546 3.14521e-05 -3.53998 63.546000 Cu 0.820834 0.211351 1 699 63.546 2.82402e-05 -3.53999 63.546000 Cu 0.795008 0.196332 0.5 700 63.546 3.59345e-05 -3.53998 63.546000 Cu 0.88113 0.204934 0.5 705 63.546 9.64384e-05 -3.53999 63.546000 Cu 0.967357 0.213485 0.5 607 63.546 3.98339e-05 -3.53999 63.546000 Cu 0.941494 0.198498 1.2197e-16 703 63.546 4.9557e-05 -3.53999 63.546000 Cu 0.907002 0.219928 0 737 63.546 3.57809e-05 -3.53999 63.546000 Cu 0.0191778 0.243422 0.5 641 63.546 2.79817e-05 -3.53998 63.546000 Cu 0.0795487 0.236955 3.68914e-17 643 63.546 1.52885e-05 -3.53998 63.546000 Cu 0.16588 0.245454 1 644 63.546 2.39988e-05 -3.53998 63.546000 Cu 0.139944 0.230489 0.5 645 63.546 1.81194e-05 -3.53999 63.546000 Cu 0.200349 0.224038 5.53971e-17 647 63.546 1.07992e-05 -3.53998 63.546000 Cu 0.286667 0.232572 4.44619e-18 648 63.546 4.47139e-05 -3.53997 63.546000 Cu 0.226278 0.239007 0.5 650 63.546 2.22193e-05 -3.53997 63.546000 Cu 0.312631 0.247547 0.5 684 63.546 8.37897e-05 -3.53995 63.546000 Cu 0.347046 0.226161 0.5 654 63.546 2.94753e-05 -3.53996 63.546000 Cu 0.372979 0.241149 1 686 63.546 5.52812e-05 -3.53996 63.546000 Cu 0.43331 0.23476 0.5 688 63.546 2.63503e-05 -3.53997 63.546000 Cu 0.493654 0.228373 2.55716e-16 690 63.546 3.56591e-05 -3.53998 63.546000 Cu 0.519471 0.243382 0.5 693 63.546 5.78186e-05 -3.53998 63.546000 Cu 0.459191 0.249774 1.68354e-16 687 63.546 3.09332e-05 -3.53997 63.546000 Cu 0.579761 0.236992 0 691 63.546 2.68498e-05 -3.53998 63.546000 Cu 0.640066 0.230593 0.5 697 63.546 2.02494e-05 -3.53998 63.546000 Cu 0.665803 0.245639 4.69854e-17 729 63.546 7.18135e-05 -3.53998 63.546000 Cu 0.700333 0.224189 6.48903e-18 695 63.546 3.67951e-05 -3.53998 63.546000 Cu 0.726119 0.239223 0.5 731 63.546 5.26541e-05 -3.53999 63.546000 Cu 0.786406 0.232794 1 733 63.546 2.04567e-05 -3.53999 63.546000 Cu 0.872568 0.241369 6.52508e-17 734 63.546 3.80451e-05 -3.53999 63.546000 Cu 0.846684 0.226363 0.5 735 63.546 3.01884e-05 -3.53999 63.546000 Cu 0.812266 0.247804 0.5 736 63.546 1.49229e-05 -3.53999 63.546000 Cu 0.993252 0.228465 1.40235e-16 606 63.546 7.11418e-05 -3.53998 63.546000 Cu 0.9329 0.234915 0.5 738 63.546 3.38692e-05 -3.53999 63.546000 Cu 0.95881 0.249907 0 639 63.546 7.54674e-05 -3.53999 63.546000 Cu 0.0451151 0.258399 4.42216e-17 640 63.546 4.16658e-05 -3.53998 63.546000 Cu 0.0710945 0.273346 0.5 676 63.546 0.000104431 -3.53995 63.546000 Cu 0.105495 0.251915 0.5 646 63.546 2.43318e-05 -3.53998 63.546000 Cu 0.131492 0.26687 1 678 63.546 3.47448e-05 -3.53996 63.546000 Cu 0.191883 0.260406 0.5 680 63.546 2.85361e-05 -3.53996 63.546000 Cu 0.217906 0.27535 2.443e-16 679 63.546 0.000217716 -3.53994 63.546000 Cu 0.252261 0.253965 1 682 63.546 6.54682e-05 -3.53995 63.546000 Cu 0.278274 0.26893 0.5 685 63.546 0.000189083 -3.53995 63.546000 Cu 0.338598 0.262537 1 683 63.546 8.18628e-05 -3.53995 63.546000 Cu 0.398892 0.256157 0.5 689 63.546 2.67778e-05 -3.53996 63.546000 Cu 0.424801 0.27117 7.24609e-17 721 63.546 0.00013338 -3.53996 63.546000 Cu 0.364493 0.277544 0.5 719 63.546 0.000144484 -3.53996 63.546000 Cu 0.485061 0.264805 0.5 723 63.546 4.80739e-05 -3.53996 63.546000 Cu 0.545294 0.258426 1.37351e-16 725 63.546 7.14778e-06 -3.53997 63.546000 Cu 0.631358 0.267084 1 726 63.546 6.83771e-05 -3.53998 63.546000 Cu 0.605543 0.252037 0.5 727 63.546 1.45765e-05 -3.53998 63.546000 Cu 0.571111 0.273475 0.5 728 63.546 8.67103e-05 -3.53997 63.546000 Cu 0.751943 0.254242 1 730 63.546 3.09816e-05 -3.53999 63.546000 Cu 0.691648 0.260674 0.5 732 63.546 7.68391e-05 -3.53999 63.546000 Cu 0.717474 0.275691 1 764 63.546 0.00011528 -3.53998 63.546000 Cu 0.777832 0.269249 0.5 766 63.546 0.00010187 -3.53998 63.546000 Cu 0.838171 0.262812 1 768 63.546 9.06465e-05 -3.53999 63.546000 Cu 0.984761 0.264872 0.5 642 63.546 5.97655e-05 -3.53998 63.546000 Cu 0.924407 0.271339 0 769 63.546 0.000178719 -3.53997 63.546000 Cu 0.898476 0.25636 0.5 770 63.546 3.94067e-05 -3.53999 63.546000 Cu 0.0106569 0.279827 1 674 63.546 0.000204682 -3.53993 63.546000 Cu 0.0969805 0.288269 0 675 63.546 0.000173266 -3.53989 63.546000 Cu 0.0364155 0.294748 0.5 677 63.546 0.000122044 -3.53985 63.546000 Cu 0.157474 0.281801 0.5 681 63.546 0.000180205 -3.53993 63.546000 Cu 0.122725 0.303171 0.5 711 63.546 0.000170966 -3.53983 63.546000 Cu 0.183305 0.29672 2.5139e-16 713 63.546 0.000434106 -3.53989 63.546000 Cu 0.243793 0.290307 0.5 715 63.546 0.000486759 -3.53994 63.546000 Cu 0.304172 0.283917 1 717 63.546 0.000293204 -3.53996 63.546000 Cu 0.329851 0.298923 0.5 720 63.546 0.00025375 -3.53996 63.546000 Cu 0.269402 0.305284 8.57994e-17 714 63.546 0.000214313 -3.53993 63.546000 Cu 0.390229 0.292562 7.90701e-17 718 63.546 0.000281298 -3.53997 63.546000 Cu 0.51085 0.27985 4.41014e-17 722 63.546 0.000147079 -3.53997 63.546000 Cu 0.450548 0.286212 0.5 724 63.546 0.000171117 -3.53997 63.546000 Cu 0.476093 0.301267 1 756 63.546 0.000119844 -3.53996 63.546000 Cu 0.536447 0.294897 0.5 758 63.546 9.81979e-05 -3.53997 63.546000 Cu 0.596808 0.288513 5.56374e-17 760 63.546 0.000157392 -3.53997 63.546000 Cu 0.657129 0.282114 0.5 762 63.546 0.000148288 -3.53997 63.546000 Cu 0.622336 0.303548 0.5 763 63.546 0.000122114 -3.53993 63.546000 Cu 0.682748 0.297129 8.20743e-17 761 63.546 0.000140122 -3.53992 63.546000 Cu 0.743146 0.290701 0.5 767 63.546 0.000134759 -3.53993 63.546000 Cu 0.80355 0.284259 0 765 63.546 0.000146823 -3.53995 63.546000 Cu 0.863971 0.277804 0.5 771 63.546 0.000162677 -3.53995 63.546000 Cu 0.829124 0.299252 0.5 800 63.546 0.000187151 -3.53986 63.546000 Cu 0.975826 0.301235 0 673 63.546 0.000136418 -3.53983 63.546000 Cu 0.889651 0.292771 4.42216e-17 802 63.546 0.000136924 -3.53989 63.546000 Cu 0.950154 0.286305 0.5 803 63.546 0.000188174 -3.53991 63.546000 Cu 0.0270123 0.331012 1 706 63.546 3.53296e-05 -3.5397 63.546000 Cu 0.00140694 0.316138 0.5 707 63.546 4.39692e-05 -3.53975 63.546000 Cu 0.0620858 0.309641 1 709 63.546 5.9422e-05 -3.53978 63.546000 Cu 0.087691 0.324525 0.5 712 63.546 0.000130122 -3.53976 63.546000 Cu 0.14834 0.318071 2.20267e-16 710 63.546 0.000327172 -3.53982 63.546000 Cu 0.208912 0.311661 0.5 716 63.546 0.000332053 -3.53989 63.546000 Cu 0.173872 0.332997 0.5 746 63.546 0.000464992 -3.53986 63.546000 Cu 0.234401 0.326632 1 748 63.546 0.000213839 -3.53992 63.546000 Cu 0.294877 0.320277 0.5 750 63.546 0.000152436 -3.53994 63.546000 Cu 0.355314 0.313938 1.21008e-16 752 63.546 0.000111054 -3.53995 63.546000 Cu 0.415715 0.307606 0.5 754 63.546 6.30297e-05 -3.53996 63.546000 Cu 0.380696 0.328978 0.5 755 63.546 6.87056e-05 -3.53995 63.546000 Cu 0.441096 0.32266 1 753 63.546 6.1012e-05 -3.53995 63.546000 Cu 0.501505 0.316308 0.5 759 63.546 4.63736e-05 -3.53994 63.546000 Cu 0.52687 0.331351 2.40335e-19 790 63.546 6.99754e-05 -3.53991 63.546000 Cu 0.561937 0.309937 0 757 63.546 7.64163e-05 -3.53994 63.546000 Cu 0.587295 0.324978 0.5 792 63.546 7.54944e-05 -3.53988 63.546000 Cu 0.647738 0.31858 9.85372e-18 794 63.546 0.000119617 -3.53984 63.546000 Cu 0.733487 0.327169 1 795 63.546 0.000182609 -3.53973 63.546000 Cu 0.708178 0.312151 0.5 796 63.546 0.000105213 -3.53983 63.546000 Cu 0.768633 0.305708 5.58778e-17 798 63.546 0.000149476 -3.53983 63.546000 Cu 0.854601 0.314209 7.53449e-17 799 63.546 9.82074e-05 -3.53977 63.546000 Cu 0.794033 0.320697 0.5 801 63.546 0.000169686 -3.53974 63.546000 Cu 0.880062 0.329155 0.5 835 63.546 0.000209134 -3.53969 63.546000 Cu 0.915194 0.307728 0.5 804 63.546 0.00014492 -3.5398 63.546000 Cu 0.94072 0.322641 1 837 63.546 0.000107709 -3.53972 63.546000 Cu 0.0525967 0.345875 0.5 742 63.546 0.000163405 -3.5397 63.546000 Cu 0.078224 0.360746 1 741 63.546 0.00051548 -3.53976 63.546000 Cu 0.113277 0.339411 1 744 63.546 0.000415737 -3.53978 63.546000 Cu 0.199349 0.347963 1.20167e-19 745 63.546 0.000418804 -3.5399 63.546000 Cu 0.138817 0.354323 0.5 747 63.546 0.000719995 -3.53985 63.546000 Cu 0.320277 0.335304 1.91186e-16 749 63.546 0.000141669 -3.53995 63.546000 Cu 0.259832 0.341629 0.5 751 63.546 0.000240578 -3.53994 63.546000 Cu 0.285173 0.356673 8.65204e-17 782 63.546 0.000121853 -3.53993 63.546000 Cu 0.345566 0.350366 0.5 784 63.546 1.35152e-05 -3.53993 63.546000 Cu 0.405973 0.344047 3.71077e-16 786 63.546 2.61416e-05 -3.53994 63.546000 Cu 0.431231 0.35911 0.5 789 63.546 1.79635e-05 -3.53992 63.546000 Cu 0.491668 0.352762 4.32602e-18 787 63.546 3.00263e-05 -3.53991 63.546000 Cu 0.466414 0.337707 0.5 788 63.546 3.04602e-05 -3.53993 63.546000 Cu 0.552095 0.34641 0.5 793 63.546 4.24612e-05 -3.53986 63.546000 Cu 0.612536 0.340027 1.29781e-17 791 63.546 8.24791e-05 -3.53979 63.546000 Cu 0.637719 0.355093 0.5 827 63.546 0.000252197 -3.53967 63.546000 Cu 0.672997 0.333615 0.5 797 63.546 0.00012973 -3.53974 63.546000 Cu 0.698212 0.348643 1 829 63.546 0.000245295 -3.53962 63.546000 Cu 0.758789 0.342172 0.5 831 63.546 0.000314542 -3.53961 63.546000 Cu 0.784082 0.357141 4.68652e-17 830 63.546 0.000430685 -3.53949 63.546000 Cu 0.819405 0.33566 0 833 63.546 0.000186446 -3.53964 63.546000 Cu 0.844779 0.350601 0.5 836 63.546 0.000327743 -3.53953 63.546000 Cu 0.991851 0.352377 0 740 63.546 7.65986e-05 -3.53962 63.546000 Cu 0.966287 0.337522 0.5 708 63.546 5.05162e-05 -3.53965 63.546000 Cu 0.905525 0.344054 1 834 63.546 0.000145151 -3.53959 63.546000 Cu 0.931043 0.358915 0.5 869 63.546 0.000113614 -3.53954 63.546000 Cu 0.0174872 0.367218 0.5 743 63.546 0.000301276 -3.53965 63.546000 Cu 0.0432408 0.382064 7.85894e-17 774 63.546 0.000765481 -3.53969 63.546000 Cu 0.103866 0.375647 0.5 776 63.546 0.00106772 -3.53981 63.546000 Cu 0.164409 0.369289 8.61599e-17 778 63.546 0.000934721 -3.53989 63.546000 Cu 0.189882 0.384328 0.5 781 63.546 0.00060324 -3.53989 63.546000 Cu 0.250158 0.378045 5.41954e-17 779 63.546 0.000106175 -3.5399 63.546000 Cu 0.224792 0.362968 0.5 780 63.546 0.000496892 -3.53992 63.546000 Cu 0.310435 0.371756 0.5 785 63.546 8.70503e-05 -3.53992 63.546000 Cu 0.37081 0.365437 1 783 63.546 3.44772e-05 -3.53994 63.546000 Cu 0.335765 0.386832 9.88977e-17 817 63.546 9.54991e-05 -3.53992 63.546000 Cu 0.396128 0.380516 0.5 819 63.546 2.62867e-05 -3.53993 63.546000 Cu 0.456501 0.374178 4.72257e-17 821 63.546 6.3704e-05 -3.53992 63.546000 Cu 0.542111 0.382966 1.35669e-16 822 63.546 0.000204773 -3.53973 63.546000 Cu 0.516882 0.367847 0.5 823 63.546 7.14113e-05 -3.53987 63.546000 Cu 0.577299 0.361491 3.58098e-17 825 63.546 0.000122682 -3.53978 63.546000 Cu 0.602434 0.376602 0.5 828 63.546 0.000477289 -3.53959 63.546000 Cu 0.662907 0.370158 1 826 63.546 0.00050171 -3.53948 63.546000 Cu 0.723445 0.363663 0.5 832 63.546 0.000464469 -3.53948 63.546000 Cu 0.688081 0.385208 0.5 862 63.546 0.00103278 -3.53927 63.546000 Cu 0.74873 0.378653 1 864 63.546 0.000951591 -3.53932 63.546000 Cu 0.83503 0.386929 1 865 63.546 0.000315974 -3.53932 63.546000 Cu 0.809459 0.372074 0.5 866 63.546 0.000694751 -3.5394 63.546000 Cu 0.870245 0.365483 1 868 63.546 0.000266717 -3.53948 63.546000 Cu 0.956692 0.373739 0 739 63.546 0.000209706 -3.53954 63.546000 Cu 0.895876 0.380318 0.5 870 63.546 0.000154758 -3.53945 63.546000 Cu 0.982508 0.388542 0.5 773 63.546 0.000623367 -3.53954 63.546000 Cu 0.00842276 0.403351 2.11254e-16 772 63.546 0.00117576 -3.5395 63.546000 Cu 0.0690687 0.396945 0.5 777 63.546 0.00171837 -3.53965 63.546000 Cu 0.0949321 0.411861 1 809 63.546 0.00541046 -3.53923 63.546000 Cu 0.129562 0.390598 1 775 63.546 0.00210057 -3.53975 63.546000 Cu 0.155131 0.405676 0.5 811 63.546 0.00107915 -3.53972 63.546000 Cu 0.215308 0.399444 1.39154e-16 813 63.546 0.000178413 -3.53983 63.546000 Cu 0.300911 0.408267 0 814 63.546 0.000127661 -3.53988 63.546000 Cu 0.275487 0.393165 0.5 815 63.546 0.000211702 -3.53988 63.546000 Cu 0.240676 0.414617 0.5 816 63.546 0.000906911 -3.53976 63.546000 Cu 0.421457 0.395593 1.43119e-16 818 63.546 0.000208609 -3.53991 63.546000 Cu 0.361158 0.401929 0.5 820 63.546 6.45704e-05 -3.53991 63.546000 Cu 0.481798 0.389274 0.5 824 63.546 0.000406435 -3.53986 63.546000 Cu 0.446825 0.410694 0.5 854 63.546 0.00200747 -3.53971 63.546000 Cu 0.506939 0.404453 3.46683e-16 856 63.546 0.000427281 -3.53956 63.546000 Cu 0.592144 0.413319 1.32184e-18 857 63.546 0.00288327 -3.5388 63.546000 Cu 0.567168 0.398129 0.5 858 63.546 0.000768792 -3.53942 63.546000 Cu 0.62757 0.391717 1.12477e-16 860 63.546 0.00125653 -3.53923 63.546000 Cu 0.652628 0.406787 0.5 863 63.546 0.00200075 -3.53891 63.546000 Cu 0.713323 0.400204 6.72937e-18 861 63.546 0.00182904 -3.53894 63.546000 Cu 0.73869 0.415101 0.5 894 63.546 0.00178681 -3.53855 63.546000 Cu 0.774139 0.393571 0.5 867 63.546 0.00100654 -3.53913 63.546000 Cu 0.799699 0.408388 8.26751e-17 896 63.546 0.000428855 -3.53899 63.546000 Cu 0.860703 0.401733 0.5 898 63.546 0.000266577 -3.53919 63.546000 Cu 0.886479 0.416472 5.43156e-17 897 63.546 0.000671368 -3.53886 63.546000 Cu 0.92165 0.395106 1 900 63.546 0.000298904 -3.53934 63.546000 Cu 0.947574 0.409842 0.5 901 63.546 0.00127866 -3.53918 63.546000 Cu 0.0603876 0.433008 1 806 63.546 0.0183351 -3.53767 63.546000 Cu 0.0343283 0.418181 0.5 807 63.546 0.00326997 -3.53928 63.546000 Cu 0.180609 0.420849 1 810 63.546 0.00051448 -3.5396 63.546000 Cu 0.120588 0.426993 0.5 812 63.546 0.00289849 -3.53928 63.546000 Cu 0.145887 0.44225 2.32404e-16 844 63.546 0.00329562 -3.53916 63.546000 Cu 0.205937 0.436108 0.5 846 63.546 0.00431642 -3.53938 63.546000 Cu 0.266239 0.429747 1 848 63.546 0.000530706 -3.53988 63.546000 Cu 0.326411 0.423383 0.5 850 63.546 0.000214992 -3.53988 63.546000 Cu 0.352154 0.438473 1.20408e-16 849 63.546 0.00274824 -3.53988 63.546000 Cu 0.386596 0.417023 0 852 63.546 0.00075685 -3.53989 63.546000 Cu 0.412306 0.432092 0.5 855 63.546 0.0102373 -3.53897 63.546000 Cu 0.47205 0.425966 1.39995e-16 853 63.546 0.00174736 -3.53897 63.546000 Cu 0.531953 0.419692 0.5 859 63.546 0.00156634 -3.53895 63.546000 Cu 0.497156 0.441352 0.5 886 63.546 0.00515677 -3.53737 63.546000 Cu 0.556816 0.435 1 888 63.546 0.0070054 -3.53737 63.546000 Cu 0.642184 0.443514 1 889 63.546 0.0102574 -3.53693 63.546000 Cu 0.617142 0.428435 0.5 890 63.546 0.00380769 -3.53834 63.546000 Cu 0.677777 0.421805 0 892 63.546 0.00375259 -3.53824 63.546000 Cu 0.764253 0.429855 2.40335e-17 893 63.546 0.000600747 -3.53848 63.546000 Cu 0.703008 0.436682 0.5 895 63.546 0.00448732 -3.53707 63.546000 Cu 0.825375 0.423151 0.5 899 63.546 0.000666211 -3.53869 63.546000 Cu 0.851048 0.437814 1 917 63.546 0.00253459 -3.53738 63.546000 Cu 0.999493 0.439369 0.5 808 63.546 0.0060921 -3.53859 63.546000 Cu 0.973548 0.424598 0 805 63.546 0.00133906 -3.5392 63.546000 Cu 0.912558 0.431095 0.5 919 63.546 0.00357741 -3.53836 63.546000 Cu 0.0259831 0.453988 4.61442e-17 840 63.546 0.0762433 -3.53059 63.546000 Cu 0.0858223 0.448233 0.5 842 63.546 0.00838363 -3.53852 63.546000 Cu 0.0513825 0.469567 0.5 843 63.546 0.0609264 -3.53071 63.546000 Cu 0.11073 0.463593 1 841 63.546 0.0150622 -3.53757 63.546000 Cu 0.170606 0.45768 0.5 847 63.546 0.0274831 -3.53757 63.546000 Cu 0.23134 0.451171 1 845 63.546 0.0028402 -3.53984 63.546000 Cu 0.291862 0.444875 0.5 851 63.546 0.00281611 -3.53979 63.546000 Cu 0.256335 0.466271 0.5 878 63.546 0.0222881 -3.53602 63.546000 Cu 0.317625 0.459872 3.51609e-16 880 63.546 0.0256809 -3.53728 63.546000 Cu 0.404753 0.469203 1.20167e-19 881 63.546 0.0689723 -3.52859 63.546000 Cu 0.37864 0.453416 0.5 882 63.546 0.0542052 -3.53314 63.546000 Cu 0.437842 0.44752 3.54493e-17 884 63.546 0.00700596 -3.53704 63.546000 Cu 0.522103 0.456937 3.48485e-18 885 63.546 0.0285968 -3.53386 63.546000 Cu 0.463263 0.463126 0.5 887 63.546 0.0145476 -3.53335 63.546000 Cu 0.548209 0.472089 0.5 907 63.546 0.0274885 -3.53431 63.546000 Cu 0.581934 0.450174 0.5 891 63.546 0.00713422 -3.53755 63.546000 Cu 0.607162 0.465443 1 909 63.546 0.0383148 -3.53326 63.546000 Cu 0.667428 0.45843 0.5 911 63.546 0.0195204 -3.53456 63.546000 Cu 0.72869 0.451301 2.65329e-16 913 63.546 0.00705818 -3.53777 63.546000 Cu 0.754012 0.466139 0.5 916 63.546 0.0219748 -3.53574 63.546000 Cu 0.815165 0.459224 0 914 63.546 0.0135462 -3.53422 63.546000 Cu 0.789752 0.444599 0.5 915 63.546 0.00212792 -3.53797 63.546000 Cu 0.877152 0.452221 0.5 920 63.546 0.0170982 -3.53615 63.546000 Cu 0.964144 0.460454 0.5 839 63.546 0.0249036 -3.53446 63.546000 Cu 0.938415 0.445806 1.38433e-16 918 63.546 0.00128866 -3.53847 63.546000 Cu 0.902453 0.466919 1 927 63.546 0.0115714 -3.53473 63.546000 Cu 0.0146815 0.489939 0.5 872 63.546 2.32989 -3.41567 63.546000 Cu 0.0771753 0.48526 9.56532e-17 873 63.546 0.619202 -3.46883 63.546000 Cu 0.16064 0.493589 4.32602e-18 874 63.546 8.91406 -3.36889 63.546000 Cu 0.134454 0.479376 0.5 875 63.546 0.260848 -3.49221 63.546000 Cu 0.195858 0.47258 2.21709e-16 876 63.546 0.0293572 -3.53677 63.546000 Cu 0.219517 0.488151 0.5 879 63.546 2.55306 -3.40177 63.546000 Cu 0.280639 0.480913 4.53872e-16 877 63.546 0.173924 -3.49293 63.546000 Cu 0.305426 0.493856 0.5 902 63.546 8.62756 -3.36373 63.546000 Cu 0.344836 0.474208 0.5 883 63.546 0.303905 -3.5127 63.546000 Cu 0.368564 0.48973 1.2245e-16 903 63.546 2.36924 -3.4169 63.546000 Cu 0.431101 0.485119 0.5 904 63.546 0.672824 -3.46471 63.546000 Cu 0.488428 0.479145 1.87701e-16 905 63.546 0.236467 -3.48929 63.546000 Cu 0.515304 0.493506 0.5 908 63.546 10.4643 -3.36178 63.546000 Cu 0.574647 0.487969 0 906 63.546 5.64907 -3.40277 63.546000 Cu 0.632935 0.480378 0.5 912 63.546 0.15659 -3.50952 63.546000 Cu 0.662063 0.493748 1 921 63.546 9.24494 -3.37156 63.546000 Cu 0.694231 0.472772 0 910 63.546 0.0755583 -3.53041 63.546000 Cu 0.720868 0.488289 0.5 922 63.546 2.19073 -3.40925 63.546000 Cu 0.779117 0.480698 1.48286e-16 923 63.546 0.179519 -3.50671 63.546000 Cu 0.866135 0.488505 1 924 63.546 2.38375 -3.40563 63.546000 Cu 0.841913 0.473262 0.5 925 63.546 0.100924 -3.52643 63.546000 Cu 0.807821 0.493826 0.5 926 63.546 8.99778 -3.37086 63.546000 Cu 0.99143 0.474521 6.00836e-17 838 63.546 0.338384 -3.50617 63.546000 Cu 0.927035 0.481249 0.5 928 63.546 0.170508 -3.48773 63.546000 Cu 0.951933 0.493951 3.60502e-19 871 63.546 8.50828 -3.35254 63.546000 Cu 0.0143853 0.5186 0.5 3 63.546 2.33819 -3.41316 63.546000 Cu 0.032229 0.5043 3.12315e-16 42 63.546 8.53196 -3.43601 63.546000 Cu 0.0767958 0.523314 1 43 63.546 0.613761 -3.46705 63.546000 Cu 0.100119 0.504283 0.5 44 63.546 9.02125 -3.34709 63.546000 Cu 0.160379 0.514972 9.49321e-17 45 63.546 8.90876 -3.36992 63.546000 Cu 0.21924 0.52039 0.5 47 63.546 2.56589 -3.40148 63.546000 Cu 0.246305 0.504271 1.0046e-16 17 63.546 9.11428 -3.4167 63.546000 Cu 0.305234 0.514682 0.5 20 63.546 8.63642 -3.36532 63.546000 Cu 0.280209 0.527625 1 49 63.546 0.174429 -3.49423 63.546000 Cu 0.368234 0.518797 1.71118e-16 18 63.546 2.3779 -3.4155 63.546000 Cu 0.385923 0.504275 0.5 19 63.546 8.59345 -3.439 63.546000 Cu 0.430765 0.523457 0.5 24 63.546 0.66774 -3.46459 63.546000 Cu 0.454121 0.504297 2.40214e-16 21 63.546 9.1147 -3.32368 63.546000 Cu 0.515047 0.515068 0.5 23 63.546 10.4407 -3.36285 63.546000 Cu 0.661787 0.514814 7.39029e-17 4 63.546 9.23705 -3.37257 63.546000 Cu 0.601814 0.504296 0.5 5 63.546 9.42898 -3.3855 63.546000 Cu 0.574327 0.52062 1.75444e-17 25 63.546 5.65964 -3.40252 63.546000 Cu 0.748138 0.504284 1.27978e-16 6 63.546 9.19871 -3.41527 63.546000 Cu 0.72056 0.520274 0.5 9 63.546 2.20574 -3.40889 63.546000 Cu 0.807601 0.514721 0.5 8 63.546 8.99798 -3.37164 63.546000 Cu 0.865784 0.520037 1 10 63.546 2.41042 -3.4053 63.546000 Cu 0.893233 0.504271 0.5 2 63.546 8.93939 -3.44181 63.546000 Cu 0.951729 0.514582 1 1 63.546 8.5041 -3.35497 63.546000 Cu 0.926615 0.52732 0.5 12 63.546 0.171774 -3.48983 63.546000 Cu 0.0252018 0.554588 3.70115e-17 15 63.546 0.0755899 -3.53007 63.546000 Cu 0.0508431 0.539003 0.5 75 63.546 0.0606463 -3.53045 63.546000 Cu 0.110104 0.544986 5.70795e-17 76 63.546 0.0148393 -3.53729 63.546000 Cu 0.195383 0.535988 1 46 63.546 0.0310429 -3.5368 63.546000 Cu 0.134086 0.529189 0.5 48 63.546 0.258807 -3.4932 63.546000 Cu 0.169874 0.550886 0.5 78 63.546 0.0287108 -3.53769 63.546000 Cu 0.316931 0.548686 1 50 63.546 0.025938 -3.53723 63.546000 Cu 0.255718 0.542275 0.5 52 63.546 0.0229815 -3.53619 63.546000 Cu 0.344329 0.534341 0.5 51 63.546 0.303412 -3.51184 63.546000 Cu 0.404203 0.539345 1.69436e-17 53 63.546 0.0715978 -3.52815 63.546000 Cu 0.377843 0.555155 0.5 56 63.546 0.0544088 -3.53263 63.546000 Cu 0.48802 0.529416 0 22 63.546 0.238198 -3.48992 63.546000 Cu 0.547675 0.536493 0.5 28 63.546 0.0280255 -3.53452 63.546000 Cu 0.462602 0.545465 0.5 55 63.546 0.0150371 -3.5331 63.546000 Cu 0.521394 0.551631 1 57 63.546 0.0297238 -3.53404 63.546000 Cu 0.606584 0.54314 0 26 63.546 0.0364334 -3.53369 63.546000 Cu 0.632544 0.528208 0.5 27 63.546 0.152575 -3.51085 63.546000 Cu 0.666719 0.550167 0.5 32 63.546 0.0180462 -3.53537 63.546000 Cu 0.693735 0.535796 7.65466e-17 29 63.546 0.072933 -3.53074 63.546000 Cu 0.753428 0.54243 0.5 31 63.546 0.0213777 -3.53622 63.546000 Cu 0.778741 0.527855 1.81453e-16 7 63.546 0.177231 -3.50814 63.546000 Cu 0.841424 0.535278 0.5 13 63.546 0.0971255 -3.52654 63.546000 Cu 0.814455 0.549352 1.23772e-17 33 63.546 0.0132616 -3.53497 63.546000 Cu 0.901854 0.541639 3.85737e-17 11 63.546 0.0120774 -3.53478 63.546000 Cu 0.990962 0.534047 4.47022e-17 14 63.546 0.341161 -3.50578 63.546000 Cu 0.963492 0.548109 0.5 16 63.546 0.0254586 -3.53447 63.546000 Cu 0.0849997 0.560347 0.5 79 63.546 0.0087261 -3.53828 63.546000 Cu 0.0592706 0.575583 1 108 63.546 0.0188302 -3.53729 63.546000 Cu 0.119322 0.581595 0.5 110 63.546 0.0028383 -3.53894 63.546000 Cu 0.144967 0.566335 1 77 63.546 0.00369943 -3.53885 63.546000 Cu 0.204828 0.572465 0.5 83 63.546 0.00498392 -3.53929 63.546000 Cu 0.230565 0.557398 1 80 63.546 0.00335938 -3.53981 63.546000 Cu 0.265012 0.57884 0 81 63.546 0.00055466 -3.53981 63.546000 Cu 0.290938 0.563696 0.5 82 63.546 0.00291037 -3.5397 63.546000 Cu 0.436948 0.561048 1.20167e-19 54 63.546 0.00664902 -3.53687 63.546000 Cu 0.351133 0.570105 5.53971e-17 84 63.546 0.00251851 -3.5398 63.546000 Cu 0.411136 0.57649 0.5 86 63.546 0.0101383 -3.53869 63.546000 Cu 0.496162 0.567234 0.5 60 63.546 0.00489374 -3.53735 63.546000 Cu 0.470718 0.582622 1 88 63.546 0.00167464 -3.53889 63.546000 Cu 0.555704 0.573577 1 58 63.546 0.00751937 -3.53764 63.546000 Cu 0.581068 0.558408 0.5 59 63.546 0.00742252 -3.53788 63.546000 Cu 0.64125 0.565081 2.12696e-16 61 63.546 0.0092455 -3.5374 63.546000 Cu 0.615888 0.580156 0.5 64 63.546 0.00381687 -3.53869 63.546000 Cu 0.727892 0.557275 0 30 63.546 0.0061358 -3.53817 63.546000 Cu 0.701945 0.57191 0.5 63 63.546 0.00421447 -3.53772 63.546000 Cu 0.763069 0.578732 5.78005e-17 65 63.546 0.00056369 -3.53886 63.546000 Cu 0.876411 0.556344 0.5 35 63.546 0.0165724 -3.53637 63.546000 Cu 0.85004 0.570768 6.87357e-17 34 63.546 0.0024607 -3.53786 63.546000 Cu 0.788861 0.56399 0.5 36 63.546 0.00189298 -3.53834 63.546000 Cu 0.937552 0.56277 5.32341e-17 37 63.546 0.0014421 -3.53854 63.546000 Cu 0.998534 0.569212 0.5 39 63.546 0.00612877 -3.53853 63.546000 Cu 0.9114 0.577484 0.5 40 63.546 0.00326284 -3.53847 63.546000 Cu 0.032899 0.590415 0.5 41 63.546 0.00336804 -3.53918 63.546000 Cu 0.0933651 0.596741 0 109 63.546 0.00560591 -3.53892 63.546000 Cu 0.00663032 0.605256 1 73 63.546 0.00109207 -3.53954 63.546000 Cu 0.179249 0.587741 1 111 63.546 0.000627629 -3.53938 63.546000 Cu 0.213471 0.609155 1.7965e-16 112 63.546 0.0002083 -3.53969 63.546000 Cu 0.153436 0.602918 0.5 114 63.546 0.00100453 -3.53949 63.546000 Cu 0.325042 0.585192 0.5 87 63.546 0.000335029 -3.53984 63.546000 Cu 0.239154 0.59397 0.5 113 63.546 0.000964912 -3.53968 63.546000 Cu 0.299238 0.600327 1 115 63.546 0.000152176 -3.53985 63.546000 Cu 0.385113 0.591576 1 85 63.546 0.000846251 -3.53986 63.546000 Cu 0.359292 0.606669 0.5 117 63.546 0.000175922 -3.53989 63.546000 Cu 0.445191 0.597901 0.5 91 63.546 0.0019508 -3.53963 63.546000 Cu 0.505201 0.604142 1 89 63.546 0.00038105 -3.53956 63.546000 Cu 0.530533 0.588893 0.5 90 63.546 0.00163291 -3.53906 63.546000 Cu 0.590605 0.595275 2.70376e-17 92 63.546 0.00288275 -3.53905 63.546000 Cu 0.650955 0.60181 0.5 94 63.546 0.00201164 -3.53926 63.546000 Cu 0.565282 0.610473 0.5 95 63.546 0.000777619 -3.53952 63.546000 Cu 0.676424 0.586793 2.24713e-17 62 63.546 0.00347815 -3.53871 63.546000 Cu 0.737194 0.593496 0.5 68 63.546 0.00175578 -3.53899 63.546000 Cu 0.711493 0.608398 7.08987e-17 96 63.546 0.00173566 -3.53935 63.546000 Cu 0.798076 0.600212 1 66 63.546 0.000411906 -3.53931 63.546000 Cu 0.824047 0.585446 0.5 67 63.546 0.000588203 -3.53902 63.546000 Cu 0.885054 0.592129 2.18584e-16 69 63.546 0.000604004 -3.53915 63.546000 Cu 0.85891 0.606878 0.5 72 63.546 0.000237374 -3.53946 63.546000 Cu 0.972263 0.583988 1 38 63.546 0.00123002 -3.53921 63.546000 Cu 0.945938 0.598757 0.5 71 63.546 0.00114674 -3.53935 63.546000 Cu 0.0671531 0.611674 0.5 142 63.546 0.00185099 -3.53958 63.546000 Cu 0.0410191 0.626575 2.11735e-16 141 63.546 0.000892366 -3.53976 63.546000 Cu 0.101411 0.632993 0.5 146 63.546 0.00105258 -3.53978 63.546000 Cu 0.127502 0.618013 1.5057e-16 143 63.546 0.00187544 -3.53958 63.546000 Cu 0.187652 0.624283 0.5 145 63.546 0.000473422 -3.53975 63.546000 Cu 0.273477 0.615436 0.5 118 63.546 0.000222607 -3.53983 63.546000 Cu 0.247783 0.630564 5.53971e-17 147 63.546 0.000128274 -3.53982 63.546000 Cu 0.307916 0.636868 0.5 149 63.546 7.06609e-05 -3.53988 63.546000 Cu 0.333638 0.62177 2.40335e-19 116 63.546 3.93306e-05 -3.53992 63.546000 Cu 0.419501 0.613021 2.23511e-17 119 63.546 0.000289253 -3.53991 63.546000 Cu 0.39385 0.628109 0.5 122 63.546 4.39897e-05 -3.53993 63.546000 Cu 0.454054 0.634459 1 120 63.546 0.00010369 -3.53992 63.546000 Cu 0.479708 0.619348 0.5 121 63.546 0.000494588 -3.53982 63.546000 Cu 0.539856 0.625657 6.1045e-17 123 63.546 0.000196747 -3.53974 63.546000 Cu 0.625507 0.616884 2.9477e-16 93 63.546 0.00152069 -3.5395 63.546000 Cu 0.600023 0.632025 0.5 125 63.546 0.000453319 -3.53972 63.546000 Cu 0.660269 0.638453 7.81087e-17 127 63.546 0.000826194 -3.53972 63.546000 Cu 0.74638 0.629954 2.00679e-17 97 63.546 0.00100875 -3.53966 63.546000 Cu 0.772171 0.615031 0.5 98 63.546 0.00105765 -3.53946 63.546000 Cu 0.685914 0.623393 0.5 99 63.546 0.00124451 -3.5396 63.546000 Cu 0.832909 0.621685 1 100 63.546 0.000299891 -3.53959 63.546000 Cu 0.806939 0.636547 0.5 103 63.546 0.000672495 -3.53971 63.546000 Cu 0.893611 0.628315 0.5 102 63.546 0.000126045 -3.53969 63.546000 Cu 0.919722 0.613512 1 70 63.546 0.000273878 -3.53955 63.546000 Cu 0.980437 0.620089 0.5 74 63.546 0.00069301 -3.53967 63.546000 Cu 0.954264 0.63491 3.60502e-19 104 63.546 0.000197272 -3.53976 63.546000 Cu 0.0148303 0.641448 0.5 106 63.546 0.000386265 -3.53981 63.546000 Cu 0.0753367 0.647926 1 175 63.546 0.000729452 -3.53984 63.546000 Cu 0.0491923 0.66282 0.5 178 63.546 0.000233456 -3.53988 63.546000 Cu 0.161723 0.639349 1.27738e-16 144 63.546 0.000861465 -3.53978 63.546000 Cu 0.221915 0.645655 0.5 150 63.546 0.000239804 -3.53981 63.546000 Cu 0.135684 0.654338 0.5 177 63.546 0.000647926 -3.53985 63.546000 Cu 0.195969 0.6607 0 179 63.546 0.000425389 -3.53985 63.546000 Cu 0.282055 0.651961 2.00439e-16 148 63.546 6.31522e-05 -3.53987 63.546000 Cu 0.368075 0.6432 1 151 63.546 3.12713e-05 -3.53991 63.546000 Cu 0.402462 0.664635 1 152 63.546 2.70597e-05 -3.53993 63.546000 Cu 0.428291 0.649557 0.5 153 63.546 2.17869e-05 -3.53993 63.546000 Cu 0.342275 0.658296 0.5 154 63.546 4.95709e-05 -3.53992 63.546000 Cu 0.514234 0.640815 0.5 126 63.546 0.000159216 -3.53988 63.546000 Cu 0.488511 0.65591 2.586e-16 155 63.546 4.7198e-05 -3.53993 63.546000 Cu 0.548718 0.662284 0.5 157 63.546 6.25968e-05 -3.53991 63.546000 Cu 0.574422 0.647161 2.20627e-16 124 63.546 0.000119089 -3.53984 63.546000 Cu 0.634589 0.65356 0.5 130 63.546 0.000237062 -3.53983 63.546000 Cu 0.694829 0.660001 2.18344e-16 128 63.546 0.000420501 -3.53985 63.546000 Cu 0.720589 0.644953 0.5 129 63.546 0.000717318 -3.53979 63.546000 Cu 0.755171 0.666485 0.5 134 63.546 0.000466899 -3.53988 63.546000 Cu 0.780999 0.651492 2.71218e-16 131 63.546 0.000619929 -3.53982 63.546000 Cu 0.867522 0.643164 7.91902e-17 101 63.546 0.000199883 -3.53978 63.546000 Cu 0.841514 0.658061 0.5 133 63.546 0.000295769 -3.53984 63.546000 Cu 0.988699 0.656304 1 105 63.546 9.70256e-05 -3.53986 63.546000 Cu 0.928134 0.649756 0.5 107 63.546 7.75335e-05 -3.53982 63.546000 Cu 0.902053 0.664627 1.24373e-16 135 63.546 0.000102242 -3.53987 63.546000 Cu 0.02309 0.677715 2.67853e-16 139 63.546 0.000102106 -3.53991 63.546000 Cu 0.109639 0.669289 5.61181e-17 176 63.546 0.000500177 -3.53989 63.546000 Cu 0.0835791 0.684211 0.5 209 63.546 0.000241981 -3.53992 63.546000 Cu 0.169999 0.675694 0.5 182 63.546 0.000377165 -3.5399 63.546000 Cu 0.144017 0.690659 0 210 63.546 0.000342533 -3.53992 63.546000 Cu 0.256198 0.667028 0.5 181 63.546 9.6267e-05 -3.53988 63.546000 Cu 0.230317 0.682063 1 180 63.546 0.00026264 -3.53991 63.546000 Cu 0.316409 0.673354 0 183 63.546 3.36639e-05 -3.53992 63.546000 Cu 0.290581 0.688407 0.5 186 63.546 8.74906e-05 -3.53993 63.546000 Cu 0.376653 0.679709 0.5 185 63.546 3.27419e-05 -3.53995 63.546000 Cu 0.43689 0.686067 1 187 63.546 4.68923e-05 -3.53996 63.546000 Cu 0.522921 0.677371 1.27137e-16 156 63.546 2.84167e-05 -3.53995 63.546000 Cu 0.4627 0.671003 0.5 158 63.546 2.66717e-05 -3.53994 63.546000 Cu 0.497154 0.692442 0.5 189 63.546 7.21191e-05 -3.53997 63.546000 Cu 0.608899 0.66866 7.00575e-17 159 63.546 7.41657e-05 -3.5399 63.546000 Cu 0.643411 0.690143 6.08046e-17 160 63.546 7.09452e-05 -3.53994 63.546000 Cu 0.583172 0.683755 0.5 162 63.546 2.68634e-05 -3.53994 63.546000 Cu 0.669135 0.675071 0.5 161 63.546 0.000161806 -3.53991 63.546000 Cu 0.72942 0.681512 5.08308e-17 163 63.546 0.00022638 -3.53992 63.546000 Cu 0.815584 0.672997 4.97493e-17 132 63.546 0.000432826 -3.5399 63.546000 Cu 0.876046 0.679537 0.5 138 63.546 0.00020643 -3.5399 63.546000 Cu 0.789745 0.687982 0.5 165 63.546 0.000338406 -3.53993 63.546000 Cu 0.936536 0.686078 5.85215e-17 136 63.546 0.000140734 -3.53989 63.546000 Cu 0.962586 0.671189 0.5 137 63.546 5.02656e-05 -3.53989 63.546000 Cu 0.997085 0.692618 0.5 140 63.546 0.000136533 -3.53989 63.546000 Cu 0.0318274 0.714026 0.5 173 63.546 9.54915e-05 -3.53984 63.546000 Cu 0.0576254 0.699126 2.2952e-17 208 63.546 0.000205799 -3.5399 63.546000 Cu 0.0924214 0.720514 1 241 63.546 0.000104715 -3.53986 63.546000 Cu 0.118116 0.705597 0.5 213 63.546 0.000360658 -3.53991 63.546000 Cu 0.17861 0.712022 3.88501e-16 211 63.546 0.000249147 -3.53993 63.546000 Cu 0.2044 0.697057 0.5 212 63.546 0.000274205 -3.53993 63.546000 Cu 0.264786 0.703431 0 214 63.546 0.000234128 -3.53995 63.546000 Cu 0.325156 0.709784 0.5 216 63.546 9.76478e-05 -3.53997 63.546000 Cu 0.239085 0.718413 0.5 217 63.546 9.7366e-05 -3.53995 63.546000 Cu 0.350853 0.694755 1 184 63.546 7.4568e-05 -3.53996 63.546000 Cu 0.411151 0.701113 0.5 190 63.546 0.000104076 -3.53998 63.546000 Cu 0.385544 0.716153 1 218 63.546 4.70156e-05 -3.53998 63.546000 Cu 0.471489 0.707493 7.90701e-17 188 63.546 9.01437e-05 -3.53997 63.546000 Cu 0.531841 0.713871 0.5 194 63.546 8.5964e-05 -3.53996 63.546000 Cu 0.55743 0.698825 1.76886e-16 191 63.546 0.00012333 -3.53996 63.546000 Cu 0.592231 0.720267 9.09666e-17 192 63.546 4.89004e-05 -3.53994 63.546000 Cu 0.617734 0.705216 0.5 193 63.546 0.000149656 -3.53995 63.546000 Cu 0.764041 0.702992 0 164 63.546 0.000223333 -3.53993 63.546000 Cu 0.703694 0.696554 0.5 166 63.546 0.000185632 -3.53995 63.546000 Cu 0.678064 0.711608 0 195 63.546 0.000189435 -3.53994 63.546000 Cu 0.738449 0.718008 0.5 197 63.546 0.000259742 -3.53992 63.546000 Cu 0.850153 0.694473 0 167 63.546 0.000429592 -3.5399 63.546000 Cu 0.884985 0.715928 7.14995e-17 168 63.546 0.000260503 -3.53985 63.546000 Cu 0.824457 0.709443 0.5 170 63.546 0.00037458 -3.5399 63.546000 Cu 0.910661 0.700993 0.5 169 63.546 0.000260035 -3.53987 63.546000 Cu 0.971248 0.707518 1 171 63.546 0.000112258 -3.53983 63.546000 Cu 0.0667694 0.73543 0.5 244 63.546 2.14497e-05 -3.53985 63.546000 Cu 0.00619411 0.728935 1 172 63.546 1.35005e-05 -3.53982 63.546000 Cu 0.127352 0.741914 1 242 63.546 0.00014504 -3.53989 63.546000 Cu 0.152971 0.726972 0.5 243 63.546 0.000176975 -3.53991 63.546000 Cu 0.213478 0.73339 2.20146e-16 245 63.546 9.31439e-05 -3.53995 63.546000 Cu 0.18787 0.748363 0.5 248 63.546 0.000211365 -3.53993 63.546000 Cu 0.299547 0.724794 0 215 63.546 5.335e-05 -3.53996 63.546000 Cu 0.273924 0.739779 0.5 247 63.546 1.85622e-05 -3.53995 63.546000 Cu 0.334364 0.746158 1.10554e-17 249 63.546 9.16909e-06 -3.53996 63.546000 Cu 0.420394 0.737546 1 219 63.546 3.00941e-05 -3.53997 63.546000 Cu 0.359968 0.731164 0.5 221 63.546 2.65336e-05 -3.53997 63.546000 Cu 0.445931 0.722522 0.5 220 63.546 3.75094e-05 -3.53997 63.546000 Cu 0.506367 0.728918 1 222 63.546 5.4835e-05 -3.53996 63.546000 Cu 0.480842 0.74393 0.5 225 63.546 2.04065e-05 -3.53997 63.546000 Cu 0.652624 0.726655 0.5 198 63.546 1.88965e-05 -3.53992 63.546000 Cu 0.566796 0.735303 0.5 224 63.546 2.83216e-05 -3.53994 63.546000 Cu 0.627231 0.741696 1.77848e-17 226 63.546 4.62458e-05 -3.53994 63.546000 Cu 0.713033 0.733042 2.05486e-17 196 63.546 6.33004e-05 -3.53992 63.546000 Cu 0.773472 0.739447 0.5 202 63.546 0.000147736 -3.53991 63.546000 Cu 0.687647 0.748091 0.5 228 63.546 4.85058e-05 -3.53993 63.546000 Cu 0.798933 0.724443 9.49321e-17 199 63.546 0.000126091 -3.5399 63.546000 Cu 0.833932 0.745878 1 200 63.546 0.000129511 -3.53992 63.546000 Cu 0.859454 0.730889 0.5 201 63.546 0.000167814 -3.53987 63.546000 Cu 0.945575 0.722425 0.5 174 63.546 0.000108698 -3.53981 63.546000 Cu 0.919996 0.737364 0 203 63.546 0.000132073 -3.53986 63.546000 Cu 0.980538 0.743854 0.5 205 63.546 5.02802e-05 -3.53984 63.546000 Cu 0.0411139 0.750352 1 274 63.546 5.42518e-06 -3.53986 63.546000 Cu 0.0154378 0.765277 0.5 207 63.546 6.08547e-05 -3.53987 63.546000 Cu 0.0759782 0.771761 9.75758e-17 275 63.546 3.98484e-05 -3.53987 63.546000 Cu 0.101679 0.756845 0.5 276 63.546 6.6446e-05 -3.53988 63.546000 Cu 0.162227 0.763313 9.6254e-17 277 63.546 0.000214743 -3.5399 63.546000 Cu 0.22275 0.769738 0.5 279 63.546 0.000174519 -3.53992 63.546000 Cu 0.248343 0.754767 1 246 63.546 7.96838e-05 -3.53995 63.546000 Cu 0.308795 0.761149 0.5 252 63.546 1.22463e-05 -3.53995 63.546000 Cu 0.283257 0.776135 9.16876e-17 281 63.546 7.77258e-05 -3.53994 63.546000 Cu 0.369265 0.767526 1 250 63.546 2.29043e-05 -3.53996 63.546000 Cu 0.394827 0.752541 0.5 251 63.546 5.35376e-06 -3.53996 63.546000 Cu 0.429737 0.773923 0.5 256 63.546 6.91985e-06 -3.53995 63.546000 Cu 0.541299 0.750327 6.93365e-17 223 63.546 5.16999e-05 -3.53997 63.546000 Cu 0.455286 0.758927 1 253 63.546 4.41427e-06 -3.53996 63.546000 Cu 0.51573 0.765323 0.5 255 63.546 6.28235e-06 -3.53996 63.546000 Cu 0.662138 0.763124 9.97388e-18 227 63.546 5.86128e-05 -3.53995 63.546000 Cu 0.60173 0.756726 0.5 229 63.546 5.77613e-05 -3.53996 63.546000 Cu 0.576169 0.771725 0 257 63.546 1.73618e-05 -3.53995 63.546000 Cu 0.748022 0.754479 0 230 63.546 3.62548e-05 -3.53993 63.546000 Cu 0.722581 0.769522 0.5 233 63.546 5.75563e-05 -3.53994 63.546000 Cu 0.782996 0.77591 1 231 63.546 2.05643e-05 -3.53993 63.546000 Cu 0.808434 0.760884 0.5 232 63.546 0.00011028 -3.53991 63.546000 Cu 0.868868 0.767301 1.04425e-16 234 63.546 0.000228224 -3.5399 63.546000 Cu 0.894409 0.752326 0.5 206 63.546 0.000120434 -3.53988 63.546000 Cu 0.954902 0.758787 1 204 63.546 0.00016671 -3.53988 63.546000 Cu 0.92934 0.773759 0.5 236 63.546 9.84902e-05 -3.53989 63.546000 Cu 0.0248336 0.801645 4.73459e-17 239 63.546 1.73225e-05 -3.53987 63.546000 Cu 0.0503575 0.786692 0.5 307 63.546 8.02836e-05 -3.53987 63.546000 Cu 0.110933 0.793152 1 308 63.546 3.29524e-05 -3.53986 63.546000 Cu 0.197132 0.78468 1.23412e-16 278 63.546 0.000101788 -3.53989 63.546000 Cu 0.136558 0.778231 0.5 280 63.546 3.498e-05 -3.53987 63.546000 Cu 0.171526 0.799605 0.5 310 63.546 2.14191e-05 -3.53988 63.546000 Cu 0.318212 0.797508 0 282 63.546 8.95631e-05 -3.53994 63.546000 Cu 0.2577 0.7911 0.5 284 63.546 9.51167e-05 -3.53992 63.546000 Cu 0.343746 0.782523 0.5 283 63.546 1.37865e-05 -3.53995 63.546000 Cu 0.404228 0.788911 0 285 63.546 1.55749e-05 -3.53995 63.546000 Cu 0.378673 0.803898 0.5 288 63.546 1.46689e-05 -3.53995 63.546000 Cu 0.490206 0.780316 2.23151e-16 254 63.546 4.15101e-06 -3.53995 63.546000 Cu 0.550673 0.786718 0.5 260 63.546 1.4752e-06 -3.53994 63.546000 Cu 0.464702 0.795312 0.5 287 63.546 3.2876e-05 -3.53995 63.546000 Cu 0.525155 0.801714 1 289 63.546 2.47885e-05 -3.53995 63.546000 Cu 0.611133 0.793118 1.04906e-16 258 63.546 7.13752e-06 -3.53994 63.546000 Cu 0.636642 0.778128 0.5 259 63.546 9.76528e-06 -3.53994 63.546000 Cu 0.671567 0.799527 0.5 264 63.546 3.45954e-06 -3.53994 63.546000 Cu 0.697095 0.78453 2.21108e-17 261 63.546 2.54249e-05 -3.53994 63.546000 Cu 0.757517 0.790935 0.5 263 63.546 3.17495e-05 -3.53994 63.546000 Cu 0.843395 0.78232 0.5 237 63.546 4.37711e-05 -3.53992 63.546000 Cu 0.817914 0.797339 1.70157e-16 265 63.546 1.11823e-05 -3.53993 63.546000 Cu 0.878324 0.803746 0.5 267 63.546 4.09511e-05 -3.53992 63.546000 Cu 0.903811 0.788741 8.30356e-17 235 63.546 0.000130612 -3.5399 63.546000 Cu 0.989818 0.780219 1 238 63.546 0.000126919 -3.53987 63.546000 Cu 0.9643 0.795193 0.5 240 63.546 5.64433e-05 -3.53989 63.546000 Cu 0.0853843 0.808088 0.5 311 63.546 4.15064e-05 -3.53988 63.546000 Cu 0.0598701 0.823054 2.90805e-16 340 63.546 3.08272e-05 -3.5399 63.546000 Cu 0.12036 0.829493 0.5 342 63.546 4.76703e-05 -3.5399 63.546000 Cu 0.145957 0.814542 0 309 63.546 1.66032e-05 -3.53989 63.546000 Cu 0.206478 0.820998 0.5 315 63.546 4.595e-05 -3.5399 63.546000 Cu 0.232094 0.806048 2.10413e-16 312 63.546 4.58179e-05 -3.53991 63.546000 Cu 0.267019 0.827432 1 313 63.546 5.86506e-05 -3.5399 63.546000 Cu 0.292595 0.812472 0.5 314 63.546 4.6389e-05 -3.53993 63.546000 Cu 0.439094 0.810294 2.38412e-16 286 63.546 1.53336e-05 -3.53995 63.546000 Cu 0.353059 0.818881 1 316 63.546 6.42164e-05 -3.53994 63.546000 Cu 0.413548 0.825275 0.5 318 63.546 1.63729e-05 -3.53994 63.546000 Cu 0.49958 0.81669 0.5 292 63.546 1.21258e-05 -3.53995 63.546000 Cu 0.474011 0.831673 3.48485e-17 320 63.546 2.4934e-05 -3.53994 63.546000 Cu 0.560071 0.823105 7.78684e-17 290 63.546 3.68323e-05 -3.53994 63.546000 Cu 0.585601 0.808114 0.5 291 63.546 6.33392e-06 -3.53995 63.546000 Cu 0.646064 0.81452 8.05121e-18 293 63.546 1.33887e-05 -3.53994 63.546000 Cu 0.620512 0.829507 0.5 296 63.546 2.65602e-05 -3.53994 63.546000 Cu 0.731998 0.805933 3.0907e-16 262 63.546 5.56132e-06 -3.53993 63.546000 Cu 0.706493 0.820937 0.5 295 63.546 5.70439e-05 -3.53992 63.546000 Cu 0.766961 0.827338 1 297 63.546 2.96867e-05 -3.53991 63.546000 Cu 0.852846 0.818748 1 266 63.546 3.47967e-05 -3.53991 63.546000 Cu 0.792409 0.812344 0.5 268 63.546 3.03578e-05 -3.53992 63.546000 Cu 0.938778 0.810166 1.18004e-16 269 63.546 8.99004e-05 -3.5399 63.546000 Cu 0.973806 0.831578 6.86155e-17 270 63.546 8.2226e-05 -3.53991 63.546000 Cu 0.999313 0.816595 0.5 271 63.546 8.9028e-05 -3.53989 63.546000 Cu 0.913329 0.825156 0.5 272 63.546 4.36699e-05 -3.53991 63.546000 Cu 0.0342846 0.838011 0.5 273 63.546 0.000119743 -3.53989 63.546000 Cu 0.0948446 0.84446 1 341 63.546 4.18318e-05 -3.5399 63.546000 Cu 0.0693699 0.85942 0.5 374 63.546 4.04565e-05 -3.5399 63.546000 Cu 0.0088306 0.852997 1 305 63.546 6.78163e-05 -3.5399 63.546000 Cu 0.180935 0.83594 1 343 63.546 1.97628e-05 -3.53987 63.546000 Cu 0.216027 0.857325 6.2487e-18 344 63.546 5.39867e-05 -3.53988 63.546000 Cu 0.155438 0.850886 0.5 346 63.546 3.19214e-05 -3.53989 63.546000 Cu 0.327568 0.833854 0.5 319 63.546 4.74923e-05 -3.5399 63.546000 Cu 0.241551 0.842386 0.5 345 63.546 5.37355e-05 -3.53987 63.546000 Cu 0.302082 0.848817 5.20324e-17 347 63.546 5.20182e-05 -3.53989 63.546000 Cu 0.38805 0.840261 2.81912e-16 317 63.546 1.68586e-05 -3.53992 63.546000 Cu 0.36258 0.855246 0.5 349 63.546 5.6236e-05 -3.53991 63.546000 Cu 0.448515 0.846663 0.5 323 63.546 3.65048e-06 -3.53993 63.546000 Cu 0.50897 0.853059 1.2197e-16 321 63.546 2.17706e-05 -3.53993 63.546000 Cu 0.534473 0.838073 0.5 322 63.546 5.2732e-05 -3.53993 63.546000 Cu 0.59499 0.844486 1.70878e-16 324 63.546 1.98435e-05 -3.53993 63.546000 Cu 0.655538 0.850885 0.5 326 63.546 2.70441e-05 -3.53993 63.546000 Cu 0.569484 0.859458 0.5 327 63.546 1.4498e-05 -3.53993 63.546000 Cu 0.681021 0.835915 5.86416e-17 294 63.546 2.47348e-05 -3.53991 63.546000 Cu 0.741575 0.842335 0.5 300 63.546 8.24097e-05 -3.5399 63.546000 Cu 0.716088 0.857304 1.46244e-16 328 63.546 5.66545e-05 -3.53992 63.546000 Cu 0.80205 0.848749 1 298 63.546 3.98204e-05 -3.53989 63.546000 Cu 0.827464 0.833753 0.5 299 63.546 1.34353e-05 -3.53989 63.546000 Cu 0.887915 0.840162 1 301 63.546 4.59281e-06 -3.53989 63.546000 Cu 0.862513 0.855172 0.5 304 63.546 2.08771e-05 -3.5399 63.546000 Cu 0.948364 0.846578 0.5 303 63.546 1.93784e-05 -3.5399 63.546000 Cu 0.0438591 0.874394 1.78809e-16 373 63.546 0.000122718 -3.53994 63.546000 Cu 0.104376 0.880816 0.5 378 63.546 2.80427e-05 -3.53992 63.546000 Cu 0.129943 0.865848 1 375 63.546 3.04355e-05 -3.53992 63.546000 Cu 0.164928 0.887238 1.10554e-16 376 63.546 3.87048e-05 -3.53991 63.546000 Cu 0.190459 0.872285 0.5 377 63.546 1.38008e-05 -3.5399 63.546000 Cu 0.276541 0.863782 0.5 350 63.546 3.29589e-05 -3.53989 63.546000 Cu 0.250982 0.878727 0 379 63.546 2.2216e-05 -3.53988 63.546000 Cu 0.311557 0.885189 0.5 381 63.546 5.84932e-05 -3.53987 63.546000 Cu 0.337058 0.870222 2.76385e-17 348 63.546 6.98479e-05 -3.53989 63.546000 Cu 0.423038 0.861655 5.17921e-17 351 63.546 2.36375e-05 -3.53993 63.546000 Cu 0.397593 0.876655 0.5 354 63.546 0.000128161 -3.53992 63.546000 Cu 0.457999 0.883061 1.51411e-17 352 63.546 9.50868e-05 -3.53994 63.546000 Cu 0.483506 0.868049 0.5 353 63.546 2.81904e-05 -3.53994 63.546000 Cu 0.543955 0.874436 8.91641e-17 355 63.546 6.4339e-05 -3.53994 63.546000 Cu 0.630035 0.865865 1 325 63.546 1.87887e-05 -3.53995 63.546000 Cu 0.604472 0.880841 0.5 357 63.546 1.9092e-05 -3.53993 63.546000 Cu 0.665015 0.887249 0 359 63.546 3.8292e-05 -3.53991 63.546000 Cu 0.751042 0.878717 2.20747e-16 329 63.546 1.63955e-05 -3.5399 63.546000 Cu 0.77657 0.863748 0.5 330 63.546 5.39515e-05 -3.53991 63.546000 Cu 0.690536 0.872286 0.5 331 63.546 1.77769e-05 -3.53992 63.546000 Cu 0.837055 0.87018 2.40335e-19 332 63.546 6.23851e-05 -3.53988 63.546000 Cu 0.811587 0.885171 0.5 335 63.546 0.000100646 -3.53988 63.546000 Cu 0.897553 0.876607 0.5 334 63.546 7.97157e-05 -3.5399 63.546000 Cu 0.922956 0.861588 1 302 63.546 1.1241e-05 -3.5399 63.546000 Cu 0.983414 0.867989 0.5 306 63.546 9.11829e-05 -3.53993 63.546000 Cu 0.957932 0.883021 0 336 63.546 9.03142e-05 -3.53993 63.546000 Cu 0.018345 0.889385 0.5 338 63.546 0.000338059 -3.53995 63.546000 Cu 0.0788388 0.895779 1.04065e-16 407 63.546 0.000248524 -3.53993 63.546000 Cu 0.0532516 0.910761 0.5 410 63.546 0.00144344 -3.53987 63.546000 Cu 0.139344 0.902198 0.5 409 63.546 4.36005e-05 -3.53992 63.546000 Cu 0.199852 0.908617 1 411 63.546 0.00010108 -3.5399 63.546000 Cu 0.225452 0.893685 0.5 382 63.546 2.76356e-05 -3.53988 63.546000 Cu 0.285988 0.900126 1.39514e-16 380 63.546 8.51251e-05 -3.53988 63.546000 Cu 0.260445 0.915084 0.5 413 63.546 0.000187033 -3.53987 63.546000 Cu 0.372104 0.891653 1.60303e-16 383 63.546 0.000277748 -3.53986 63.546000 Cu 0.407219 0.913094 2.16541e-16 384 63.546 0.000973336 -3.53976 63.546000 Cu 0.432604 0.898086 0.5 385 63.546 0.000366115 -3.53988 63.546000 Cu 0.346626 0.906612 0.5 386 63.546 0.000221193 -3.53978 63.546000 Cu 0.518436 0.88942 0.5 358 63.546 0.000230062 -3.53994 63.546000 Cu 0.493002 0.90446 1 387 63.546 0.000179436 -3.53992 63.546000 Cu 0.553335 0.910775 0.5 389 63.546 0.00134138 -3.53986 63.546000 Cu 0.578935 0.895801 5.15518e-17 356 63.546 0.000198026 -3.53992 63.546000 Cu 0.639432 0.90221 0.5 362 63.546 3.18775e-05 -3.53991 63.546000 Cu 0.699926 0.908622 1 360 63.546 0.000100649 -3.5399 63.546000 Cu 0.725516 0.893684 0.5 361 63.546 2.84929e-05 -3.53989 63.546000 Cu 0.760495 0.915084 0.5 366 63.546 0.000175696 -3.53988 63.546000 Cu 0.786026 0.900121 1 363 63.546 8.2374e-05 -3.53989 63.546000 Cu 0.872097 0.891634 0 333 63.546 0.000349452 -3.53983 63.546000 Cu 0.846644 0.906605 0.5 365 63.546 0.000267298 -3.53977 63.546000 Cu 0.992934 0.904442 1 337 63.546 0.000176074 -3.5399 63.546000 Cu 0.932558 0.898061 0.5 339 63.546 0.000300598 -3.53985 63.546000 Cu 0.90721 0.913092 2.67973e-17 367 63.546 0.00111977 -3.53973 63.546000 Cu 0.0278403 0.925887 1.74723e-16 371 63.546 0.00103049 -3.53971 63.546000 Cu 0.0879599 0.932074 0.5 438 63.546 0.00851119 -3.53936 63.546000 Cu 0.00259426 0.941085 0.5 372 63.546 0.00545087 -3.53925 63.546000 Cu 0.11372 0.917147 1.92268e-17 408 63.546 0.00068502 -3.53989 63.546000 Cu 0.17422 0.923573 0.5 414 63.546 3.99649e-05 -3.53992 63.546000 Cu 0.148484 0.938504 1 439 63.546 0.00207326 -3.53977 63.546000 Cu 0.234727 0.929984 1 412 63.546 0.000471524 -3.53985 63.546000 Cu 0.320995 0.921504 1.59101e-16 415 63.546 0.000711309 -3.53983 63.546000 Cu 0.295466 0.936486 0.5 418 63.546 0.0015082 -3.53962 63.546000 Cu 0.355968 0.942847 2.25794e-16 416 63.546 0.0064507 -3.53929 63.546000 Cu 0.381749 0.928045 0.5 417 63.546 0.0009013 -3.53955 63.546000 Cu 0.442385 0.934589 8.82028e-17 419 63.546 0.00428304 -3.53915 63.546000 Cu 0.527914 0.925888 1 388 63.546 0.00101524 -3.53974 63.546000 Cu 0.467661 0.919535 0.5 390 63.546 0.00117423 -3.53976 63.546000 Cu 0.502646 0.941071 0.5 421 63.546 0.00535011 -3.53931 63.546000 Cu 0.613814 0.917156 0 391 63.546 0.00063181 -3.53987 63.546000 Cu 0.648553 0.938511 7.54651e-17 392 63.546 0.00205501 -3.53976 63.546000 Cu 0.588037 0.932074 0.5 394 63.546 0.00849115 -3.53932 63.546000 Cu 0.674301 0.923581 0.5 393 63.546 5.38306e-05 -3.53992 63.546000 Cu 0.734778 0.929991 1 395 63.546 0.000449809 -3.53987 63.546000 Cu 0.82102 0.921507 1 364 63.546 0.000711996 -3.53985 63.546000 Cu 0.881739 0.928053 0.5 370 63.546 0.00095197 -3.53955 63.546000 Cu 0.795475 0.936496 0.5 397 63.546 0.0015208 -3.53963 63.546000 Cu 0.855947 0.942864 4.80669e-19 399 63.546 0.00634472 -3.53933 63.546000 Cu 0.94235 0.934602 1 368 63.546 0.00444408 -3.53911 63.546000 Cu 0.967615 0.919531 0.5 369 63.546 0.00111818 -3.5397 63.546000 Cu 0.0375537 0.962639 0.5 405 63.546 0.0132593 -3.53761 63.546000 Cu 0.0625559 0.947328 1 437 63.546 0.00364533 -3.53893 63.546000 Cu 0.0966267 0.968956 0 456 63.546 0.0581427 -3.53221 63.546000 Cu 0.122226 0.953314 0.5 442 63.546 0.0454771 -3.53456 63.546000 Cu 0.183481 0.959807 1 440 63.546 0.018964 -3.53711 63.546000 Cu 0.20911 0.944945 0.5 441 63.546 0.00116992 -3.53978 63.546000 Cu 0.269773 0.951293 1 443 63.546 0.00424956 -3.53947 63.546000 Cu 0.330803 0.957964 0.5 445 63.546 0.0180118 -3.5381 63.546000 Cu 0.244705 0.966281 0.5 446 63.546 0.0165749 -3.53667 63.546000 Cu 0.417016 0.949511 0.5 422 63.546 0.0071635 -3.53808 63.546000 Cu 0.390694 0.964055 1 447 63.546 0.0745666 -3.53533 63.546000 Cu 0.451619 0.971236 0.5 449 63.546 0.054999 -3.53685 63.546000 Cu 0.477461 0.95629 3.45481e-16 420 63.546 0.0274149 -3.53838 63.546000 Cu 0.5375 0.962625 0.5 426 63.546 0.0133481 -3.53757 63.546000 Cu 0.562594 0.94732 0 423 63.546 0.00382103 -3.53893 63.546000 Cu 0.596512 0.96895 1.52132e-16 424 63.546 0.0578383 -3.53206 63.546000 Cu 0.62223 0.95331 0.5 425 63.546 0.0458594 -3.53443 63.546000 Cu 0.769742 0.951308 1 396 63.546 0.00437871 -3.53949 63.546000 Cu 0.709133 0.94496 0.5 398 63.546 0.00126606 -3.5398 63.546000 Cu 0.683431 0.959821 1 427 63.546 0.0192466 -3.53714 63.546000 Cu 0.744611 0.966303 0.5 429 63.546 0.0171 -3.53666 63.546000 Cu 0.830756 0.957985 0.5 402 63.546 0.0180514 -3.53811 63.546000 Cu 0.890668 0.964082 7.28214e-17 400 63.546 0.0731193 -3.53533 63.546000 Cu 0.916977 0.949535 0.5 401 63.546 0.00695719 -3.53806 63.546000 Cu 0.977449 0.956312 3.24452e-17 403 63.546 0.0280126 -3.53835 63.546000 Cu 0.951666 0.971259 0.5 406 63.546 0.0569731 -3.53673 63.546000 Cu 0.0712311 0.984702 0.5 459 63.546 0.760854 -3.45402 63.546000 Cu 0.0126345 0.977948 2.16421e-16 404 63.546 0.368584 -3.47514 63.546000 Cu 0.13261 0.989591 1 457 63.546 2.47038 -3.42665 63.546000 Cu 0.15658 0.974074 0.5 458 63.546 0.267523 -3.51718 63.546000 Cu 0.220061 0.980859 1 460 63.546 0.16572 -3.49608 63.546000 Cu 0.195109 0.993858 0.5 462 63.546 8.64851 -3.36698 63.546000 Cu 0.30476 0.972593 4.80669e-19 444 63.546 0.0425885 -3.53524 63.546000 Cu 0.280479 0.988108 0.5 461 63.546 2.52994 -3.39998 63.546000 Cu 0.33838 0.993581 1 463 63.546 6.15102 -3.39857 63.546000 Cu 0.422301 0.985281 1.59943e-16 448 63.546 0.89665 -3.4145 63.546000 Cu 0.365745 0.979624 0.5 450 63.546 0.296109 -3.4972 63.546000 Cu 0.512502 0.977942 6.71735e-17 451 63.546 0.366746 -3.4754 63.546000 Cu 0.488516 0.992223 0.5 453 63.546 2.36595 -3.38214 63.546000 Cu 0.656409 0.974081 0.5 430 63.546 0.271056 -3.51705 63.546000 Cu 0.571029 0.9847 0.5 452 63.546 0.762699 -3.45406 63.546000 Cu 0.632395 0.989598 2.19666e-16 454 63.546 2.45975 -3.42653 63.546000 Cu 0.719931 0.980874 2.74582e-16 428 63.546 0.163145 -3.49635 63.546000 Cu 0.694928 0.993871 0.5 455 63.546 8.64614 -3.36565 63.546000 Cu 0.780406 0.988128 0.5 434 63.546 2.51851 -3.40068 63.546000 Cu 0.804674 0.972609 2.68454e-16 431 63.546 0.0438345 -3.53515 63.546000 Cu 0.838394 0.99358 1.80732e-16 432 63.546 6.16244 -3.3979 63.546000 Cu 0.865748 0.979646 0.5 433 63.546 0.296098 -3.49744 63.546000 Cu 0.922373 0.985294 1.20167e-19 435 63.546 0.896617 -3.41483 63.546000 Cu 0.98873 0.992217 0.5 436 63.546 2.38831 -3.38127