Number of particles = 900 A = 1 Angstrom (basic length-scale) H0(1,1) = 38.5014 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.26 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.64523 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 0.0431977 0.0205999 0.75 542 63.546 0.451328 -2.52335 63.546000 Cu 0.00760933 0.0328196 0.25 540 63.546 0.0691705 -2.54246 63.546000 Cu 0.0789692 0.00630291 0.25 544 63.546 0.296425 -2.54484 63.546000 Cu 0.110493 0.0230476 0.75 543 63.546 0.0240664 -2.56212 63.546000 Cu 0.145975 0.00716295 0.25 546 63.546 0.0113394 -2.56368 63.546000 Cu 0.177343 0.0238204 0.75 584 63.546 0.00393633 -2.56414 63.546000 Cu 0.212665 0.00751613 0.25 586 63.546 0.00885741 -2.56468 63.546000 Cu 0.244021 0.024254 0.75 585 63.546 0.00305797 -2.56416 63.546000 Cu 0.279359 0.00778821 0.25 588 63.546 0.00920262 -2.56424 63.546000 Cu 0.310604 0.0246563 0.75 634 63.546 0.00363183 -2.56298 63.546000 Cu 0.377016 0.025318 0.75 635 63.546 0.0196366 -2.55956 63.546000 Cu 0.346088 0.00808654 0.25 636 63.546 0.0120091 -2.562 63.546000 Cu 0.412791 0.00882178 0.25 638 63.546 0.0826205 -2.55114 63.546000 Cu 0.442861 0.027437 0.75 692 63.546 0.0886874 -2.5492 63.546000 Cu 0.507541 0.0327698 0.75 693 63.546 0.0727092 -2.5415 63.546000 Cu 0.478183 0.0124987 0.25 694 63.546 0.2503 -2.5081 63.546000 Cu 0.543174 0.0206249 0.25 456 63.546 0.456643 -2.5215 63.546000 Cu 0.578981 0.00639524 0.75 455 63.546 0.303809 -2.54401 63.546000 Cu 0.610506 0.0231803 0.25 462 63.546 0.0257072 -2.56205 63.546000 Cu 0.646027 0.00733146 0.75 464 63.546 0.0125359 -2.56364 63.546000 Cu 0.677367 0.0239951 0.25 466 63.546 0.00429025 -2.56404 63.546000 Cu 0.71272 0.00768693 0.75 465 63.546 0.00929861 -2.56461 63.546000 Cu 0.744061 0.0244162 0.25 480 63.546 0.00313759 -2.56408 63.546000 Cu 0.779403 0.00793652 0.75 482 63.546 0.00930878 -2.56419 63.546000 Cu 0.846128 0.00821463 0.75 483 63.546 0.012067 -2.562 63.546000 Cu 0.810658 0.0247959 0.25 484 63.546 0.00376422 -2.56293 63.546000 Cu 0.877073 0.0254345 0.25 506 63.546 0.0199766 -2.5596 63.546000 Cu 0.91282 0.00893362 0.75 508 63.546 0.0821086 -2.55099 63.546000 Cu 0.978188 0.0125828 0.75 509 63.546 0.248888 -2.50769 63.546000 Cu 0.942894 0.027543 0.25 510 63.546 0.0862652 -2.54938 63.546000 Cu 0.0744808 0.038309 0.25 545 63.546 0.106942 -2.5567 63.546000 Cu 0.0386954 0.0525634 0.75 539 63.546 0.0862206 -2.55239 63.546000 Cu 0.0699534 0.070623 0.25 578 63.546 0.044831 -2.56163 63.546000 Cu 0.00341333 0.0661487 0.25 541 63.546 0.012243 -2.55876 63.546000 Cu 0.105842 0.0555428 0.75 580 63.546 0.02358 -2.56299 63.546000 Cu 0.141657 0.0398883 0.25 582 63.546 0.00725423 -2.56375 63.546000 Cu 0.136934 0.0726386 0.25 583 63.546 0.00781793 -2.56455 63.546000 Cu 0.172723 0.0567382 0.75 581 63.546 0.00239087 -2.56445 63.546000 Cu 0.208442 0.0405842 0.25 587 63.546 0.00132252 -2.56423 63.546000 Cu 0.203667 0.0736633 0.25 628 63.546 0.000936978 -2.56467 63.546000 Cu 0.239373 0.0574557 0.75 630 63.546 0.000606982 -2.56416 63.546000 Cu 0.305804 0.0581374 0.75 631 63.546 0.00192569 -2.56345 63.546000 Cu 0.275026 0.0411148 0.25 632 63.546 0.00119167 -2.56363 63.546000 Cu 0.341424 0.0417588 0.25 637 63.546 0.00587271 -2.5623 63.546000 Cu 0.372003 0.0592346 0.75 688 63.546 0.0144578 -2.56228 63.546000 Cu 0.437821 0.0617144 0.75 689 63.546 0.0295717 -2.56079 63.546000 Cu 0.407504 0.043192 0.25 690 63.546 0.0383824 -2.55893 63.546000 Cu 0.473007 0.0468892 0.25 695 63.546 0.0356512 -2.55658 63.546000 Cu 0.503365 0.0661125 0.75 750 63.546 0.0131652 -2.55822 63.546000 Cu 0.57444 0.0383914 0.75 460 63.546 0.11044 -2.55646 63.546000 Cu 0.538636 0.0525895 0.25 458 63.546 0.0882789 -2.55175 63.546000 Cu 0.569903 0.0706942 0.75 457 63.546 0.0460516 -2.56147 63.546000 Cu 0.605806 0.055659 0.25 463 63.546 0.0247507 -2.56293 63.546000 Cu 0.641649 0.0400386 0.75 461 63.546 0.00786694 -2.56366 63.546000 Cu 0.636897 0.0727804 0.75 474 63.546 0.00837232 -2.5646 63.546000 Cu 0.672703 0.0568999 0.25 476 63.546 0.00267316 -2.56445 63.546000 Cu 0.703655 0.0738345 0.75 475 63.546 0.00109759 -2.56468 63.546000 Cu 0.70845 0.0407527 0.75 478 63.546 0.00138739 -2.56418 63.546000 Cu 0.739387 0.0576215 0.25 481 63.546 0.000628377 -2.56412 63.546000 Cu 0.775069 0.0412681 0.75 479 63.546 0.00121398 -2.56354 63.546000 Cu 0.805844 0.0582759 0.25 502 63.546 0.00187371 -2.56334 63.546000 Cu 0.84148 0.041881 0.75 504 63.546 0.00598411 -2.56225 63.546000 Cu 0.907545 0.0432909 0.75 505 63.546 0.0383841 -2.55911 63.546000 Cu 0.872051 0.0593358 0.25 507 63.546 0.0147786 -2.5623 63.546000 Cu 0.937862 0.0617933 0.25 536 63.546 0.0289963 -2.56098 63.546000 Cu 0.97304 0.0469651 0.75 538 63.546 0.0334016 -2.557 63.546000 Cu 0.0343271 0.0850944 0.75 576 63.546 0.0230345 -2.56104 63.546000 Cu 0.0654355 0.103217 0.25 579 63.546 0.0197774 -2.56404 63.546000 Cu 0.101158 0.0881531 0.75 577 63.546 0.0169097 -2.56439 63.546000 Cu 0.132199 0.105471 0.25 624 63.546 0.00673916 -2.56539 63.546000 Cu 0.167924 0.0896957 0.75 626 63.546 0.00278267 -2.56514 63.546000 Cu 0.198828 0.106786 0.25 629 63.546 0.00104194 -2.56518 63.546000 Cu 0.234508 0.0906776 0.75 627 63.546 0.000369108 -2.56466 63.546000 Cu 0.270165 0.0744493 0.25 633 63.546 0.000630621 -2.56415 63.546000 Cu 0.265291 0.107789 0.25 682 63.546 0.000412522 -2.56471 63.546000 Cu 0.300903 0.0916052 0.75 684 63.546 0.00159605 -2.56433 63.546000 Cu 0.367129 0.09296 0.75 685 63.546 0.0101097 -2.56419 63.546000 Cu 0.336477 0.0754046 0.25 686 63.546 0.00496657 -2.56369 63.546000 Cu 0.331616 0.108952 0.25 687 63.546 0.00404253 -2.56465 63.546000 Cu 0.402541 0.0771574 0.25 691 63.546 0.0198169 -2.56317 63.546000 Cu 0.43309 0.0954772 0.75 746 63.546 0.0138845 -2.56408 63.546000 Cu 0.397753 0.110849 0.25 744 63.546 0.0115889 -2.56484 63.546000 Cu 0.468348 0.0805345 0.25 748 63.546 0.0123765 -2.56297 63.546000 Cu 0.534287 0.0851193 0.25 459 63.546 0.023001 -2.5607 63.546000 Cu 0.49897 0.0993404 0.75 747 63.546 0.00353704 -2.56294 63.546000 Cu 0.56538 0.103294 0.75 470 63.546 0.0203129 -2.56397 63.546000 Cu 0.6011 0.0882701 0.25 472 63.546 0.0181023 -2.56445 63.546000 Cu 0.632146 0.105621 0.75 471 63.546 0.0077476 -2.5654 63.546000 Cu 0.667903 0.0898533 0.25 477 63.546 0.00296899 -2.56515 63.546000 Cu 0.698822 0.106942 0.75 496 63.546 0.00111147 -2.56516 63.546000 Cu 0.765304 0.107939 0.75 497 63.546 0.000401259 -2.5647 63.546000 Cu 0.734509 0.0908414 0.25 498 63.546 0.000419749 -2.56464 63.546000 Cu 0.770186 0.0746076 0.75 500 63.546 0.000590952 -2.56406 63.546000 Cu 0.836505 0.0755245 0.75 501 63.546 0.00495458 -2.56361 63.546000 Cu 0.800921 0.0917451 0.25 503 63.546 0.00152019 -2.56426 63.546000 Cu 0.831636 0.109074 0.75 530 63.546 0.00398372 -2.56461 63.546000 Cu 0.867156 0.0930579 0.25 532 63.546 0.0104182 -2.56416 63.546000 Cu 0.902577 0.0772402 0.75 534 63.546 0.0201804 -2.56325 63.546000 Cu 0.897789 0.110934 0.75 531 63.546 0.0116601 -2.56482 63.546000 Cu 0.933131 0.0955485 0.25 537 63.546 0.013399 -2.56414 63.546000 Cu 0.968394 0.0805931 0.75 535 63.546 0.011401 -2.56315 63.546000 Cu 0.999 0.0993595 0.25 574 63.546 0.00350679 -2.56319 63.546000 Cu 0.0298947 0.1179 0.75 573 63.546 0.00711118 -2.56396 63.546000 Cu 0.0609117 0.136011 0.25 620 63.546 0.00922729 -2.56513 63.546000 Cu 0.0965179 0.120914 0.75 622 63.546 0.0107615 -2.56538 63.546000 Cu 0.127516 0.138411 0.25 625 63.546 0.00562231 -2.56591 63.546000 Cu 0.163156 0.12272 0.75 623 63.546 0.00298478 -2.56565 63.546000 Cu 0.194034 0.139948 0.25 678 63.546 0.00116735 -2.56548 63.546000 Cu 0.229659 0.123921 0.75 680 63.546 0.000250672 -2.56507 63.546000 Cu 0.296061 0.125026 0.75 681 63.546 0.00125433 -2.56488 63.546000 Cu 0.260479 0.141117 0.25 683 63.546 0.000229396 -2.56507 63.546000 Cu 0.326817 0.142409 0.25 740 63.546 0.00326691 -2.56521 63.546000 Cu 0.36232 0.126531 0.75 742 63.546 0.00698112 -2.56516 63.546000 Cu 0.393036 0.144361 0.25 745 63.546 0.00744807 -2.56563 63.546000 Cu 0.428422 0.129006 0.75 743 63.546 0.00813365 -2.56527 63.546000 Cu 0.459156 0.147314 0.25 794 63.546 0.00315897 -2.56534 63.546000 Cu 0.463747 0.113996 0.25 749 63.546 0.0053695 -2.5646 63.546000 Cu 0.529846 0.11793 0.25 468 63.546 0.00691026 -2.56378 63.546000 Cu 0.494479 0.132506 0.75 796 63.546 0.00112635 -2.56459 63.546000 Cu 0.560844 0.136092 0.75 467 63.546 0.0100551 -2.56503 63.546000 Cu 0.596452 0.121038 0.25 473 63.546 0.0122073 -2.56536 63.546000 Cu 0.627448 0.138544 0.75 492 63.546 0.00633455 -2.56587 63.546000 Cu 0.663124 0.122862 0.25 494 63.546 0.0030735 -2.56561 63.546000 Cu 0.694033 0.140078 0.75 493 63.546 0.00111359 -2.56553 63.546000 Cu 0.729668 0.124064 0.25 499 63.546 0.000296495 -2.5651 63.546000 Cu 0.7605 0.141251 0.75 526 63.546 0.000206046 -2.56512 63.546000 Cu 0.826858 0.142529 0.75 527 63.546 0.00316669 -2.56522 63.546000 Cu 0.796082 0.125161 0.25 528 63.546 0.00115673 -2.56489 63.546000 Cu 0.862348 0.126636 0.25 533 63.546 0.0069483 -2.56514 63.546000 Cu 0.89307 0.144453 0.75 568 63.546 0.00721494 -2.56563 63.546000 Cu 0.928459 0.129081 0.25 570 63.546 0.00764233 -2.56531 63.546000 Cu 0.96378 0.114045 0.75 572 63.546 0.00497911 -2.56471 63.546000 Cu 0.994524 0.132522 0.25 575 63.546 0.00108044 -2.56474 63.546000 Cu 0.959192 0.14736 0.75 569 63.546 0.0029241 -2.56543 63.546000 Cu 0.0208564 0.183866 0.75 615 63.546 0.000912139 -2.56549 63.546000 Cu 0.0254153 0.150847 0.75 618 63.546 0.00247997 -2.56505 63.546000 Cu 0.0563485 0.168932 0.25 621 63.546 0.00459879 -2.56563 63.546000 Cu 0.091896 0.153814 0.75 619 63.546 0.00706638 -2.56587 63.546000 Cu 0.122815 0.171439 0.25 674 63.546 0.00490337 -2.56612 63.546000 Cu 0.158424 0.155809 0.75 676 63.546 0.00309637 -2.56588 63.546000 Cu 0.224875 0.157173 0.75 677 63.546 0.000225374 -2.56533 63.546000 Cu 0.189268 0.173138 0.25 679 63.546 0.00128684 -2.56565 63.546000 Cu 0.255707 0.174435 0.25 736 63.546 0.000106925 -2.56527 63.546000 Cu 0.291277 0.158404 0.75 738 63.546 0.000936363 -2.56519 63.546000 Cu 0.357579 0.159988 0.75 739 63.546 0.00491029 -2.56565 63.546000 Cu 0.322048 0.175807 0.25 741 63.546 0.00236555 -2.5655 63.546000 Cu 0.388337 0.177746 0.25 790 63.546 0.00563388 -2.566 63.546000 Cu 0.423783 0.162389 0.75 792 63.546 0.00562003 -2.56581 63.546000 Cu 0.454565 0.180551 0.25 795 63.546 0.0024777 -2.56568 63.546000 Cu 0.525358 0.150878 0.25 469 63.546 0.0024733 -2.56492 63.546000 Cu 0.520811 0.183914 0.25 486 63.546 0.00106928 -2.5654 63.546000 Cu 0.489948 0.165647 0.75 793 63.546 0.000409198 -2.56524 63.546000 Cu 0.556294 0.169013 0.75 488 63.546 0.00520719 -2.56557 63.546000 Cu 0.591834 0.153923 0.25 490 63.546 0.00793425 -2.56582 63.546000 Cu 0.622795 0.171554 0.75 489 63.546 0.00517054 -2.56614 63.546000 Cu 0.658393 0.155936 0.25 495 63.546 0.00330079 -2.56592 63.546000 Cu 0.689269 0.17326 0.75 522 63.546 0.00135964 -2.56566 63.546000 Cu 0.755722 0.174547 0.75 523 63.546 0.000121421 -2.56528 63.546000 Cu 0.724898 0.157299 0.25 524 63.546 0.000230868 -2.56535 63.546000 Cu 0.791305 0.158528 0.25 529 63.546 0.000851255 -2.56523 63.546000 Cu 0.822088 0.175918 0.75 564 63.546 0.00220865 -2.56549 63.546000 Cu 0.888354 0.177834 0.75 565 63.546 0.0052624 -2.56601 63.546000 Cu 0.857608 0.160092 0.25 566 63.546 0.00476033 -2.56565 63.546000 Cu 0.923811 0.162461 0.25 571 63.546 0.00514321 -2.56587 63.546000 Cu 0.954587 0.180587 0.75 614 63.546 0.00227018 -2.5658 63.546000 Cu 0.990002 0.165651 0.25 616 63.546 0.000381321 -2.56535 63.546000 Cu 0.0162613 0.216935 0.75 668 63.546 0.000346935 -2.56562 63.546000 Cu 0.0517141 0.20195 0.25 670 63.546 0.00266751 -2.56583 63.546000 Cu 0.0825769 0.219909 0.75 669 63.546 0.00419933 -2.56615 63.546000 Cu 0.0872272 0.186812 0.75 672 63.546 0.00496761 -2.56608 63.546000 Cu 0.153664 0.188944 0.75 673 63.546 0.00312114 -2.56601 63.546000 Cu 0.118084 0.204543 0.25 675 63.546 0.00458316 -2.56623 63.546000 Cu 0.148962 0.222138 0.75 730 63.546 0.00331236 -2.56607 63.546000 Cu 0.184523 0.206356 0.25 732 63.546 0.00144356 -2.56576 63.546000 Cu 0.22011 0.190433 0.75 734 63.546 0.000257847 -2.56547 63.546000 Cu 0.286488 0.19175 0.75 735 63.546 0.000611121 -2.5654 63.546000 Cu 0.250947 0.207733 0.25 737 63.546 4.4289e-05 -2.56543 63.546000 Cu 0.317314 0.209146 0.25 786 63.546 0.00165652 -2.56571 63.546000 Cu 0.352844 0.193353 0.75 788 63.546 0.00370119 -2.5659 63.546000 Cu 0.383647 0.211029 0.25 791 63.546 0.00506576 -2.56617 63.546000 Cu 0.419129 0.195668 0.75 789 63.546 0.0047142 -2.56606 63.546000 Cu 0.449974 0.213725 0.25 832 63.546 0.00248396 -2.56579 63.546000 Cu 0.516244 0.216985 0.25 487 63.546 0.0004708 -2.56546 63.546000 Cu 0.485378 0.198772 0.75 834 63.546 0.000285969 -2.56547 63.546000 Cu 0.551683 0.202036 0.75 485 63.546 0.00308199 -2.56579 63.546000 Cu 0.587204 0.186923 0.25 491 63.546 0.00570964 -2.5661 63.546000 Cu 0.582578 0.220017 0.25 516 63.546 0.0047907 -2.56612 63.546000 Cu 0.618098 0.20466 0.75 518 63.546 0.00487326 -2.56622 63.546000 Cu 0.684491 0.206474 0.75 519 63.546 0.00151766 -2.5657 63.546000 Cu 0.653668 0.189065 0.25 520 63.546 0.00330632 -2.56601 63.546000 Cu 0.720102 0.190546 0.25 525 63.546 0.000236719 -2.56542 63.546000 Cu 0.750911 0.207841 0.75 560 63.546 3.88575e-05 -2.56537 63.546000 Cu 0.81728 0.209246 0.75 561 63.546 0.00167517 -2.56566 63.546000 Cu 0.786501 0.19186 0.25 562 63.546 0.000528554 -2.56537 63.546000 Cu 0.852838 0.193445 0.25 567 63.546 0.00373954 -2.56588 63.546000 Cu 0.883634 0.211122 0.75 610 63.546 0.00438766 -2.56618 63.546000 Cu 0.919127 0.19574 0.25 612 63.546 0.00397867 -2.56611 63.546000 Cu 0.949942 0.213758 0.75 611 63.546 0.00229919 -2.5659 63.546000 Cu 0.985403 0.198761 0.25 617 63.546 0.000304895 -2.56562 63.546000 Cu 0.0117898 0.250039 0.75 665 63.546 0.000233539 -2.56546 63.546000 Cu 0.0471447 0.235057 0.25 671 63.546 0.00208392 -2.56583 63.546000 Cu 0.0780672 0.253098 0.75 726 63.546 0.00441548 -2.56605 63.546000 Cu 0.144393 0.255398 0.75 727 63.546 0.00346926 -2.56602 63.546000 Cu 0.113474 0.237731 0.25 728 63.546 0.00478723 -2.56622 63.546000 Cu 0.215402 0.223703 0.75 731 63.546 0.000336692 -2.56559 63.546000 Cu 0.179881 0.239609 0.25 733 63.546 0.00144167 -2.56582 63.546000 Cu 0.210807 0.257018 0.75 780 63.546 0.000578963 -2.56559 63.546000 Cu 0.277214 0.258359 0.75 781 63.546 0.00020322 -2.56558 63.546000 Cu 0.246296 0.241041 0.25 782 63.546 2.52663e-05 -2.56555 63.546000 Cu 0.281791 0.225064 0.75 784 63.546 0.000363658 -2.56558 63.546000 Cu 0.312713 0.24243 0.25 787 63.546 0.00131217 -2.56581 63.546000 Cu 0.348174 0.226635 0.75 785 63.546 0.00324611 -2.56605 63.546000 Cu 0.379105 0.244238 0.25 828 63.546 0.00468802 -2.56623 63.546000 Cu 0.414557 0.228864 0.75 830 63.546 0.00461046 -2.56613 63.546000 Cu 0.445506 0.246838 0.25 833 63.546 0.00326424 -2.56572 63.546000 Cu 0.511823 0.250089 0.25 513 63.546 0.000239298 -2.56533 63.546000 Cu 0.480882 0.231874 0.75 831 63.546 0.000531059 -2.56544 63.546000 Cu 0.547151 0.235135 0.75 514 63.546 0.00233985 -2.56571 63.546000 Cu 0.613448 0.237844 0.75 515 63.546 0.00492016 -2.56619 63.546000 Cu 0.578081 0.253192 0.25 517 63.546 0.00440867 -2.56596 63.546000 Cu 0.648929 0.222259 0.25 521 63.546 0.00348517 -2.56605 63.546000 Cu 0.644358 0.255537 0.25 554 63.546 0.00429238 -2.56601 63.546000 Cu 0.679809 0.239747 0.75 556 63.546 0.00191804 -2.56578 63.546000 Cu 0.746194 0.241151 0.75 557 63.546 0.000141023 -2.56549 63.546000 Cu 0.71533 0.223823 0.25 558 63.546 0.000398689 -2.56551 63.546000 Cu 0.710728 0.257138 0.25 559 63.546 0.000681362 -2.56561 63.546000 Cu 0.777144 0.258449 0.25 604 63.546 0.000363657 -2.56564 63.546000 Cu 0.781725 0.225167 0.25 563 63.546 0.00044219 -2.56551 63.546000 Cu 0.812618 0.242519 0.75 606 63.546 0.00153066 -2.56584 63.546000 Cu 0.848102 0.226735 0.25 608 63.546 0.00296287 -2.56606 63.546000 Cu 0.879042 0.244323 0.75 607 63.546 0.00407107 -2.56624 63.546000 Cu 0.914502 0.22893 0.25 613 63.546 0.00421701 -2.56615 63.546000 Cu 0.945458 0.24686 0.75 664 63.546 0.00316162 -2.56577 63.546000 Cu 0.980846 0.231868 0.25 666 63.546 0.000521526 -2.56558 63.546000 Cu 0.0736998 0.286372 0.75 723 63.546 0.00530083 -2.56572 63.546000 Cu 0.042738 0.268232 0.25 724 63.546 0.00221333 -2.5656 63.546000 Cu 0.00750013 0.283174 0.75 722 63.546 0.000404814 -2.56505 63.546000 Cu 0.108999 0.271003 0.25 729 63.546 0.00532589 -2.56605 63.546000 Cu 0.13995 0.288747 0.75 776 63.546 0.0042223 -2.56578 63.546000 Cu 0.206281 0.290371 0.75 777 63.546 0.0010801 -2.56548 63.546000 Cu 0.175343 0.272934 0.25 778 63.546 0.00185291 -2.56571 63.546000 Cu 0.241712 0.27436 0.25 783 63.546 0.000238023 -2.56548 63.546000 Cu 0.272708 0.291639 0.75 822 63.546 0.000235175 -2.56558 63.546000 Cu 0.308179 0.27566 0.25 824 63.546 0.00129838 -2.5658 63.546000 Cu 0.33921 0.292987 0.75 823 63.546 0.00338719 -2.56606 63.546000 Cu 0.34364 0.259841 0.75 826 63.546 0.00329678 -2.56609 63.546000 Cu 0.37469 0.277355 0.25 829 63.546 0.00505003 -2.56617 63.546000 Cu 0.410119 0.261975 0.75 827 63.546 0.00554334 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