Number of particles = 906 A = 1 Angstrom (basic length-scale) H0(1,1) = 38.0875 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 76.6939 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.59894 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 0.0160204 0.0414273 0.748561 459 63.546 7.00867 -3.22828 63.546000 Cu 0.0816765 0.042555 0.748422 460 63.546 0.0539234 -3.50939 63.546000 Cu 0.0489325 0.0264132 0.248128 461 63.546 3.23991 -3.44006 63.546000 Cu 0.081703 0.0103001 0.747676 463 63.546 0.0505865 -3.5091 63.546000 Cu 0.016063 0.0113484 0.747669 455 63.546 6.98471 -3.22882 63.546000 Cu 0.147872 0.0101034 0.748036 464 63.546 0.0257403 -3.51518 63.546000 Cu 0.115234 0.026451 0.248184 465 63.546 0.0354272 -3.51454 63.546000 Cu 0.147813 0.0428642 0.748219 477 63.546 0.0262905 -3.51506 63.546000 Cu 0.181551 0.0264949 0.247992 479 63.546 0.0286849 -3.51674 63.546000 Cu 0.214252 0.0430189 0.748001 478 63.546 0.0221095 -3.51628 63.546000 Cu 0.214305 0.00997623 0.747671 481 63.546 0.0209264 -3.51631 63.546000 Cu 0.281025 0.00985041 0.747238 482 63.546 0.0239184 -3.51553 63.546000 Cu 0.248151 0.0264948 0.247529 483 63.546 0.0300183 -3.51734 63.546000 Cu 0.280953 0.0431427 0.747511 503 63.546 0.0239447 -3.51538 63.546000 Cu 0.315174 0.0264801 0.247039 505 63.546 0.0469875 -3.51549 63.546000 Cu 0.347919 0.0432817 0.747293 504 63.546 0.0358357 -3.50906 63.546000 Cu 0.347973 0.00964589 0.746703 507 63.546 0.0348999 -3.50946 63.546000 Cu 0.382923 0.0264343 0.247221 509 63.546 0.144278 -3.49649 63.546000 Cu 0.414875 0.00912022 0.747146 508 63.546 0.32787 -3.47429 63.546000 Cu 0.414803 0.0437142 0.747786 537 63.546 0.328515 -3.47398 63.546000 Cu 0.478548 0.00327018 0.747588 510 63.546 5.6394 -3.36815 63.546000 Cu 0.452786 0.0263943 0.247746 539 63.546 4.45046 -3.47591 63.546000 Cu 0.478473 0.0494973 0.748459 538 63.546 5.60071 -3.36949 63.546000 Cu 0.516063 0.0113484 0.247669 541 63.546 6.98471 -3.22882 63.546000 Cu 0.548933 0.0264132 0.748128 542 63.546 3.23991 -3.44006 63.546000 Cu 0.51602 0.0414273 0.248561 544 63.546 7.00867 -3.22828 63.546000 Cu 0.581703 0.0103001 0.247676 545 63.546 0.0505865 -3.5091 63.546000 Cu 0.581676 0.042555 0.248422 581 63.546 0.0539234 -3.50939 63.546000 Cu 0.615234 0.026451 0.748184 583 63.546 0.0354272 -3.51454 63.546000 Cu 0.647872 0.0101034 0.248036 585 63.546 0.0257403 -3.51518 63.546000 Cu 0.647813 0.0428642 0.248219 586 63.546 0.0262905 -3.51506 63.546000 Cu 0.681551 0.0264949 0.747992 584 63.546 0.0286849 -3.51674 63.546000 Cu 0.714305 0.00997623 0.247671 587 63.546 0.0209264 -3.51631 63.546000 Cu 0.714252 0.0430189 0.248001 631 63.546 0.0221095 -3.51628 63.546000 Cu 0.748151 0.0264948 0.747529 633 63.546 0.0300183 -3.51734 63.546000 Cu 0.781025 0.00985041 0.247238 635 63.546 0.0239184 -3.51553 63.546000 Cu 0.780953 0.0431427 0.247511 636 63.546 0.0239447 -3.51538 63.546000 Cu 0.815174 0.0264801 0.747039 634 63.546 0.0469875 -3.51549 63.546000 Cu 0.847973 0.00964589 0.246703 637 63.546 0.0348999 -3.50946 63.546000 Cu 0.847919 0.0432817 0.247293 689 63.546 0.0358357 -3.50906 63.546000 Cu 0.882923 0.0264343 0.747221 691 63.546 0.144278 -3.49649 63.546000 Cu 0.978548 0.00327018 0.247588 453 63.546 5.6394 -3.36815 63.546000 Cu 0.952786 0.0263943 0.747746 692 63.546 4.45046 -3.47591 63.546000 Cu 0.914875 0.00912022 0.247146 693 63.546 0.32787 -3.47429 63.546000 Cu 0.914803 0.0437142 0.247786 694 63.546 0.328515 -3.47398 63.546000 Cu 0.978473 0.0494973 0.248459 457 63.546 5.60071 -3.36949 63.546000 Cu 0.0100002 0.0720414 0.749067 456 63.546 0.543959 -3.43167 63.546000 Cu 0.0461704 0.0581546 0.248823 462 63.546 0.405549 -3.48175 63.546000 Cu 0.0412453 0.0898061 0.249372 471 63.546 0.13931 -3.49755 63.546000 Cu 0.0772401 0.0747122 0.749029 473 63.546 0.024899 -3.51267 63.546000 Cu 0.108356 0.0914085 0.249275 476 63.546 0.00560069 -3.51441 63.546000 Cu 0.144109 0.0755549 0.748828 474 63.546 0.00379615 -3.51469 63.546000 Cu 0.112948 0.0590007 0.248654 475 63.546 0.0134884 -3.51367 63.546000 Cu 0.179516 0.0593896 0.248516 480 63.546 0.0106099 -3.51482 63.546000 Cu 0.175153 0.0922374 0.248975 497 63.546 0.00129229 -3.51487 63.546000 Cu 0.210749 0.0760555 0.748555 499 63.546 0.00284911 -3.51434 63.546000 Cu 0.277286 0.0764848 0.748003 500 63.546 0.00288809 -3.51241 63.546000 Cu 0.246079 0.059681 0.248046 501 63.546 0.00959121 -3.51425 63.546000 Cu 0.241763 0.0928512 0.248677 502 63.546 0.0011447 -3.51392 63.546000 Cu 0.312688 0.0599671 0.247699 506 63.546 0.0097251 -3.51071 63.546000 Cu 0.308161 0.0935021 0.248118 531 63.546 0.00288967 -3.51201 63.546000 Cu 0.343631 0.0770753 0.747932 533 63.546 0.00968846 -3.50839 63.546000 Cu 0.379186 0.0605322 0.247629 535 63.546 0.0504359 -3.50102 63.546000 Cu 0.374265 0.0946485 0.248232 536 63.546 0.0296163 -3.51184 63.546000 Cu 0.409494 0.078672 0.748272 534 63.546 0.0964015 -3.50718 63.546000 Cu 0.439797 0.0978084 0.249021 573 63.546 0.0600064 -3.51091 63.546000 Cu 0.444739 0.0635089 0.248584 540 63.546 0.267124 -3.48501 63.546000 Cu 0.474368 0.083749 0.749074 575 63.546 0.0919954 -3.48529 63.546000 Cu 0.541245 0.0898061 0.749372 576 63.546 0.13931 -3.49755 63.546000 Cu 0.51 0.0720414 0.249067 577 63.546 0.543959 -3.43167 63.546000 Cu 0.54617 0.0581546 0.748823 579 63.546 0.405549 -3.48175 63.546000 Cu 0.57724 0.0747122 0.249029 582 63.546 0.024899 -3.51267 63.546000 Cu 0.612948 0.0590007 0.748654 580 63.546 0.0134884 -3.51367 63.546000 Cu 0.608356 0.0914085 0.749275 625 63.546 0.00560069 -3.51441 63.546000 Cu 0.644109 0.0755549 0.248828 627 63.546 0.00379615 -3.51469 63.546000 Cu 0.675153 0.0922374 0.748975 626 63.546 0.00129229 -3.51487 63.546000 Cu 0.679516 0.0593896 0.748516 629 63.546 0.0106099 -3.51482 63.546000 Cu 0.746079 0.059681 0.748046 630 63.546 0.00959121 -3.51425 63.546000 Cu 0.710749 0.0760555 0.248555 632 63.546 0.00284911 -3.51434 63.546000 Cu 0.741763 0.0928512 0.748677 683 63.546 0.0011447 -3.51392 63.546000 Cu 0.777286 0.0764848 0.248003 685 63.546 0.00288809 -3.51241 63.546000 Cu 0.808161 0.0935021 0.748118 684 63.546 0.00288967 -3.51201 63.546000 Cu 0.812688 0.0599671 0.747699 687 63.546 0.0097251 -3.51071 63.546000 Cu 0.879186 0.0605322 0.747629 688 63.546 0.0504359 -3.50102 63.546000 Cu 0.843631 0.0770753 0.247932 690 63.546 0.00968846 -3.50839 63.546000 Cu 0.874265 0.0946485 0.748232 745 63.546 0.0296163 -3.51184 63.546000 Cu 0.974368 0.083749 0.249074 458 63.546 0.0919954 -3.48529 63.546000 Cu 0.939797 0.0978084 0.749021 746 63.546 0.0600064 -3.51091 63.546000 Cu 0.909494 0.078672 0.248272 747 63.546 0.0964015 -3.50718 63.546000 Cu 0.944739 0.0635089 0.748584 749 63.546 0.267124 -3.48501 63.546000 Cu 0.00121633 0.136028 0.749593 466 63.546 0.0229688 -3.50579 63.546000 Cu 0.00551877 0.103752 0.749393 469 63.546 0.101936 -3.48795 63.546000 Cu 0.0725661 0.106869 0.749559 470 63.546 0.0226198 -3.51145 63.546000 Cu 0.036808 0.121789 0.249498 472 63.546 0.0512228 -3.50505 63.546000 Cu 0.0680214 0.139181 0.749576 491 63.546 0.0150844 -3.51254 63.546000 Cu 0.103735 0.12387 0.249714 493 63.546 0.00619956 -3.51456 63.546000 Cu 0.134818 0.14088 0.749705 492 63.546 0.00264283 -3.5156 63.546000 Cu 0.139458 0.108197 0.749345 495 63.546 0.00249177 -3.51508 63.546000 Cu 0.170473 0.125074 0.249488 498 63.546 0.00121904 -3.51545 63.546000 Cu 0.206128 0.10905 0.749051 496 63.546 0.000721842 -3.51492 63.546000 Cu 0.201419 0.142057 0.749557 525 63.546 0.000677671 -3.51564 63.546000 Cu 0.267825 0.1431 0.748868 526 63.546 0.000812132 -3.51487 63.546000 Cu 0.237015 0.126001 0.24907 527 63.546 0.000555913 -3.51486 63.546000 Cu 0.272598 0.109814 0.748701 529 63.546 0.00101411 -3.5138 63.546000 Cu 0.303341 0.12697 0.248646 532 63.546 0.00250936 -3.51415 63.546000 Cu 0.338848 0.110792 0.74825 530 63.546 0.00865578 -3.51313 63.546000 Cu 0.334028 0.144373 0.748867 567 63.546 0.00583879 -3.51519 63.546000 Cu 0.369429 0.128467 0.248762 569 63.546 0.0164139 -3.51548 63.546000 Cu 0.400001 0.146529 0.749107 568 63.546 0.0167497 -3.51688 63.546000 Cu 0.404722 0.112821 0.748874 571 63.546 0.0384927 -3.51491 63.546000 Cu 0.435225 0.131472 0.249296 574 63.546 0.0203846 -3.51551 63.546000 Cu 0.47026 0.117096 0.749376 572 63.546 0.0179316 -3.50656 63.546000 Cu 0.505519 0.103752 0.249393 578 63.546 0.101936 -3.48795 63.546000 Cu 0.501216 0.136028 0.249593 619 63.546 0.0229688 -3.50579 63.546000 Cu 0.536808 0.121789 0.749498 621 63.546 0.0512228 -3.50505 63.546000 Cu 0.572566 0.106869 0.249559 623 63.546 0.0226198 -3.51145 63.546000 Cu 0.568021 0.139181 0.249576 624 63.546 0.0150844 -3.51254 63.546000 Cu 0.603735 0.12387 0.749714 622 63.546 0.00619956 -3.51456 63.546000 Cu 0.639458 0.108197 0.249345 628 63.546 0.00249177 -3.51508 63.546000 Cu 0.634818 0.14088 0.249705 677 63.546 0.00264283 -3.5156 63.546000 Cu 0.670473 0.125074 0.749488 679 63.546 0.00121904 -3.51545 63.546000 Cu 0.737015 0.126001 0.74907 680 63.546 0.000555913 -3.51486 63.546000 Cu 0.706128 0.10905 0.249051 681 63.546 0.000721842 -3.51492 63.546000 Cu 0.701419 0.142057 0.249557 682 63.546 0.000677671 -3.51564 63.546000 Cu 0.772598 0.109814 0.248701 686 63.546 0.00101411 -3.5138 63.546000 Cu 0.767825 0.1431 0.248868 739 63.546 0.000812132 -3.51487 63.546000 Cu 0.803341 0.12697 0.748646 741 63.546 0.00250936 -3.51415 63.546000 Cu 0.869429 0.128467 0.748762 742 63.546 0.0164139 -3.51548 63.546000 Cu 0.838848 0.110792 0.24825 743 63.546 0.00865578 -3.51313 63.546000 Cu 0.834028 0.144373 0.248867 744 63.546 0.00583879 -3.51519 63.546000 Cu 0.900001 0.146529 0.249107 793 63.546 0.0167497 -3.51688 63.546000 Cu 0.97026 0.117096 0.249376 467 63.546 0.0179316 -3.50656 63.546000 Cu 0.904722 0.112821 0.248874 748 63.546 0.0384927 -3.51491 63.546000 Cu 0.935225 0.131472 0.749296 795 63.546 0.0203846 -3.51551 63.546000 Cu 0.0634722 0.171623 0.749553 488 63.546 0.00801712 -3.51376 63.546000 Cu 0.0323525 0.154058 0.249381 489 63.546 0.0183171 -3.51029 63.546000 Cu 0.0279082 0.186531 0.249492 490 63.546 0.00615713 -3.5128 63.546000 Cu 0.0991377 0.156409 0.249621 494 63.546 0.00523777 -3.51512 63.546000 Cu 0.0945373 0.189031 0.249643 519 63.546 0.00363582 -3.51558 63.546000 Cu 0.130161 0.173611 0.749772 521 63.546 0.00241826 -3.51624 63.546000 Cu 0.196701 0.175081 0.749805 522 63.546 0.000670171 -3.51621 63.546000 Cu 0.165806 0.157939 0.249819 523 63.546 0.00131442 -3.51612 63.546000 Cu 0.161113 0.190847 0.249743 524 63.546 0.00137988 -3.51659 63.546000 Cu 0.232284 0.159146 0.249381 528 63.546 0.000381394 -3.51561 63.546000 Cu 0.227547 0.192292 0.249675 561 63.546 0.00030021 -3.51632 63.546000 Cu 0.263091 0.176357 0.749388 563 63.546 0.000484171 -3.51589 63.546000 Cu 0.298588 0.160368 0.248895 565 63.546 0.00179562 -3.51539 63.546000 Cu 0.293867 0.193698 0.249399 566 63.546 0.000965229 -3.51626 63.546000 Cu 0.329342 0.177821 0.749033 564 63.546 0.00367184 -3.51622 63.546000 Cu 0.364697 0.162057 0.249133 570 63.546 0.0086729 -3.51651 63.546000 Cu 0.360081 0.195461 0.249257 611 63.546 0.00486367 -3.51716 63.546000 Cu 0.395408 0.179989 0.749327 613 63.546 0.00735657 -3.51727 63.546000 Cu 0.430657 0.16484 0.249457 615 63.546 0.00849069 -3.51657 63.546000 Cu 0.426202 0.198037 0.24931 616 63.546 0.00390712 -3.51702 63.546000 Cu 0.461481 0.183141 0.749404 614 63.546 0.00233575 -3.515 63.546000 Cu 0.465876 0.15017 0.749469 617 63.546 0.00545818 -3.51311 63.546000 Cu 0.496821 0.168586 0.249478 620 63.546 0.00616148 -3.51174 63.546000 Cu 0.532352 0.154058 0.749381 618 63.546 0.0183171 -3.51029 63.546000 Cu 0.527908 0.186531 0.749492 671 63.546 0.00615713 -3.5128 63.546000 Cu 0.594537 0.189031 0.749643 672 63.546 0.00363582 -3.51558 63.546000 Cu 0.563472 0.171623 0.249553 673 63.546 0.00801712 -3.51376 63.546000 Cu 0.599138 0.156409 0.749621 675 63.546 0.00523777 -3.51512 63.546000 Cu 0.665806 0.157939 0.749819 676 63.546 0.00131442 -3.51612 63.546000 Cu 0.630161 0.173611 0.249772 678 63.546 0.00241826 -3.51624 63.546000 Cu 0.661113 0.190847 0.749743 733 63.546 0.00137988 -3.51659 63.546000 Cu 0.696701 0.175081 0.249805 735 63.546 0.000670171 -3.51621 63.546000 Cu 0.727547 0.192292 0.749675 734 63.546 0.00030021 -3.51632 63.546000 Cu 0.732284 0.159146 0.749381 737 63.546 0.000381394 -3.51561 63.546000 Cu 0.763091 0.176357 0.249388 740 63.546 0.000484171 -3.51589 63.546000 Cu 0.798588 0.160368 0.748895 738 63.546 0.00179562 -3.51539 63.546000 Cu 0.793867 0.193698 0.749399 787 63.546 0.000965229 -3.51626 63.546000 Cu 0.860081 0.195461 0.749257 788 63.546 0.00486367 -3.51716 63.546000 Cu 0.829342 0.177821 0.249033 789 63.546 0.00367184 -3.51622 63.546000 Cu 0.864697 0.162057 0.749133 791 63.546 0.0086729 -3.51651 63.546000 Cu 0.895408 0.179989 0.249327 794 63.546 0.00735657 -3.51727 63.546000 Cu 0.965876 0.15017 0.249469 468 63.546 0.00545818 -3.51311 63.546000 Cu 0.961481 0.183141 0.249404 485 63.546 0.00233575 -3.515 63.546000 Cu 0.996821 0.168586 0.749478 487 63.546 0.00616148 -3.51174 63.546000 Cu 0.930657 0.16484 0.749457 792 63.546 0.00849069 -3.51657 63.546000 Cu 0.926202 0.198037 0.74931 833 63.546 0.00390712 -3.51702 63.546000 Cu 0.0545886 0.236857 0.749308 514 63.546 0.00149345 -3.51508 63.546000 Cu 0.023506 0.219145 0.249501 515 63.546 0.00183319 -3.51414 63.546000 Cu 0.0589894 0.204196 0.749492 517 63.546 0.00381663 -3.5145 63.546000 Cu 0.0900565 0.221739 0.249484 520 63.546 0.0022904 -3.51593 63.546000 Cu 0.125552 0.20641 0.749528 518 63.546 0.00221839 -3.51652 63.546000 Cu 0.121101 0.239265 0.749324 555 63.546 0.00193768 -3.51699 63.546000 Cu 0.187531 0.2412 0.74947 556 63.546 0.000952103 -3.51714 63.546000 Cu 0.156552 0.223794 0.249392 557 63.546 0.00146256 -3.51711 63.546000 Cu 0.192025 0.20812 0.749428 559 63.546 0.000741139 -3.51679 63.546000 Cu 0.258402 0.209593 0.749555 560 63.546 0.000163273 -3.51645 63.546000 Cu 0.222955 0.225451 0.249442 562 63.546 0.000302131 -3.51679 63.546000 Cu 0.253841 0.242813 0.74964 605 63.546 4.75887e-05 -3.51652 63.546000 Cu 0.289259 0.226965 0.249643 607 63.546 0.000503846 -3.51652 63.546000 Cu 0.320107 0.244417 0.749673 606 63.546 0.00113945 -3.51685 63.546000 Cu 0.324672 0.21115 0.749591 609 63.546 0.00223801 -3.51683 63.546000 Cu 0.390869 0.213258 0.749319 610 63.546 0.003852 -3.51749 63.546000 Cu 0.355499 0.228739 0.249575 612 63.546 0.002683 -3.5173 63.546000 Cu 0.386346 0.246414 0.749504 663 63.546 0.00245044 -3.51736 63.546000 Cu 0.421724 0.231111 0.249295 665 63.546 0.00249451 -3.51711 63.546000 Cu 0.45708 0.216071 0.74933 667 63.546 0.00128039 -3.51599 63.546000 Cu 0.492466 0.201265 0.249395 669 63.546 0.00142567 -3.51397 63.546000 Cu 0.488068 0.234006 0.249221 670 63.546 0.000383773 -3.51503 63.546000 Cu 0.45267 0.248965 0.74926 664 63.546 0.00106763 -3.51633 63.546000 Cu 0.523506 0.219145 0.749501 668 63.546 0.00183319 -3.51414 63.546000 Cu 0.554589 0.236857 0.249308 727 63.546 0.00149345 -3.51508 63.546000 Cu 0.558989 0.204196 0.249492 674 63.546 0.00381663 -3.5145 63.546000 Cu 0.590057 0.221739 0.749484 729 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0.247333 443 63.546 0.00937262 -3.51442 63.546000 Cu 0.277521 0.976521 0.747097 444 63.546 0.00274446 -3.51282 63.546000 Cu 0.308504 0.959481 0.246946 425 63.546 0.00341017 -3.51264 63.546000 Cu 0.312824 0.992999 0.246863 446 63.546 0.0093155 -3.51114 63.546000 Cu 0.374622 0.958224 0.246672 428 63.546 0.0295629 -3.51227 63.546000 Cu 0.379325 0.992339 0.246585 429 63.546 0.0502977 -3.50161 63.546000 Cu 0.343869 0.975858 0.746633 431 63.546 0.0104266 -3.50899 63.546000 Cu 0.440175 0.954957 0.247058 402 63.546 0.0558917 -3.51005 63.546000 Cu 0.409736 0.974142 0.746719 430 63.546 0.0940575 -3.50697 63.546000 Cu 0.474635 0.968997 0.747317 408 63.546 0.0894989 -3.48401 63.546000 Cu 0.444897 0.989266 0.247213 432 63.546 0.261555 -3.48401 63.546000 Cu 0.546298 0.994632 0.747566 543 63.546 0.419087 -3.48193 63.546000 Cu 0.510172 0.980715 0.247512 406 63.546 0.561787 -3.43106 63.546000 Cu 0.541546 0.963008 0.747408 407 63.546 0.141089 -3.49705 63.546000 Cu 0.577469 0.97815 0.247433 409 63.546 0.0254117 -3.51229 63.546000 Cu 0.644331 0.977415 0.247504 374 63.546 0.00314428 -3.51498 63.546000 Cu 0.608684 0.961513 0.747322 376 63.546 0.00503749 -3.51455 63.546000 Cu 0.613063 0.993927 0.747724 410 63.546 0.0118726 -3.51324 63.546000 Cu 0.675507 0.960744 0.747462 375 63.546 0.00133543 -3.51499 63.546000 Cu 0.679647 0.993584 0.747853 379 63.546 0.00988713 -3.51508 63.546000 Cu 0.777521 0.976521 0.247097 336 63.546 0.00274446 -3.51282 63.546000 Cu 0.742097 0.960172 0.747276 338 63.546 0.000982218 -3.51427 63.546000 Cu 0.710985 0.976961 0.24753 377 63.546 0.00262267 -3.51439 63.546000 Cu 0.746225 0.993336 0.747333 378 63.546 0.00937262 -3.51442 63.546000 Cu 0.874622 0.958224 0.746672 292 63.546 0.0295629 -3.51227 63.546000 Cu 0.808504 0.959481 0.746946 337 63.546 0.00341017 -3.51264 63.546000 Cu 0.843869 0.975858 0.246633 339 63.546 0.0104266 -3.50899 63.546000 Cu 0.879325 0.992339 0.746585 340 63.546 0.0502977 -3.50161 63.546000 Cu 0.812824 0.992999 0.746863 341 63.546 0.0093155 -3.51114 63.546000 Cu 0.909736 0.974142 0.246719 290 63.546 0.0940575 -3.50697 63.546000 Cu 0.940175 0.954957 0.747058 291 63.546 0.0558917 -3.51005 63.546000 Cu 0.974635 0.968997 0.247317 293 63.546 0.0894989 -3.48401 63.546000 Cu 0.944897 0.989266 0.747213 295 63.546 0.261555 -3.48401