Number of particles = 904 A = 1 Angstrom (basic length-scale) H0(1,1) = 27.3375 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.2016 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.1056 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 0.0217106 0.00308533 0.75 493 63.546 4.82217 -3.46635 63.546000 Cu 0.0338463 0.0316175 6.82681e-16 497 63.546 0.0803468 -3.49185 63.546000 Cu 0.101631 0.00751309 7.76542e-16 501 63.546 4.21138 -3.55423 63.546000 Cu 0.0217106 0.00308533 0.25 502 63.546 4.82217 -3.46635 63.546000 Cu 0.0338463 0.0316175 0.5 503 63.546 0.0803468 -3.49185 63.546000 Cu 0.101631 0.00751309 0.5 504 63.546 4.21138 -3.55423 63.546000 Cu 0.112004 0.0375856 0.75 523 63.546 0.120635 -3.54673 63.546000 Cu 0.112004 0.0375856 0.25 535 63.546 0.120635 -3.54673 63.546000 Cu 0.183403 0.0172847 0.75 531 63.546 5.82677 -3.49533 63.546000 Cu 0.183403 0.0172847 0.25 532 63.546 5.82677 -3.49533 63.546000 Cu 0.190787 0.0460064 2.57715e-16 533 63.546 0.0407062 -3.51722 63.546000 Cu 0.261389 0.0241723 1 534 63.546 3.76243 -3.51651 63.546000 Cu 0.190787 0.0460064 0.5 537 63.546 0.0407062 -3.51722 63.546000 Cu 0.261389 0.0241723 0.5 539 63.546 3.76243 -3.51651 63.546000 Cu 0.329113 0.00303312 4.63785e-17 538 63.546 4.75683 -3.46871 63.546000 Cu 0.329113 0.00303312 0.5 540 63.546 4.75683 -3.46871 63.546000 Cu 0.340701 0.0312664 0.75 575 63.546 0.0853287 -3.49133 63.546000 Cu 0.409032 0.00725455 0.75 583 63.546 4.25456 -3.56544 63.546000 Cu 0.409032 0.00725455 0.25 584 63.546 4.25456 -3.56544 63.546000 Cu 0.419055 0.037026 3.66186e-16 585 63.546 0.133587 -3.5507 63.546000 Cu 0.340701 0.0312664 0.25 587 63.546 0.0853287 -3.49133 63.546000 Cu 0.419055 0.037026 0.5 589 63.546 0.133587 -3.5507 63.546000 Cu 0.491329 0.0170675 1 586 63.546 5.94131 -3.48916 63.546000 Cu 0.491329 0.0170675 0.5 590 63.546 5.94131 -3.48916 63.546000 Cu 0.569744 0.0234746 0.75 637 63.546 3.82237 -3.52024 63.546000 Cu 0.498147 0.0453253 0.75 638 63.546 0.0534311 -3.51067 63.546000 Cu 0.498147 0.0453253 0.25 639 63.546 0.0534311 -3.51067 63.546000 Cu 0.569744 0.0234746 0.25 645 63.546 3.82237 -3.52024 63.546000 Cu 0.639771 0.00283604 0.75 459 63.546 5.98312 -3.47553 63.546000 Cu 0.639771 0.00283604 0.25 460 63.546 5.98312 -3.47553 63.546000 Cu 0.649314 0.0303108 1.03961e-15 461 63.546 0.625306 -3.45338 63.546000 Cu 0.649314 0.0303108 0.5 463 63.546 0.625306 -3.45338 63.546000 Cu 0.72128 0.00177842 5.70047e-16 462 63.546 2.5472 -3.53153 63.546000 Cu 0.72128 0.00177842 0.5 464 63.546 2.5472 -3.53153 63.546000 Cu 0.798274 0.00983192 0.75 467 63.546 4.65206 -3.48869 63.546000 Cu 0.728248 0.0319969 0.75 468 63.546 0.477591 -3.54265 63.546000 Cu 0.728248 0.0319969 0.25 469 63.546 0.477591 -3.54265 63.546000 Cu 0.806335 0.0393105 1 471 63.546 0.00563653 -3.53431 63.546000 Cu 0.798274 0.00983192 0.25 476 63.546 4.65206 -3.48869 63.546000 Cu 0.806335 0.0393105 0.5 477 63.546 0.00563653 -3.53431 63.546000 Cu 0.877651 0.0178556 4.60047e-16 475 63.546 6.10374 -3.49562 63.546000 Cu 0.877651 0.0178556 0.5 478 63.546 6.10374 -3.49562 63.546000 Cu 0.884569 0.0467739 0.75 485 63.546 0.0152615 -3.52649 63.546000 Cu 0.954905 0.0245095 0.75 494 63.546 3.90392 -3.5075 63.546000 Cu 0.954905 0.0245095 0.25 495 63.546 3.90392 -3.5075 63.546000 Cu 0.884569 0.0467739 0.25 498 63.546 0.0152615 -3.52649 63.546000 Cu 0.0419092 0.0602325 0.75 524 63.546 0.00480629 -3.5298 63.546000 Cu 0.0419092 0.0602325 0.25 525 63.546 0.00480629 -3.5298 63.546000 Cu 0.0500961 0.0889401 1 526 63.546 0.000381842 -3.53643 63.546000 Cu 0.120226 0.0668725 1.21349e-15 527 63.546 0.0217224 -3.5469 63.546000 Cu 0.0500961 0.0889401 0.5 530 63.546 0.000381842 -3.53643 63.546000 Cu 0.120226 0.0668725 0.5 536 63.546 0.0217224 -3.5469 63.546000 Cu 0.128671 0.0957796 0.75 568 63.546 0.00389162 -3.54432 63.546000 Cu 0.128671 0.0957796 0.25 569 63.546 0.00389162 -3.54432 63.546000 Cu 0.199132 0.0744585 0.75 567 63.546 0.00815773 -3.53125 63.546000 Cu 0.269739 0.0527675 0.75 576 63.546 0.000516 -3.54006 63.546000 Cu 0.269739 0.0527675 0.25 577 63.546 0.000516 -3.54006 63.546000 Cu 0.277996 0.0812636 1 578 63.546 0.000138012 -3.54047 63.546000 Cu 0.199132 0.0744585 0.25 580 63.546 0.00815773 -3.53125 63.546000 Cu 0.277996 0.0812636 0.5 582 63.546 0.000138012 -3.54047 63.546000 Cu 0.348646 0.0596073 2.88804e-18 579 63.546 0.00762733 -3.5284 63.546000 Cu 0.348646 0.0596073 0.5 588 63.546 0.00762733 -3.5284 63.546000 Cu 0.427186 0.0660349 0.75 629 63.546 0.024817 -3.54965 63.546000 Cu 0.35688 0.088054 0.75 630 63.546 0.000976399 -3.53608 63.546000 Cu 0.35688 0.088054 0.25 631 63.546 0.000976399 -3.53608 63.546000 Cu 0.427186 0.0660349 0.25 642 63.546 0.024817 -3.54965 63.546000 Cu 0.435711 0.0946899 3.46649e-16 633 63.546 0.0042777 -3.54542 63.546000 Cu 0.435711 0.0946899 0.5 643 63.546 0.0042777 -3.54542 63.546000 Cu 0.50638 0.0734622 4.5614e-16 640 63.546 0.0135148 -3.52899 63.546000 Cu 0.50638 0.0734622 0.5 644 63.546 0.0135148 -3.52899 63.546000 Cu 0.577246 0.0517429 1.45251e-16 641 63.546 0.00304093 -3.53797 63.546000 Cu 0.577246 0.0517429 0.5 646 63.546 0.00304093 -3.53797 63.546000 Cu 0.656655 0.0580475 0.75 465 63.546 0.207178 -3.50591 63.546000 Cu 0.664964 0.0859893 1 466 63.546 0.064048 -3.52032 63.546000 Cu 0.656655 0.0580475 0.25 472 63.546 0.207178 -3.50591 63.546000 Cu 0.664964 0.0859893 0.5 473 63.546 0.064048 -3.52032 63.546000 Cu 0.585568 0.0798925 0.75 697 63.546 0.00166003 -3.53899 63.546000 Cu 0.585568 0.0798925 0.25 698 63.546 0.00166003 -3.53899 63.546000 Cu 0.735765 0.0614624 6.91685e-16 470 63.546 0.183828 -3.55508 63.546000 Cu 0.735765 0.0614624 0.5 474 63.546 0.183828 -3.55508 63.546000 Cu 0.74383 0.0905712 0.75 479 63.546 0.0643662 -3.54954 63.546000 Cu 0.814081 0.0683922 0.75 486 63.546 0.00329826 -3.53424 63.546000 Cu 0.814081 0.0683922 0.25 487 63.546 0.00329826 -3.53424 63.546000 Cu 0.822418 0.0972469 1.73622e-16 488 63.546 0.00111489 -3.53797 63.546000 Cu 0.74383 0.0905712 0.25 490 63.546 0.0643662 -3.54954 63.546000 Cu 0.822418 0.0972469 0.5 492 63.546 0.00111489 -3.53797 63.546000 Cu 0.89275 0.0753942 0 489 63.546 0.00146455 -3.53466 63.546000 Cu 0.963228 0.0533664 1.72857e-16 496 63.546 0.00161989 -3.54241 63.546000 Cu 0.89275 0.0753942 0.5 499 63.546 0.00146455 -3.53466 63.546000 Cu 0.963228 0.0533664 0.5 500 63.546 0.00161989 -3.54241 63.546000 Cu 0.971449 0.0820836 0.75 515 63.546 0.000524244 -3.5411 63.546000 Cu 0.971449 0.0820836 0.25 528 63.546 0.000524244 -3.5411 63.546000 Cu 0.0585689 0.117659 0.75 559 63.546 6.55528e-05 -3.53874 63.546000 Cu 0.067231 0.146367 1.63174e-16 563 63.546 4.65186e-05 -3.53947 63.546000 Cu 0.137289 0.124536 3.47499e-16 570 63.546 0.000753624 -3.54193 63.546000 Cu 0.0585689 0.117659 0.25 572 63.546 6.55528e-05 -3.53874 63.546000 Cu 0.067231 0.146367 0.5 573 63.546 4.65186e-05 -3.53947 63.546000 Cu 0.137289 0.124536 0.5 574 63.546 0.000753624 -3.54193 63.546000 Cu 0.207565 0.10297 1.43722e-16 571 63.546 0.00195994 -3.53686 63.546000 Cu 0.207565 0.10297 0.5 581 63.546 0.00195994 -3.53686 63.546000 Cu 0.216187 0.131539 0.75 622 63.546 0.000692107 -3.53893 63.546000 Cu 0.216187 0.131539 0.25 623 63.546 0.000692107 -3.53893 63.546000 Cu 0.286483 0.10978 0.75 621 63.546 0.000110731 -3.54086 63.546000 Cu 0.286483 0.10978 0.25 634 63.546 0.000110731 -3.54086 63.546000 Cu 0.295136 0.138312 1.72857e-16 625 63.546 0.000106156 -3.54022 63.546000 Cu 0.365444 0.116525 8.66751e-16 632 63.546 0.0001215 -3.53856 63.546000 Cu 0.295136 0.138312 0.5 635 63.546 0.000106156 -3.54022 63.546000 Cu 0.365444 0.116525 0.5 636 63.546 0.0001215 -3.53856 63.546000 Cu 0.374116 0.145001 0.75 681 63.546 6.95842e-05 -3.53939 63.546000 Cu 0.374116 0.145001 0.25 694 63.546 6.95842e-05 -3.53939 63.546000 Cu 0.51492 0.101668 0.75 689 63.546 0.0045314 -3.53522 63.546000 Cu 0.444401 0.123183 0.75 690 63.546 0.000793259 -3.5422 63.546000 Cu 0.444401 0.123183 0.25 691 63.546 0.000793259 -3.5422 63.546000 Cu 0.523574 0.129939 1 693 63.546 0.00223083 -3.53781 63.546000 Cu 0.51492 0.101668 0.25 700 63.546 0.0045314 -3.53522 63.546000 Cu 0.523574 0.129939 0.5 701 63.546 0.00223083 -3.53781 63.546000 Cu 0.673391 0.114111 0.75 480 63.546 0.0179351 -3.52856 63.546000 Cu 0.673391 0.114111 0.25 481 63.546 0.0179351 -3.52856 63.546000 Cu 0.681994 0.142359 1 482 63.546 0.00442412 -3.53382 63.546000 Cu 0.681994 0.142359 0.5 484 63.546 0.00442412 -3.53382 63.546000 Cu 0.594141 0.108063 1 699 63.546 0.00177389 -3.53868 63.546000 Cu 0.594141 0.108063 0.5 702 63.546 0.00177389 -3.53868 63.546000 Cu 0.60281 0.136287 0.75 749 63.546 0.00125582 -3.53837 63.546000 Cu 0.60281 0.136287 0.25 757 63.546 0.00125582 -3.53837 63.546000 Cu 0.75224 0.119428 3.458e-16 483 63.546 0.022543 -3.54673 63.546000 Cu 0.75224 0.119428 0.5 491 63.546 0.022543 -3.54673 63.546000 Cu 0.830975 0.126004 0.75 507 63.546 0.000643991 -3.53884 63.546000 Cu 0.760874 0.148156 0.75 508 63.546 0.00766904 -3.54415 63.546000 Cu 0.760874 0.148156 0.25 509 63.546 0.00766904 -3.54415 63.546000 Cu 0.830975 0.126004 0.25 520 63.546 0.000643991 -3.53884 63.546000 Cu 0.90115 0.104063 0.75 516 63.546 0.000139535 -3.53782 63.546000 Cu 0.90115 0.104063 0.25 517 63.546 0.000139535 -3.53782 63.546000 Cu 0.909741 0.132737 9.43623e-16 518 63.546 8.64588e-05 -3.53872 63.546000 Cu 0.979884 0.110806 3.88101e-16 519 63.546 0.000217809 -3.54037 63.546000 Cu 0.909741 0.132737 0.5 522 63.546 8.64588e-05 -3.53872 63.546000 Cu 0.979884 0.110806 0.5 529 63.546 0.000217809 -3.54037 63.546000 Cu 0.988488 0.139523 0.75 560 63.546 9.48819e-05 -3.54015 63.546000 Cu 0.988488 0.139523 0.25 561 63.546 9.48819e-05 -3.54015 63.546000 Cu 0.076016 0.17506 0.75 614 63.546 8.30763e-05 -3.53947 63.546000 Cu 0.076016 0.17506 0.25 615 63.546 8.30763e-05 -3.53947 63.546000 Cu 0.00613249 0.19696 0.75 605 63.546 2.95819e-05 -3.54007 63.546000 Cu 0.00613249 0.19696 0.25 618 63.546 2.95819e-05 -3.54007 63.546000 Cu 0.146002 0.153229 0.75 613 63.546 0.000224934 -3.5406 63.546000 Cu 0.146002 0.153229 0.25 626 63.546 0.000224934 -3.5406 63.546000 Cu 0.154845 0.181882 0 617 63.546 0.000137767 -3.5405 63.546000 Cu 0.224917 0.160106 1.59267e-16 624 63.546 0.000346745 -3.53926 63.546000 Cu 0.154845 0.181882 0.5 627 63.546 0.000137767 -3.5405 63.546000 Cu 0.224917 0.160106 0.5 628 63.546 0.000346745 -3.53926 63.546000 Cu 0.233793 0.188669 0.75 673 63.546 0.000235086 -3.53993 63.546000 Cu 0.233793 0.188669 0.25 686 63.546 0.000235086 -3.53993 63.546000 Cu 0.303885 0.166826 0.75 682 63.546 0.000141538 -3.53958 63.546000 Cu 0.303885 0.166826 0.25 683 63.546 0.000141538 -3.53958 63.546000 Cu 0.312787 0.195324 0 684 63.546 6.78978e-05 -3.5397 63.546000 Cu 0.382926 0.173466 1 685 63.546 6.97432e-05 -3.54005 63.546000 Cu 0.312787 0.195324 0.5 688 63.546 6.78978e-05 -3.5397 63.546000 Cu 0.382926 0.173466 0.5 695 63.546 6.97432e-05 -3.54005 63.546000 Cu 0.453165 0.151641 5.96804e-16 692 63.546 0.000198986 -3.54116 63.546000 Cu 0.453165 0.151641 0.5 696 63.546 0.000198986 -3.54116 63.546000 Cu 0.462058 0.180065 0.75 741 63.546 0.000157897 -3.54032 63.546000 Cu 0.532363 0.158245 0.75 750 63.546 0.0011883 -3.53881 63.546000 Cu 0.532363 0.158245 0.25 751 63.546 0.0011883 -3.53881 63.546000 Cu 0.541302 0.186573 1 752 63.546 0.000651939 -3.539 63.546000 Cu 0.462058 0.180065 0.25 754 63.546 0.000157897 -3.54032 63.546000 Cu 0.541302 0.186573 0.5 756 63.546 0.000651939 -3.539 63.546000 Cu 0.69078 0.170704 0.75 505 63.546 0.00104852 -3.53703 63.546000 Cu 0.699661 0.199115 3.28811e-16 506 63.546 0.000376501 -3.53892 63.546000 Cu 0.69078 0.170704 0.25 512 63.546 0.00104852 -3.53703 63.546000 Cu 0.699661 0.199115 0.5 513 63.546 0.000376501 -3.53892 63.546000 Cu 0.611613 0.164557 2.14224e-16 753 63.546 0.000577017 -3.5386 63.546000 Cu 0.611613 0.164557 0.5 758 63.546 0.000577017 -3.5386 63.546000 Cu 0.620533 0.192871 0.75 809 63.546 0.000197884 -3.53895 63.546000 Cu 0.620533 0.192871 0.25 810 63.546 0.000197884 -3.53895 63.546000 Cu 0.769702 0.176813 5.20441e-16 510 63.546 0.00264706 -3.54219 63.546000 Cu 0.839667 0.154698 8.49423e-20 511 63.546 0.000635512 -3.53927 63.546000 Cu 0.769702 0.176813 0.5 514 63.546 0.00264706 -3.54219 63.546000 Cu 0.839667 0.154698 0.5 521 63.546 0.000635512 -3.53927 63.546000 Cu 0.848518 0.183371 0.75 552 63.546 0.000653471 -3.53996 63.546000 Cu 0.848518 0.183371 0.25 553 63.546 0.000653471 -3.53996 63.546000 Cu 0.918494 0.161432 0.75 551 63.546 0.000101961 -3.53991 63.546000 Cu 0.927357 0.190144 6.10395e-16 555 63.546 3.24039e-05 -3.53994 63.546000 Cu 0.99725 0.168242 8.3838e-17 562 63.546 3.26692e-05 -3.53997 63.546000 Cu 0.918494 0.161432 0.25 564 63.546 0.000101961 -3.53991 63.546000 Cu 0.927357 0.190144 0.5 565 63.546 3.24039e-05 -3.53994 63.546000 Cu 0.99725 0.168242 0.5 566 63.546 3.26692e-05 -3.53997 63.546000 Cu 0.0150899 0.225663 1.698e-16 609 63.546 6.9737e-05 -3.54036 63.546000 Cu 0.084964 0.203744 1.4695e-17 616 63.546 2.11336e-05 -3.54018 63.546000 Cu 0.0150899 0.225663 0.5 619 63.546 6.9737e-05 -3.54036 63.546000 Cu 0.084964 0.203744 0.5 620 63.546 2.11336e-05 -3.54018 63.546000 Cu 0.0939244 0.232431 0.75 665 63.546 2.36166e-05 -3.53997 63.546000 Cu 0.0939244 0.232431 0.25 678 63.546 2.36166e-05 -3.53997 63.546000 Cu 0.163831 0.210534 0.75 674 63.546 0.00010273 -3.54028 63.546000 Cu 0.163831 0.210534 0.25 675 63.546 0.00010273 -3.54028 63.546000 Cu 0.172767 0.239167 2.70031e-16 676 63.546 0.000124875 -3.53982 63.546000 Cu 0.242732 0.21724 5.20611e-16 677 63.546 0.000190914 -3.53973 63.546000 Cu 0.172767 0.239167 0.5 680 63.546 0.000124875 -3.53982 63.546000 Cu 0.242732 0.21724 0.5 687 63.546 0.000190914 -3.53973 63.546000 Cu 0.251665 0.245805 0.75 734 63.546 0.000214549 -3.5401 63.546000 Cu 0.251665 0.245805 0.25 735 63.546 0.000214549 -3.5401 63.546000 Cu 0.321699 0.223824 0.75 733 63.546 9.62088e-05 -3.54 63.546000 Cu 0.391861 0.201926 0.75 742 63.546 9.66818e-05 -3.54033 63.546000 Cu 0.391861 0.201926 0.25 743 63.546 9.66818e-05 -3.54033 63.546000 Cu 0.400797 0.230373 3.36371e-17 744 63.546 0.00016281 -3.54029 63.546000 Cu 0.321699 0.223824 0.25 746 63.546 9.62088e-05 -3.54 63.546000 Cu 0.400797 0.230373 0.5 748 63.546 0.00016281 -3.54029 63.546000 Cu 0.471004 0.208447 0 745 63.546 9.56658e-05 -3.53929 63.546000 Cu 0.471004 0.208447 0.5 755 63.546 9.56658e-05 -3.53929 63.546000 Cu 0.550245 0.2149 0.75 801 63.546 0.000256385 -3.53906 63.546000 Cu 0.47994 0.23681 0.75 802 63.546 5.15735e-05 -3.53903 63.546000 Cu 0.47994 0.23681 0.25 803 63.546 5.15735e-05 -3.53903 63.546000 Cu 0.55916 0.243243 3.46904e-16 805 63.546 8.34389e-05 -3.53907 63.546000 Cu 0.550245 0.2149 0.25 812 63.546 0.000256385 -3.53906 63.546000 Cu 0.55916 0.243243 0.5 813 63.546 8.34389e-05 -3.53907 63.546000 Cu 0.708532 0.227578 0.75 544 63.546 0.000269349 -3.53997 63.546000 Cu 0.708532 0.227578 0.25 545 63.546 0.000269349 -3.53997 63.546000 Cu 0.629439 0.221236 1 811 63.546 0.000104183 -3.53938 63.546000 Cu 0.629439 0.221236 0.5 814 63.546 0.000104183 -3.53938 63.546000 Cu 0.638322 0.249624 0.75 541 63.546 0.000132365 -3.5392 63.546000 Cu 0.638322 0.249624 0.25 548 63.546 0.000132365 -3.5392 63.546000 Cu 0.778598 0.205435 0.75 543 63.546 0.00110019 -3.54097 63.546000 Cu 0.787446 0.234025 1 547 63.546 0.000732944 -3.53989 63.546000 Cu 0.778598 0.205435 0.25 556 63.546 0.00110019 -3.54097 63.546000 Cu 0.787446 0.234025 0.5 557 63.546 0.000732944 -3.53989 63.546000 Cu 0.857439 0.212048 1.20023e-16 554 63.546 0.000422856 -3.54012 63.546000 Cu 0.857439 0.212048 0.5 558 63.546 0.000422856 -3.54012 63.546000 Cu 0.866298 0.24071 0.75 597 63.546 0.000188384 -3.54004 63.546000 Cu 0.936244 0.218839 0.75 606 63.546 2.28658e-05 -3.5396 63.546000 Cu 0.936244 0.218839 0.25 607 63.546 2.28658e-05 -3.5396 63.546000 Cu 0.945145 0.247515 1.74132e-16 608 63.546 2.46366e-05 -3.5397 63.546000 Cu 0.866298 0.24071 0.25 610 63.546 0.000188384 -3.54004 63.546000 Cu 0.945145 0.247515 0.5 612 63.546 2.46366e-05 -3.5397 63.546000 Cu 0.0240202 0.254353 0.75 666 63.546 0.000165967 -3.54044 63.546000 Cu 0.0240202 0.254353 0.25 667 63.546 0.000165967 -3.54044 63.546000 Cu 0.0329911 0.283055 1.73962e-16 668 63.546 0.0006243 -3.54113 63.546000 Cu 0.102838 0.261098 5.39723e-16 669 63.546 7.20463e-05 -3.53933 63.546000 Cu 0.0329911 0.283055 0.5 672 63.546 0.0006243 -3.54113 63.546000 Cu 0.102838 0.261098 0.5 679 63.546 7.20463e-05 -3.53933 63.546000 Cu 0.111817 0.289739 0.75 726 63.546 9.24992e-05 -3.53897 63.546000 Cu 0.111817 0.289739 0.25 727 63.546 9.24992e-05 -3.53897 63.546000 Cu 0.181725 0.267785 0.75 725 63.546 0.000163393 -3.54051 63.546000 Cu 0.190728 0.29641 2.17452e-16 729 63.546 0.000453594 -3.54113 63.546000 Cu 0.260649 0.274358 6.13283e-17 736 63.546 0.000321299 -3.54017 63.546000 Cu 0.181725 0.267785 0.25 738 63.546 0.000163393 -3.54051 63.546000 Cu 0.190728 0.29641 0.5 739 63.546 0.000453594 -3.54113 63.546000 Cu 0.260649 0.274358 0.5 740 63.546 0.000321299 -3.54017 63.546000 Cu 0.330654 0.252316 7.97523e-16 737 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-3.49683 63.546000 Cu 0.121992 0.517839 2.54147e-16 13 63.546 6.05846 -3.49683 63.546000 Cu 0.114767 0.546804 0.25 21 63.546 0.0143216 -3.52716 63.546000 Cu 0.0446958 0.52459 0.25 22 63.546 3.88449 -3.50758 63.546000 Cu 0.0446958 0.52459 0.75 23 63.546 3.88449 -3.50758 63.546000 Cu 0.114767 0.546804 0.75 34 63.546 0.0143216 -3.52716 63.546000 Cu 0.201453 0.509794 0.75 887 63.546 4.58561 -3.4927 63.546000 Cu 0.201453 0.509794 0.25 892 63.546 4.58561 -3.4927 63.546000 Cu 0.271168 0.532104 0.25 8 63.546 0.406203 -3.54158 63.546000 Cu 0.271168 0.532104 0.75 9 63.546 0.406203 -3.54158 63.546000 Cu 0.19306 0.539312 0.5 10 63.546 0.00691463 -3.53483 63.546000 Cu 0.19306 0.539312 3.70943e-16 14 63.546 0.00691463 -3.53483 63.546000 Cu 0.278819 0.501968 0.5 1 63.546 2.31852 -3.5334 63.546000 Cu 0.278819 0.501968 6.44967e-16 3 63.546 2.31852 -3.5334 63.546000 Cu 0.350044 0.530121 0.5 2 63.546 0.540025 -3.45641 63.546000 Cu 0.350044 0.530121 1.44402e-16 4 63.546 0.540025 -3.45641 63.546000 Cu 0.360268 0.502698 0.25 130 63.546 5.9144 -3.47118 63.546000 Cu 0.360268 0.502698 0.75 131 63.546 5.9144 -3.47118 63.546000 Cu 0.508155 0.517066 0.5 84 63.546 5.95443 -3.49119 63.546000 Cu 0.508155 0.517066 4.47561e-16 86 63.546 5.95443 -3.49119 63.546000 Cu 0.429749 0.52341 0.25 129 63.546 3.83753 -3.51956 63.546000 Cu 0.501048 0.545357 0.25 133 63.546 0.0515112 -3.51223 63.546000 Cu 0.501048 0.545357 0.75 134 63.546 0.0515112 -3.51223 63.546000 Cu 0.429749 0.52341 0.75 137 63.546 3.83753 -3.51956 63.546000 Cu 0.670232 0.503025 0.5 45 63.546 4.75524 -3.47135 63.546000 Cu 0.670232 0.503025 3.20232e-16 51 63.546 4.75524 -3.47135 63.546000 Cu 0.658636 0.531321 0.25 81 63.546 0.0725538 -3.49273 63.546000 Cu 0.580178 0.537198 0.5 85 63.546 0.109571 -3.55061 63.546000 Cu 0.658636 0.531321 0.75 92 63.546 0.0725538 -3.49273 63.546000 Cu 0.580178 0.537198 6.11244e-16 93 63.546 0.109571 -3.55061 63.546000 Cu 0.590393 0.507512 0.75 760 63.546 4.20403 -3.56037 63.546000 Cu 0.590393 0.507512 0.25 761 63.546 4.20403 -3.56037 63.546000 Cu 0.816009 0.517346 0.25 47 63.546 5.81668 -3.49623 63.546000 Cu 0.816009 0.517346 0.75 48 63.546 5.81668 -3.49623 63.546000 Cu 0.737887 0.524234 0.5 49 63.546 3.76351 -3.51736 63.546000 Cu 0.808421 0.546065 0.5 50 63.546 0.040455 -3.51742 63.546000 Cu 0.737887 0.524234 1.96471e-16 52 63.546 3.76351 -3.51736 63.546000 Cu 0.808421 0.546065 9.42689e-16 59 63.546 0.040455 -3.51742 63.546000 Cu 0.89786 0.507544 3.47754e-16 818 63.546 4.21573 -3.55776 63.546000 Cu 0.89786 0.507544 0.5 825 63.546 4.21573 -3.55776 63.546000 Cu 0.977978 0.503193 0.25 19 63.546 4.78922 -3.46715 63.546000 Cu 0.965608 0.531684 0.5 24 63.546 0.0819885 -3.49248 63.546000 Cu 0.977978 0.503193 0.75 26 63.546 4.78922 -3.46715 63.546000 Cu 0.965608 0.531684 3.83684e-16 28 63.546 0.0819885 -3.49248 63.546000 Cu 0.88735 0.53763 0.25 46 63.546 0.124444 -3.54682 63.546000 Cu 0.88735 0.53763 0.75 58 63.546 0.124444 -3.54682 63.546000 Cu 0.036066 0.553437 0.5 25 63.546 0.00129873 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0.049821 -3.52203 63.546000 Cu 0.342502 0.557882 0.75 16 63.546 0.169436 -3.5077 63.546000 Cu 0.334138 0.585849 4.35924e-16 18 63.546 0.049821 -3.52203 63.546000 Cu 0.413499 0.579808 0.25 188 63.546 0.00119231 -3.53856 63.546000 Cu 0.413499 0.579808 0.75 189 63.546 0.00119231 -3.53856 63.546000 Cu 0.421904 0.551668 0.5 135 63.546 0.00209494 -3.53816 63.546000 Cu 0.421904 0.551668 2.45568e-16 138 63.546 0.00209494 -3.53816 63.546000 Cu 0.4927 0.573476 0.5 136 63.546 0.0136125 -3.52942 63.546000 Cu 0.4927 0.573476 5.47113e-16 145 63.546 0.0136125 -3.52942 63.546000 Cu 0.563381 0.59476 0.5 142 63.546 0.00321544 -3.54495 63.546000 Cu 0.563381 0.59476 3.10379e-16 146 63.546 0.00321544 -3.54495 63.546000 Cu 0.650517 0.559665 0.5 90 63.546 0.00558229 -3.52936 63.546000 Cu 0.650517 0.559665 1 94 63.546 0.00558229 -3.52936 63.546000 Cu 0.571926 0.566146 0.25 132 63.546 0.0192971 -3.54854 63.546000 Cu 0.642221 0.588122 0.25 140 63.546 0.000713899 -3.53663 63.546000 Cu 0.642221 0.588122 0.75 141 63.546 0.000713899 -3.53663 63.546000 Cu 0.571926 0.566146 0.75 144 63.546 0.0192971 -3.54854 63.546000 Cu 0.800025 0.574515 0.25 87 63.546 0.00839648 -3.53184 63.546000 Cu 0.729461 0.552844 0.25 88 63.546 0.000374933 -3.53939 63.546000 Cu 0.729461 0.552844 0.75 89 63.546 0.000374933 -3.53939 63.546000 Cu 0.721096 0.581335 0.5 91 63.546 5.98971e-05 -3.54059 63.546000 Cu 0.800025 0.574515 0.75 100 63.546 0.00839648 -3.53184 63.546000 Cu 0.721096 0.581335 1 101 63.546 5.98971e-05 -3.54059 63.546000 Cu 0.957378 0.560287 0.25 54 63.546 0.00470933 -3.52902 63.546000 Cu 0.957378 0.560287 0.75 55 63.546 0.00470933 -3.52902 63.546000 Cu 0.879027 0.566903 0.5 56 63.546 0.0235989 -3.54697 63.546000 Cu 0.949078 0.588985 0.5 57 63.546 0.000328013 -3.53635 63.546000 Cu 0.879027 0.566903 6.58302e-16 60 63.546 0.0235989 -3.54697 63.546000 Cu 0.949078 0.588985 8.0967e-16 67 63.546 0.000328013 -3.53635 63.546000 Cu 0.870463 0.59581 0.25 96 63.546 0.00449821 -3.54448 63.546000 Cu 0.870463 0.59581 0.75 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0.325694 0.614004 0.25 37 63.546 0.0137558 -3.5305 63.546000 Cu 0.325694 0.614004 0.75 38 63.546 0.0137558 -3.5305 63.546000 Cu 0.317289 0.642289 0.5 40 63.546 0.00354724 -3.5346 63.546000 Cu 0.317289 0.642289 3.60665e-16 44 63.546 0.00354724 -3.5346 63.546000 Cu 0.404945 0.607967 0.5 190 63.546 0.00104285 -3.53885 63.546000 Cu 0.404945 0.607967 4.53592e-17 197 63.546 0.00104285 -3.53885 63.546000 Cu 0.396401 0.636195 0.25 243 63.546 0.000659955 -3.53873 63.546000 Cu 0.396401 0.636195 0.75 249 63.546 0.000659955 -3.53873 63.546000 Cu 0.48418 0.60167 0.25 187 63.546 0.00507004 -3.53549 63.546000 Cu 0.554736 0.623235 0.25 192 63.546 0.000521266 -3.54197 63.546000 Cu 0.554736 0.623235 0.75 193 63.546 0.000521266 -3.54197 63.546000 Cu 0.475582 0.62992 0.5 194 63.546 0.00230926 -3.53734 63.546000 Cu 0.48418 0.60167 0.75 196 63.546 0.00507004 -3.53549 63.546000 Cu 0.475582 0.62992 1 198 63.546 0.00230926 -3.53734 63.546000 Cu 0.633695 0.616593 0.5 143 63.546 0.000139804 -3.53907 63.546000 Cu 0.704086 0.638369 0.5 150 63.546 9.11032e-05 -3.54029 63.546000 Cu 0.633695 0.616593 9.55855e-16 153 63.546 0.000139804 -3.53907 63.546000 Cu 0.704086 0.638369 2.33166e-16 154 63.546 9.11032e-05 -3.54029 63.546000 Cu 0.625131 0.645053 0.25 191 63.546 9.83034e-05 -3.53966 63.546000 Cu 0.625131 0.645053 0.75 204 63.546 9.83034e-05 -3.53966 63.546000 Cu 0.712647 0.609853 0.25 139 63.546 9.87969e-05 -3.5405 63.546000 Cu 0.712647 0.609853 0.75 152 63.546 9.87969e-05 -3.5405 63.546000 Cu 0.791528 0.603039 0.5 98 63.546 0.00230369 -3.53708 63.546000 Cu 0.791528 0.603039 2.73259e-16 102 63.546 0.00230369 -3.53708 63.546000 Cu 0.782997 0.631603 0.25 148 63.546 0.0010486 -3.53869 63.546000 Cu 0.782997 0.631603 0.75 149 63.546 0.0010486 -3.53869 63.546000 Cu 0.940584 0.617685 0.25 95 63.546 4.08337e-05 -3.53871 63.546000 Cu 0.861872 0.624553 0.5 99 63.546 0.00101255 -3.54177 63.546000 Cu 0.93206 0.64636 0.5 106 63.546 8.70124e-05 -3.5392 63.546000 Cu 0.940584 0.617685 0.75 108 63.546 4.08337e-05 -3.53871 63.546000 Cu 0.861872 0.624553 4.40086e-16 109 63.546 0.00101255 -3.54177 63.546000 Cu 0.93206 0.64636 2.58479e-16 110 63.546 8.70124e-05 -3.5392 63.546000 Cu 0.081072 0.661475 0.25 103 63.546 1.64698e-05 -3.53962 63.546000 Cu 0.00232107 0.668222 0.5 107 63.546 4.32443e-05 -3.53981 63.546000 Cu 0.0725552 0.690119 0.5 114 63.546 5.79564e-05 -3.5393 63.546000 Cu 0.081072 0.661475 0.75 116 63.546 1.64698e-05 -3.53962 63.546000 Cu 0.00232107 0.668222 6.52356e-16 117 63.546 4.32443e-05 -3.53981 63.546000 Cu 0.0725552 0.690119 5.28596e-16 118 63.546 5.79564e-05 -3.5393 63.546000 Cu 0.159827 0.654747 0.5 72 63.546 0.000330591 -3.53984 63.546000 Cu 0.230071 0.676809 0.5 73 63.546 0.00272031 -3.54193 63.546000 Cu 0.159827 0.654747 2.81329e-16 76 63.546 0.000330591 -3.53984 63.546000 Cu 0.230071 0.676809 4.94789e-16 79 63.546 0.00272031 -3.54193 63.546000 Cu 0.151335 0.683411 0.25 112 63.546 0.000191947 -3.53992 63.546000 Cu 0.151335 0.683411 0.75 113 63.546 0.000191947 -3.53992 63.546000 Cu 0.308865 0.670658 0.25 69 63.546 0.000858685 -3.53684 63.546000 Cu 0.30039 0.699073 0.5 77 63.546 0.000312716 -3.53865 63.546000 Cu 0.308865 0.670658 0.75 78 63.546 0.000858685 -3.53684 63.546000 Cu 0.30039 0.699073 6.66712e-16 80 63.546 0.000312716 -3.53865 63.546000 Cu 0.387866 0.664482 0.5 247 63.546 0.000378485 -3.53882 63.546000 Cu 0.387866 0.664482 1.97831e-16 250 63.546 0.000378485 -3.53882 63.546000 Cu 0.379371 0.692815 0.25 300 63.546 0.000190418 -3.53892 63.546000 Cu 0.379371 0.692815 0.75 301 63.546 0.000190418 -3.53892 63.546000 Cu 0.546134 0.651653 0.5 195 63.546 0.000167586 -3.54042 63.546000 Cu 0.546134 0.651653 1.29537e-16 205 63.546 0.000167586 -3.54042 63.546000 Cu 0.537573 0.680024 0.25 244 63.546 5.51782e-05 -3.53995 63.546000 Cu 0.467002 0.658196 0.25 245 63.546 0.000976919 -3.53807 63.546000 Cu 0.467002 0.658196 0.75 246 63.546 0.000976919 -3.53807 63.546000 Cu 0.458451 0.686503 0.5 248 63.546 0.000440891 -3.5386 63.546000 Cu 0.537573 0.680024 0.75 256 63.546 5.51782e-05 -3.53995 63.546000 Cu 0.458451 0.686503 1.05159e-16 257 63.546 0.000440891 -3.5386 63.546000 Cu 0.695565 0.666872 0.25 200 63.546 0.000136081 -3.53957 63.546000 Cu 0.695565 0.666872 0.75 201 63.546 0.000136081 -3.53957 63.546000 Cu 0.616642 0.673495 0.5 202 63.546 0.000153605 -3.53947 63.546000 Cu 0.687132 0.695355 0.5 203 63.546 0.000215433 -3.53974 63.546000 Cu 0.616642 0.673495 3.67035e-16 206 63.546 0.000153605 -3.53947 63.546000 Cu 0.687132 0.695355 3.55653e-16 213 63.546 0.000215433 -3.53974 63.546000 Cu 0.774435 0.66015 0.5 151 63.546 0.000517334 -3.53923 63.546000 Cu 0.844817 0.681873 0.5 158 63.546 6.98943e-05 -3.54059 63.546000 Cu 0.774435 0.66015 2.67823e-16 161 63.546 0.000517334 -3.53923 63.546000 Cu 0.844817 0.681873 3.0868e-16 162 63.546 6.98943e-05 -3.54059 63.546000 Cu 0.766012 0.6887 0.25 199 63.546 0.000404427 -3.53955 63.546000 Cu 0.766012 0.6887 0.75 212 63.546 0.000404427 -3.53955 63.546000 Cu 0.853321 0.65323 0.25 147 63.546 0.00024034 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121 63.546 0.000609645 -3.54064 63.546000 Cu 0.221559 0.705413 0.75 123 63.546 0.0011096 -3.54108 63.546000 Cu 0.213009 0.733993 1.72518e-16 125 63.546 0.000609645 -3.54064 63.546000 Cu 0.291881 0.727543 0.25 119 63.546 0.00020612 -3.54006 63.546000 Cu 0.291881 0.727543 0.75 120 63.546 0.00020612 -3.54006 63.546000 Cu 0.370872 0.721184 0.5 302 63.546 0.000127858 -3.53926 63.546000 Cu 0.370872 0.721184 1.01464e-15 309 63.546 0.000127858 -3.53926 63.546000 Cu 0.362252 0.749577 0.25 353 63.546 0.000110593 -3.53948 63.546000 Cu 0.362252 0.749577 0.75 358 63.546 0.000110593 -3.53948 63.546000 Cu 0.529058 0.708397 0.5 254 63.546 6.34029e-05 -3.53965 63.546000 Cu 0.529058 0.708397 1.86873e-18 258 63.546 6.34029e-05 -3.53965 63.546000 Cu 0.449963 0.714831 0.25 299 63.546 0.0001367 -3.53879 63.546000 Cu 0.520505 0.736775 0.25 304 63.546 0.000137539 -3.53935 63.546000 Cu 0.520505 0.736775 0.75 305 63.546 0.000137539 -3.53935 63.546000 Cu 0.44136 0.743177 0.5 306 63.546 3.50803e-05 -3.5395 63.546000 Cu 0.449963 0.714831 0.75 308 63.546 0.0001367 -3.53879 63.546000 Cu 0.44136 0.743177 4.02541e-16 310 63.546 3.50803e-05 -3.5395 63.546000 Cu 0.678557 0.723829 0.25 251 63.546 0.000124488 -3.53976 63.546000 Cu 0.608113 0.701906 0.25 252 63.546 6.85601e-05 -3.53988 63.546000 Cu 0.608113 0.701906 0.75 253 63.546 6.85601e-05 -3.53988 63.546000 Cu 0.599547 0.730334 0.5 255 63.546 0.000101677 -3.54022 63.546000 Cu 0.678557 0.723829 0.75 264 63.546 0.000124488 -3.53976 63.546000 Cu 0.599547 0.730334 2.48626e-16 265 63.546 0.000101677 -3.54022 63.546000 Cu 0.836293 0.710514 0.25 208 63.546 9.50122e-05 -3.54041 63.546000 Cu 0.836293 0.710514 0.75 209 63.546 9.50122e-05 -3.54041 63.546000 Cu 0.757487 0.717265 0.5 210 63.546 0.000499032 -3.53997 63.546000 Cu 0.827685 0.739152 0.5 211 63.546 0.000226114 -3.54033 63.546000 Cu 0.757487 0.717265 1.04029e-15 214 63.546 0.000499032 -3.53997 63.546000 Cu 0.827685 0.739152 5.10163e-16 221 63.546 0.000226114 -3.54033 63.546000 Cu 0.748814 0.745823 0.25 260 63.546 0.000419208 -3.54024 63.546000 Cu 0.748814 0.745823 0.75 261 63.546 0.000419208 -3.54024 63.546000 Cu 0.915068 0.703686 0.5 159 63.546 5.11481e-05 -3.54021 63.546000 Cu 0.985174 0.72555 0.5 166 63.546 2.15551e-05 -3.54006 63.546000 Cu 0.915068 0.703686 4.79244e-16 169 63.546 5.11481e-05 -3.54021 63.546000 Cu 0.985174 0.72555 1.35143e-16 170 63.546 2.15551e-05 -3.54006 63.546000 Cu 0.906463 0.732353 0.25 207 63.546 1.88577e-05 -3.5397 63.546000 Cu 0.906463 0.732353 0.75 220 63.546 1.88577e-05 -3.5397 63.546000 Cu 0.125538 0.76925 0.5 174 63.546 0.000172199 -3.53986 63.546000 Cu 0.125538 0.76925 1.10425e-18 178 63.546 0.000172199 -3.53986 63.546000 Cu 0.0467696 0.776039 0.25 215 63.546 0.000110255 -3.53913 63.546000 Cu 0.117043 0.797851 0.25 224 63.546 0.000140969 -3.54002 63.546000 Cu 0.117043 0.797851 0.75 225 63.546 0.000140969 -3.54002 63.546000 Cu 0.0467696 0.776039 0.75 228 63.546 0.000110255 -3.53913 63.546000 Cu 0.274653 0.784554 0.25 171 63.546 0.000222304 -3.54083 63.546000 Cu 0.204372 0.762562 0.25 172 63.546 0.000422363 -3.54006 63.546000 Cu 0.204372 0.762562 0.75 173 63.546 0.000422363 -3.54006 63.546000 Cu 0.195868 0.791113 0.5 175 63.546 0.000496527 -3.53826 63.546000 Cu 0.274653 0.784554 0.75 183 63.546 0.000222304 -3.54083 63.546000 Cu 0.195868 0.791113 1.11087e-15 184 63.546 0.000496527 -3.53826 63.546000 Cu 0.283262 0.756044 0.5 122 63.546 0.000119182 -3.54077 63.546000 Cu 0.283262 0.756044 3.47584e-16 127 63.546 0.000119182 -3.54077 63.546000 Cu 0.353615 0.777991 0.5 126 63.546 0.00022096 -3.53904 63.546000 Cu 0.353615 0.777991 6.63059e-16 128 63.546 0.00022096 -3.53904 63.546000 Cu 0.424133 0.799901 0.5 357 63.546 0.000104626 -3.53979 63.546000 Cu 0.424133 0.799901 6.94403e-16 365 63.546 0.000104626 -3.53979 63.546000 Cu 0.511759 0.765134 0.5 307 63.546 0.000183608 -3.53864 63.546000 Cu 0.511759 0.765134 5.31993e-16 317 63.546 0.000183608 -3.53864 63.546000 Cu 0.503234 0.793457 0.25 354 63.546 0.000643652 -3.53729 63.546000 Cu 0.432655 0.771541 0.25 355 63.546 0.000115804 -3.5393 63.546000 Cu 0.432655 0.771541 0.75 356 63.546 0.000115804 -3.5393 63.546000 Cu 0.503234 0.793457 0.75 364 63.546 0.000643652 -3.53729 63.546000 Cu 0.669878 0.752314 0.5 262 63.546 6.25815e-05 -3.53978 63.546000 Cu 0.669878 0.752314 4.82812e-16 266 63.546 6.25815e-05 -3.53978 63.546000 Cu 0.590871 0.758779 0.25 303 63.546 0.00018261 -3.54088 63.546000 Cu 0.661254 0.780773 0.25 312 63.546 0.000206723 -3.53866 63.546000 Cu 0.661254 0.780773 0.75 313 63.546 0.000206723 -3.53866 63.546000 Cu 0.582258 0.787189 0.5 314 63.546 0.000334607 -3.54017 63.546000 Cu 0.590871 0.758779 0.75 316 63.546 0.00018261 -3.54088 63.546000 Cu 0.582258 0.787189 2.72835e-16 318 63.546 0.000334607 -3.54017 63.546000 Cu 0.818995 0.76777 0.25 259 63.546 0.00039022 -3.54057 63.546000 Cu 0.740166 0.774369 0.5 263 63.546 0.000555209 -3.53993 63.546000 Cu 0.810533 0.796388 0.5 270 63.546 0.00065597 -3.54085 63.546000 Cu 0.818995 0.76777 0.75 272 63.546 0.00039022 -3.54057 63.546000 Cu 0.740166 0.774369 2.81329e-16 273 63.546 0.000555209 -3.53993 63.546000 Cu 0.810533 0.796388 1.10323e-15 274 63.546 0.00065597 -3.54085 63.546000 Cu 0.976574 0.754227 0.25 216 63.546 5.05564e-05 -3.54059 63.546000 Cu 0.976574 0.754227 0.75 217 63.546 5.05564e-05 -3.54059 63.546000 Cu 0.897818 0.761017 0.5 218 63.546 6.61341e-05 -3.53997 63.546000 Cu 0.968021 0.782916 0.5 219 63.546 0.000335105 -3.54112 63.546000 Cu 0.897818 0.761017 1 222 63.546 6.61341e-05 -3.53997 63.546000 Cu 0.968021 0.782916 5.37684e-17 229 63.546 0.000335105 -3.54112 63.546000 Cu 0.889314 0.789663 0.25 268 63.546 8.00594e-05 -3.53904 63.546000 Cu 0.889314 0.789663 0.75 269 63.546 8.00594e-05 -3.53904 63.546000 Cu 0.0382873 0.804685 0.5 226 63.546 0.000258293 -3.53918 63.546000 Cu 0.108453 0.826475 0.5 227 63.546 0.000198152 -3.5414 63.546000 Cu 0.0382873 0.804685 5.24518e-16 230 63.546 0.000258293 -3.53918 63.546000 Cu 0.108453 0.826475 4.44248e-16 237 63.546 0.000198152 -3.5414 63.546000 Cu 0.0296767 0.833372 0.25 276 63.546 0.00047483 -3.53777 63.546000 Cu 0.0296767 0.833372 0.75 277 63.546 0.00047483 -3.53777 63.546000 Cu 0.266177 0.8131 0.5 181 63.546 0.00079026 -3.54261 63.546000 Cu 0.266177 0.8131 1.179e-16 185 63.546 0.00079026 -3.54261 63.546000 Cu 0.187347 0.819631 0.25 223 63.546 0.00174307 -3.53733 63.546000 Cu 0.257529 0.841715 0.25 232 63.546 0.00432725 -3.54432 63.546000 Cu 0.257529 0.841715 0.75 233 63.546 0.00432725 -3.54432 63.546000 Cu 0.178776 0.848131 0.5 234 63.546 0.00667767 -3.53339 63.546000 Cu 0.187347 0.819631 0.75 236 63.546 0.00174307 -3.53733 63.546000 Cu 0.178776 0.848131 8.89855e-16 238 63.546 0.00667767 -3.53339 63.546000 Cu 0.345126 0.806413 0.25 179 63.546 0.000400536 -3.53847 63.546000 Cu 0.345126 0.806413 0.75 180 63.546 0.000400536 -3.53847 63.546000 Cu 0.336505 0.834837 0.5 182 63.546 0.00123463 -3.53798 63.546000 Cu 0.336505 0.834837 5.0719e-16 186 63.546 0.00123463 -3.53798 63.546000 Cu 0.415637 0.828272 0.25 397 63.546 0.000257125 -3.54099 63.546000 Cu 0.415637 0.828272 0.75 403 63.546 0.000257125 -3.54099 63.546000 Cu 0.4948 0.821756 0.5 362 63.546 0.00236785 -3.53568 63.546000 Cu 0.4948 0.821756 2.43784e-16 366 63.546 0.00236785 -3.53568 63.546000 Cu 0.56539 0.844002 0.5 363 63.546 0.00362506 -3.54504 63.546000 Cu 0.56539 0.844002 6.71808e-16 373 63.546 0.00362506 -3.54504 63.546000 Cu 0.486304 0.849978 0.25 399 63.546 0.00932059 -3.53071 63.546000 Cu 0.486304 0.849978 0.75 400 63.546 0.00932059 -3.53071 63.546000 Cu 0.65284 0.809181 0.5 315 63.546 0.000512192 -3.53762 63.546000 Cu 0.65284 0.809181 6.24326e-17 325 63.546 0.000512192 -3.53762 63.546000 Cu 0.644463 0.837554 0.25 359 63.546 0.0021564 -3.53559 63.546000 Cu 0.57381 0.815576 0.25 360 63.546 0.000696957 -3.54196 63.546000 Cu 0.57381 0.815576 0.75 361 63.546 0.000696957 -3.54196 63.546000 Cu 0.644463 0.837554 0.75 372 63.546 0.0021564 -3.53559 63.546000 Cu 0.731733 0.802891 0.25 311 63.546 0.000557529 -3.53994 63.546000 Cu 0.802136 0.825013 0.25 320 63.546 0.00145441 -3.54171 63.546000 Cu 0.802136 0.825013 0.75 321 63.546 0.00145441 -3.54171 63.546000 Cu 0.723342 0.831409 0.5 322 63.546 0.000784987 -3.54023 63.546000 Cu 0.731733 0.802891 0.75 324 63.546 0.000557529 -3.53994 63.546000 Cu 0.723342 0.831409 2.73854e-16 326 63.546 0.000784987 -3.54023 63.546000 Cu 0.959537 0.811648 0.25 267 63.546 0.00163444 -3.54262 63.546000 Cu 0.880884 0.818303 0.5 271 63.546 0.000429033 -3.53744 63.546000 Cu 0.951036 0.840457 0.5 278 63.546 0.00658434 -3.54417 63.546000 Cu 0.959537 0.811648 0.75 280 63.546 0.00163444 -3.54262 63.546000 Cu 0.880884 0.818303 7.08418e-16 281 63.546 0.000429033 -3.53744 63.546000 Cu 0.951036 0.840457 1.07622e-16 282 63.546 0.00658434 -3.54417 63.546000 Cu 0.872509 0.846918 0.25 319 63.546 0.0033541 -3.53322 63.546000 Cu 0.872509 0.846918 0.75 332 63.546 0.0033541 -3.53322 63.546000 Cu 0.0998407 0.855137 0.25 275 63.546 0.000889986 -3.54261 63.546000 Cu 0.0211159 0.86209 0.5 279 63.546 0.00197063 -3.53478 63.546000 Cu 0.0910157 0.883879 0.5 286 63.546 0.00628491 -3.5459 63.546000 Cu 0.0998407 0.855137 0.75 288 63.546 0.000889986 -3.54261 63.546000 Cu 0.0211159 0.86209 1.78379e-18 289 63.546 0.00197063 -3.53478 63.546000 Cu 0.0910157 0.883879 4.90542e-16 290 63.546 0.00628491 -3.5459 63.546000 Cu 0.0124078 0.890865 0.25 327 63.546 0.0101408 -3.52714 63.546000 Cu 0.0124078 0.890865 0.75 340 63.546 0.0101408 -3.52714 63.546000 Cu 0.248842 0.870422 0.5 235 63.546 0.0181618 -3.5492 63.546000 Cu 0.248842 0.870422 1.71923e-16 241 63.546 0.0181618 -3.5492 63.546000 Cu 0.239955 0.899419 0.25 283 63.546 0.0884022 -3.55753 63.546000 Cu 0.170151 0.876577 0.25 284 63.546 0.0282142 -3.5255 63.546000 Cu 0.170151 0.876577 0.75 285 63.546 0.0282142 -3.5255 63.546000 Cu 0.239955 0.899419 0.75 295 63.546 0.0884022 -3.55753 63.546000 Cu 0.327836 0.863281 0.25 231 63.546 0.00319354 -3.53438 63.546000 Cu 0.318981 0.891763 0.5 239 63.546 0.0130127 -3.52658 63.546000 Cu 0.327836 0.863281 0.75 240 63.546 0.00319354 -3.53438 63.546000 Cu 0.318981 0.891763 5.08719e-16 242 63.546 0.0130127 -3.52658 63.546000 Cu 0.40693 0.85663 0.5 401 63.546 0.00115942 -3.5425 63.546000 Cu 0.40693 0.85663 3.54889e-16 404 63.546 0.00115942 -3.5425 63.546000 Cu 0.397968 0.885049 0.25 428 63.546 0.00740522 -3.54802 63.546000 Cu 0.397968 0.885049 0.75 429 63.546 0.00740522 -3.54802 63.546000 Cu 0.556833 0.872446 0.25 398 63.546 0.016796 -3.54949 63.546000 Cu 0.477685 0.878052 0.5 402 63.546 0.0385281 -3.52106 63.546000 Cu 0.556833 0.872446 0.75 410 63.546 0.016796 -3.54949 63.546000 Cu 0.477685 0.878052 3.49283e-16 411 63.546 0.0385281 -3.52106 63.546000 Cu 0.636087 0.865855 0.5 370 63.546 0.00898556 -3.53083 63.546000 Cu 0.706552 0.888446 0.5 371 63.546 0.00408395 -3.53893 63.546000 Cu 0.636087 0.865855 8.50867e-16 374 63.546 0.00898556 -3.53083 63.546000 Cu 0.706552 0.888446 1.01319e-15 381 63.546 0.00408395 -3.53893 63.546000 Cu 0.627474 0.894022 0.25 406 63.546 0.0366331 -3.52205 63.546000 Cu 0.627474 0.894022 0.75 407 63.546 0.0366331 -3.52205 63.546000 Cu 0.793738 0.853658 0.5 323 63.546 0.00394352 -3.54297 63.546000 Cu 0.793738 0.853658 5.47878e-16 333 63.546 0.00394352 -3.54297 63.546000 Cu 0.785234 0.882379 0.25 367 63.546 0.0150077 -3.54664 63.546000 Cu 0.715025 0.859928 0.25 368 63.546 0.00163952 -3.53989 63.546000 Cu 0.715025 0.859928 0.75 369 63.546 0.00163952 -3.53989 63.546000 Cu 0.785234 0.882379 0.75 380 63.546 0.0150077 -3.54664 63.546000 Cu 0.94248 0.869423 0.25 328 63.546 0.0281076 -3.54838 63.546000 Cu 0.94248 0.869423 0.75 329 63.546 0.0281076 -3.54838 63.546000 Cu 0.864092 0.875455 0.5 330 63.546 0.0226201 -3.52472 63.546000 Cu 0.933818 0.898691 0.5 331 63.546 0.11739 -3.55419 63.546000 Cu 0.864092 0.875455 3.17939e-16 334 63.546 0.0226201 -3.52472 63.546000 Cu 0.933818 0.898691 1.83815e-16 341 63.546 0.11739 -3.55419 63.546000 Cu 0.082061 0.912822 0.25 336 63.546 0.045132 -3.55453 63.546000 Cu 0.082061 0.912822 0.75 337 63.546 0.045132 -3.55453 63.546000 Cu 0.00381719 0.919702 0.5 338 63.546 0.0686002 -3.51439 63.546000 Cu 0.0736588 0.942404 0.5 339 63.546 0.471418 -3.5534 63.546000 Cu 0.00381719 0.919702 4.45777e-16 342 63.546 0.0686002 -3.51439 63.546000 Cu 0.0736588 0.942404 3.18024e-16 349 63.546 0.471418 -3.5534 63.546000 Cu 0.161524 0.90486 0.5 287 63.546 0.139678 -3.50745 63.546000 Cu 0.231675 0.929043 0.5 293 63.546 0.445763 -3.5689 63.546000 Cu 0.161524 0.90486 5.21715e-16 296 63.546 0.139678 -3.50745 63.546000 Cu 0.231675 0.929043 1.11121e-15 297 63.546 0.445763 -3.5689 63.546000 Cu 0.153266 0.932864 0.25 335 63.546 0.706768 -3.46664 63.546000 Cu 0.153266 0.932864 0.75 348 63.546 0.706768 -3.46664 63.546000 Cu 0.310308 0.920257 0.25 291 63.546 0.0882688 -3.51073 63.546000 Cu 0.310308 0.920257 0.75 292 63.546 0.0882688 -3.51073 63.546000 Cu 0.303231 0.94878 0.5 294 63.546 0.719744 -3.4595 63.546000 Cu 0.303231 0.94878 6.93893e-16 298 63.546 0.719744 -3.4595 63.546000 Cu 0.388822 0.913728 0.5 430 63.546 0.0559327 -3.55786 63.546000 Cu 0.388822 0.913728 7.6533e-16 437 63.546 0.0559327 -3.55786 63.546000 Cu 0.380485 0.943087 0.25 447 63.546 0.562638 -3.56547 63.546000 Cu 0.380485 0.943087 0.75 453 63.546 0.562638 -3.56547 63.546000 Cu 0.547863 0.901017 0.5 408 63.546 0.0775087 -3.56085 63.546000 Cu 0.547863 0.901017 1.02186e-16 412 63.546 0.0775087 -3.56085 63.546000 Cu 0.468756 0.905949 0.25 427 63.546 0.161042 -3.50228 63.546000 Cu 0.539091 0.930083 0.25 432 63.546 0.402053 -3.57527 63.546000 Cu 0.539091 0.930083 0.75 433 63.546 0.402053 -3.57527 63.546000 Cu 0.460273 0.933609 0.5 434 63.546 0.732994 -3.45951 63.546000 Cu 0.468756 0.905949 0.75 436 63.546 0.161042 -3.50228 63.546000 Cu 0.460273 0.933609 1.06526e-15 438 63.546 0.732994 -3.45951 63.546000 Cu 0.697822 0.917 0.25 405 63.546 0.0125412 -3.53744 63.546000 Cu 0.618726 0.922018 0.5 409 63.546 0.154297 -3.50271 63.546000 Cu 0.690184 0.945631 0.5 416 63.546 0.145597 -3.52165 63.546000 Cu 0.697822 0.917 0.75 418 63.546 0.0125412 -3.53744 63.546000 Cu 0.618726 0.922018 1 419 63.546 0.154297 -3.50271 63.546000 Cu 0.690184 0.945631 1 420 63.546 0.145597 -3.52165 63.546000 Cu 0.610995 0.949796 0.25 431 63.546 0.760438 -3.47201 63.546000 Cu 0.610995 0.949796 0.75 443 63.546 0.760438 -3.47201 63.546000 Cu 0.776281 0.911312 0.5 378 63.546 0.0706965 -3.55413 63.546000 Cu 0.84693 0.932024 0.5 379 63.546 0.654409 -3.47095 63.546000 Cu 0.776281 0.911312 1.06339e-15 382 63.546 0.0706965 -3.55413 63.546000 Cu 0.84693 0.932024 3.13777e-16 389 63.546 0.654409 -3.47095 63.546000 Cu 0.76798 0.940866 0.25 414 63.546 0.482069 -3.55703 63.546000 Cu 0.76798 0.940866 0.75 415 63.546 0.482069 -3.55703 63.546000 Cu 0.855548 0.903881 0.25 376 63.546 0.123563 -3.50989 63.546000 Cu 0.855548 0.903881 0.75 377 63.546 0.123563 -3.50989 63.546000 Cu 0.996791 0.948601 0.25 384 63.546 0.551053 -3.46866 63.546000 Cu 0.996791 0.948601 0.75 385 63.546 0.551053 -3.46866 63.546000 Cu 0.92545 0.928586 0.25 375 63.546 0.512194 -3.56808 63.546000 Cu 0.92545 0.928586 0.75 388 63.546 0.512194 -3.56808 63.546000 Cu 0.0744786 0.9741 0.25 383 63.546 6.16493 -3.57683 63.546000 Cu 0.0744786 0.9741 0.75 394 63.546 6.16493 -3.57683 63.546000 Cu 0.158863 0.987118 0.25 391 63.546 9.37792 -3.3926 63.546000 Cu 0.158863 0.987118 0.75 392 63.546 9.37792 -3.3926 63.546000 Cu 0.225955 0.960047 0.25 344 63.546 5.09898 -3.58506 63.546000 Cu 0.225955 0.960047 0.75 345 63.546 5.09898 -3.58506 63.546000 Cu 0.146914 0.960294 0.5 346 63.546 6.31802 -3.35291 63.546000 Cu 0.237131 0.99249 0.5 347 63.546 6.63308 -3.5511 63.546000 Cu 0.146914 0.960294 1 350 63.546 6.31802 -3.35291 63.546000 Cu 0.237131 0.99249 7.62017e-16 352 63.546 6.63308 -3.5511 63.546000 Cu 0.30357 0.976582 0.25 343 63.546 7.05217 -3.3683 63.546000 Cu 0.30357 0.976582 0.75 351 63.546 7.05217 -3.3683 63.546000 Cu 0.382505 0.974543 0.5 451 63.546 5.58833 -3.5797 63.546000 Cu 0.382505 0.974543 1.49923e-16 454 63.546 5.58833 -3.5797 63.546000 Cu 0.533482 0.96051 0.5 435 63.546 5.01606 -3.59943 63.546000 Cu 0.533482 0.96051 1.20355e-15 444 63.546 5.01606 -3.59943 63.546000 Cu 0.54477 0.992414 0.25 448 63.546 6.87827 -3.5458 63.546000 Cu 0.45438 0.96075 0.25 449 63.546 6.22337 -3.34496 63.546000 Cu 0.45438 0.96075 0.75 450 63.546 6.22337 -3.34496 63.546000 Cu 0.466809 0.987272 0.5 452 63.546 9.33138 -3.37666 63.546000 Cu 0.54477 0.992414 0.75 455 63.546 6.87827 -3.5458 63.546000 Cu 0.466809 0.987272 1 456 63.546 9.33138 -3.37666 63.546000 Cu 0.689146 0.97413 0.25 440 63.546 4.94416 -3.46982 63.546000 Cu 0.689146 0.97413 0.75 441 63.546 4.94416 -3.46982 63.546000 Cu 0.610911 0.97727 0.5 442 63.546 6.61134 -3.3753 63.546000 Cu 0.610911 0.97727 2.15532e-15 445 63.546 6.61134 -3.3753 63.546000 Cu 0.841122 0.9597 0.25 413 63.546 5.87375 -3.36366 63.546000 Cu 0.767552 0.972053 0.5 417 63.546 6.24009 -3.52869 63.546000 Cu 0.848442 0.98733 0.5 423 63.546 10.3328 -3.43047 63.546000 Cu 0.841122 0.9597 0.75 424 63.546 5.87375 -3.36366 63.546000 Cu 0.767552 0.972053 1 425 63.546 6.24009 -3.52869 63.546000 Cu 0.848442 0.98733 1.73707e-16 426 63.546 10.3328 -3.43047 63.546000 Cu 0.919447 0.959699 0.5 386 63.546 5.11402 -3.55544 63.546000 Cu 0.995401 0.976694 0.5 387 63.546 7.23065 -3.36364 63.546000 Cu 0.919447 0.959699 5.24009e-16 390 63.546 5.11402 -3.55544 63.546000 Cu 0.995401 0.976694 1.04071e-15 395 63.546 7.23065 -3.36364 63.546000 Cu 0.928043 0.992593 0.25 421 63.546 7.1838 -3.56103 63.546000 Cu 0.928043 0.992593 0.75 422 63.546 7.1838 -3.56103