Number of particles = 900 A = 1 Angstrom (basic length-scale) H0(1,1) = 38.0919 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 76.3282 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.5945 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 0.0287997 0.00555128 3.14779e-16 466 63.546 0.00910913 -3.5142 63.546000 Cu 0.0245359 0.0389242 1 479 63.546 0.00101449 -3.51368 63.546000 Cu 0.0909544 0.0396187 3.99717e-16 480 63.546 0.00392216 -3.51189 63.546000 Cu 0.0600662 0.0224668 0.5 481 63.546 0.00318835 -3.51228 63.546000 Cu 0.0954805 0.00587883 1 483 63.546 0.0101482 -3.51046 63.546000 Cu 0.161993 0.00654589 2.45646e-16 484 63.546 0.0613338 -3.49989 63.546000 Cu 0.126429 0.023144 0.5 485 63.546 0.0125713 -3.5081 63.546000 Cu 0.157051 0.0409424 0 505 63.546 0.0318553 -3.51179 63.546000 Cu 0.192232 0.0249917 0.5 507 63.546 0.0933752 -3.50553 63.546000 Cu 0.222566 0.0443557 9.856e-16 506 63.546 0.0459299 -3.50943 63.546000 Cu 0.227374 0.00988277 1.81749e-15 509 63.546 0.242803 -3.47765 63.546000 Cu 0.292694 0.0181666 2.91614e-15 510 63.546 0.46757 -3.44049 63.546000 Cu 0.257167 0.0302497 0.5 511 63.546 0.0692305 -3.48739 63.546000 Cu 0.328763 0.00412882 0.5 512 63.546 0.361213 -3.48416 63.546000 Cu 0.32405 0.0360318 0.5 541 63.546 0.125368 -3.49973 63.546000 Cu 0.359956 0.0207918 1.85911e-15 543 63.546 0.0253 -3.5136 63.546000 Cu 0.395569 0.00492541 0.5 545 63.546 0.0121253 -3.51436 63.546000 Cu 0.391128 0.0375849 0.5 546 63.546 0.00565506 -3.51495 63.546000 Cu 0.426815 0.0215708 1.48051e-15 544 63.546 0.00336406 -3.51502 63.546000 Cu 0.462172 0.00529174 0.5 547 63.546 0.00963793 -3.51506 63.546000 Cu 0.457916 0.038356 0.5 583 63.546 0.00117098 -3.51487 63.546000 Cu 0.493492 0.0220351 3.36617e-17 585 63.546 0.00288064 -3.5142 63.546000 Cu 0.5288 0.00555128 0.5 587 63.546 0.00910913 -3.5142 63.546000 Cu 0.524536 0.0389242 0.5 588 63.546 0.00101449 -3.51368 63.546000 Cu 0.560066 0.0224668 7.4104e-16 586 63.546 0.00318835 -3.51228 63.546000 Cu 0.595481 0.00587883 0.5 589 63.546 0.0101482 -3.51046 63.546000 Cu 0.590954 0.0396187 0.5 633 63.546 0.00392216 -3.51189 63.546000 Cu 0.626429 0.023144 1 635 63.546 0.0125713 -3.5081 63.546000 Cu 0.661993 0.00654589 0.5 637 63.546 0.0613338 -3.49989 63.546000 Cu 0.657051 0.0409424 0.5 638 63.546 0.0318553 -3.51179 63.546000 Cu 0.692232 0.0249917 1 636 63.546 0.0933752 -3.50553 63.546000 Cu 0.727374 0.00988277 0.5 639 63.546 0.242803 -3.47765 63.546000 Cu 0.722566 0.0443557 0.5 691 63.546 0.0459299 -3.50943 63.546000 Cu 0.757167 0.0302497 1 693 63.546 0.0692305 -3.48739 63.546000 Cu 0.792694 0.0181666 0.5 695 63.546 0.46757 -3.44049 63.546000 Cu 0.828763 0.00412882 1 455 63.546 0.361213 -3.48416 63.546000 Cu 0.859956 0.0207918 0.5 457 63.546 0.0253 -3.5136 63.546000 Cu 0.82405 0.0360318 1 694 63.546 0.125368 -3.49973 63.546000 Cu 0.895569 0.00492541 1 456 63.546 0.0121253 -3.51436 63.546000 Cu 0.891128 0.0375849 1 461 63.546 0.00565506 -3.51495 63.546000 Cu 0.957916 0.038356 1 462 63.546 0.00117098 -3.51487 63.546000 Cu 0.926815 0.0215708 0.5 463 63.546 0.00336406 -3.51502 63.546000 Cu 0.962172 0.00529174 1 465 63.546 0.00963793 -3.51506 63.546000 Cu 0.993492 0.0220351 0.5 467 63.546 0.00288064 -3.5142 63.546000 Cu 0.0198877 0.0722749 1 476 63.546 0.000635137 -3.51474 63.546000 Cu 0.0554198 0.0559903 0.5 482 63.546 0.00153196 -3.51375 63.546000 Cu 0.0507731 0.0894599 0.5 499 63.546 0.00146898 -3.51511 63.546000 Cu 0.0862573 0.0732814 1 501 63.546 0.003819 -3.51447 63.546000 Cu 0.152354 0.0749694 1 502 63.546 0.0171451 -3.51535 63.546000 Cu 0.121657 0.0570851 0.5 503 63.546 0.0105503 -3.51334 63.546000 Cu 0.117028 0.090851 0.5 504 63.546 0.00763258 -3.51564 63.546000 Cu 0.187514 0.0593564 0.5 508 63.546 0.0341341 -3.51407 63.546000 Cu 0.183009 0.0932548 0.5 533 63.546 0.0140648 -3.51616 63.546000 Cu 0.218128 0.0781966 1.60345e-16 535 63.546 0.0145444 -3.5141 63.546000 Cu 0.28837 0.0501572 1.4308e-15 539 63.546 0.0895304 -3.49213 63.546000 Cu 0.284165 0.0827042 1.22702e-16 536 63.546 0.0212859 -3.50728 63.546000 Cu 0.253109 0.063745 0.5 537 63.546 0.0136722 -3.50694 63.546000 Cu 0.248921 0.0970214 0.5 538 63.546 0.0037967 -3.51259 63.546000 Cu 0.319691 0.0682745 0.5 542 63.546 0.0465256 -3.50709 63.546000 Cu 0.355388 0.0532012 7.21012e-16 540 63.546 0.0223431 -3.51239 63.546000 Cu 0.350927 0.0857869 1 577 63.546 0.0154906 -3.51387 63.546000 Cu 0.386583 0.0702991 0.5 579 63.546 0.00632299 -3.51528 63.546000 Cu 0.417701 0.0873902 1 578 63.546 0.00245065 -3.51578 63.546000 Cu 0.422268 0.0544606 1 581 63.546 0.00227403 -3.51534 63.546000 Cu 0.488938 0.0552529 3.36617e-17 582 63.546 0.000583029 -3.51468 63.546000 Cu 0.453321 0.0714188 0.5 584 63.546 0.000976561 -3.51537 63.546000 Cu 0.484324 0.0884593 3.81016e-16 627 63.546 0.000445 -3.51541 63.546000 Cu 0.550773 0.0894599 6.1689e-16 628 63.546 0.00146898 -3.51511 63.546000 Cu 0.519888 0.0722749 0.5 629 63.546 0.000635137 -3.51474 63.546000 Cu 0.55542 0.0559903 2.61089e-16 631 63.546 0.00153196 -3.51375 63.546000 Cu 0.586257 0.0732814 0.5 634 63.546 0.003819 -3.51447 63.546000 Cu 0.621657 0.0570851 7.151e-16 632 63.546 0.0105503 -3.51334 63.546000 Cu 0.617028 0.090851 7.39713e-16 685 63.546 0.00763258 -3.51564 63.546000 Cu 0.652354 0.0749694 0.5 687 63.546 0.0171451 -3.51535 63.546000 Cu 0.683009 0.0932548 2.29117e-16 686 63.546 0.0140648 -3.51616 63.546000 Cu 0.687514 0.0593564 1 689 63.546 0.0341341 -3.51407 63.546000 Cu 0.753109 0.063745 1 690 63.546 0.0136722 -3.50694 63.546000 Cu 0.718128 0.0781966 0.5 692 63.546 0.0145444 -3.5141 63.546000 Cu 0.748921 0.0970214 1 747 63.546 0.0037967 -3.51259 63.546000 Cu 0.78837 0.0501572 0.5 696 63.546 0.0895304 -3.49213 63.546000 Cu 0.784165 0.0827042 0.5 749 63.546 0.0212859 -3.50728 63.546000 Cu 0.886583 0.0702991 1 458 63.546 0.00632299 -3.51528 63.546000 Cu 0.855388 0.0532012 0.5 459 63.546 0.0223431 -3.51239 63.546000 Cu 0.850927 0.0857869 0.5 460 63.546 0.0154906 -3.51387 63.546000 Cu 0.819691 0.0682745 1 751 63.546 0.0465256 -3.50709 63.546000 Cu 0.922268 0.0544606 0.5 464 63.546 0.00227403 -3.51534 63.546000 Cu 0.917701 0.0873902 0.5 473 63.546 0.00245065 -3.51578 63.546000 Cu 0.953321 0.0714188 1 475 63.546 0.000976561 -3.51537 63.546000 Cu 0.988938 0.0552529 0.5 477 63.546 0.000583029 -3.51468 63.546000 Cu 0.984324 0.0884593 0.5 478 63.546 0.000445 -3.51541 63.546000 Cu 0.0152685 0.105597 2.63985e-16 497 63.546 0.000437742 -3.51556 63.546000 Cu 0.0816388 0.106847 7.08223e-16 498 63.546 0.00322577 -3.51577 63.546000 Cu 0.0461988 0.122873 0.5 500 63.546 0.00127423 -3.51591 63.546000 Cu 0.0771207 0.140314 6.2256e-17 527 63.546 0.0027086 -3.51654 63.546000 Cu 0.0107426 0.138913 4.00562e-16 494 63.546 0.000218967 -3.51613 63.546000 Cu 0.143355 0.14232 1 528 63.546 0.00498852 -3.51709 63.546000 Cu 0.112494 0.124465 0.5 529 63.546 0.00509701 -3.51662 63.546000 Cu 0.147794 0.108746 4.04182e-17 531 63.546 0.00892487 -3.51667 63.546000 Cu 0.178607 0.126892 0.5 534 63.546 0.00634548 -3.51685 63.546000 Cu 0.209483 0.145161 5.23023e-16 569 63.546 0.00245722 -3.51626 63.546000 Cu 0.213783 0.111762 1.24753e-16 532 63.546 0.00551707 -3.5157 63.546000 Cu 0.275739 0.148529 4.94911e-16 570 63.546 0.00214263 -3.51463 63.546000 Cu 0.244716 0.130234 0.5 571 63.546 0.00121901 -3.51478 63.546000 Cu 0.279958 0.115546 5.79729e-16 573 63.546 0.00628637 -3.51242 63.546000 Cu 0.315366 0.100848 0.5 575 63.546 0.0186035 -3.51183 63.546000 Cu 0.311112 0.133643 0.5 576 63.546 0.00806578 -3.51417 63.546000 Cu 0.346555 0.118537 1 574 63.546 0.00969001 -3.51495 63.546000 Cu 0.382094 0.103113 0.5 580 63.546 0.00572371 -3.51571 63.546000 Cu 0.377715 0.136022 0.5 621 63.546 0.0043773 -3.51619 63.546000 Cu 0.413206 0.120367 2.25014e-16 623 63.546 0.00218821 -3.51629 63.546000 Cu 0.444284 0.137629 0.5 626 63.546 0.000966691 -3.51651 63.546000 Cu 0.479767 0.121674 1 624 63.546 0.000328673 -3.51608 63.546000 Cu 0.448752 0.104498 0.5 625 63.546 0.000928898 -3.51598 63.546000 Cu 0.510743 0.138913 0.5 679 63.546 0.000218967 -3.51613 63.546000 Cu 0.515269 0.105597 0.5 630 63.546 0.000437742 -3.51556 63.546000 Cu 0.546199 0.122873 1 681 63.546 0.00127423 -3.51591 63.546000 Cu 0.581639 0.106847 0.5 683 63.546 0.00322577 -3.51577 63.546000 Cu 0.577121 0.140314 0.5 684 63.546 0.0027086 -3.51654 63.546000 Cu 0.612494 0.124465 3.36617e-17 682 63.546 0.00509701 -3.51662 63.546000 Cu 0.647794 0.108746 0.5 688 63.546 0.00892487 -3.51667 63.546000 Cu 0.643355 0.14232 0.5 741 63.546 0.00498852 -3.51709 63.546000 Cu 0.678607 0.126892 3.82344e-16 743 63.546 0.00634548 -3.51685 63.546000 Cu 0.709483 0.145161 0.5 746 63.546 0.00245722 -3.51626 63.546000 Cu 0.744716 0.130234 6.18458e-16 744 63.546 0.00121901 -3.51478 63.546000 Cu 0.713783 0.111762 0.5 745 63.546 0.00551707 -3.5157 63.546000 Cu 0.775739 0.148529 0.5 795 63.546 0.00214263 -3.51463 63.546000 Cu 0.779958 0.115546 0.5 750 63.546 0.00628637 -3.51242 63.546000 Cu 0.815366 0.100848 3.93323e-17 748 63.546 0.0186035 -3.51183 63.546000 Cu 0.811112 0.133643 1 797 63.546 0.00806578 -3.51417 63.546000 Cu 0.877715 0.136022 1 468 63.546 0.0043773 -3.51619 63.546000 Cu 0.846555 0.118537 0.5 469 63.546 0.00969001 -3.51495 63.546000 Cu 0.882094 0.103113 1 471 63.546 0.00572371 -3.51571 63.546000 Cu 0.948752 0.104498 1 472 63.546 0.000928898 -3.51598 63.546000 Cu 0.913206 0.120367 0.5 474 63.546 0.00218821 -3.51629 63.546000 Cu 0.944284 0.137629 3.71123e-16 493 63.546 0.000966691 -3.51651 63.546000 Cu 0.979767 0.121674 0.5 495 63.546 0.000328673 -3.51608 63.546000 Cu 0.0725923 0.173714 3.82826e-16 524 63.546 0.00218477 -3.51668 63.546000 Cu 0.0417057 0.156251 0.5 525 63.546 0.0010471 -3.51643 63.546000 Cu 0.0370785 0.189593 0.5 526 63.546 0.0007076 -3.51639 63.546000 Cu 0.00622269 0.172226 3.71002e-16 523 63.546 0.000162124 -3.51631 63.546000 Cu 0.108031 0.157947 0.5 530 63.546 0.00351049 -3.51698 63.546000 Cu 0.10341 0.191322 0.5 563 63.546 0.00262387 -3.51702 63.546000 Cu 0.138862 0.175742 2.46732e-16 565 63.546 0.00329729 -3.5172 63.546000 Cu 0.174236 0.160335 0.5 567 63.546 0.00366997 -3.51697 63.546000 Cu 0.169684 0.193655 0.5 568 63.546 0.00245981 -3.51709 63.546000 Cu 0.2051 0.178445 6.47656e-16 566 63.546 0.00156835 -3.51662 63.546000 Cu 0.240425 0.163411 0.5 572 63.546 0.000482184 -3.51564 63.546000 Cu 0.235957 0.196563 0.5 613 63.546 0.000252431 -3.51613 63.546000 Cu 0.271376 0.181583 1 615 63.546 0.000873227 -3.51561 63.546000 Cu 0.306784 0.166577 0.5 617 63.546 0.00387855 -3.51536 63.546000 Cu 0.302302 0.199608 0.5 618 63.546 0.00217996 -3.51618 63.546000 Cu 0.337781 0.184415 1 616 63.546 0.00368394 -3.51631 63.546000 Cu 0.342224 0.151427 1 619 63.546 0.0059795 -3.51571 63.546000 Cu 0.373281 0.169025 0.5 622 63.546 0.00326341 -3.51652 63.546000 Cu 0.408776 0.153425 1 620 63.546 0.00199921 -3.51665 63.546000 Cu 0.404249 0.186542 5.4462e-16 673 63.546 0.00186414 -3.51677 63.546000 Cu 0.439773 0.170807 0.5 675 63.546 0.00111331 -3.51669 63.546000 Cu 0.470683 0.188168 4.93222e-16 674 63.546 0.000362675 -3.51634 63.546000 Cu 0.475267 0.154916 7.23907e-19 677 63.546 0.000310381 -3.51645 63.546000 Cu 0.506223 0.172226 0.5 680 63.546 0.000162124 -3.51631 63.546000 Cu 0.541706 0.156251 1 678 63.546 0.0010471 -3.51643 63.546000 Cu 0.537078 0.189593 1 735 63.546 0.0007076 -3.51639 63.546000 Cu 0.572592 0.173714 0.5 737 63.546 0.00218477 -3.51668 63.546000 Cu 0.60341 0.191322 1 736 63.546 0.00262387 -3.51702 63.546000 Cu 0.608031 0.157947 1 739 63.546 0.00351049 -3.51698 63.546000 Cu 0.638862 0.175742 0.5 742 63.546 0.00329729 -3.5172 63.546000 Cu 0.674236 0.160335 1 740 63.546 0.00366997 -3.51697 63.546000 Cu 0.669684 0.193655 3.36617e-17 789 63.546 0.00245981 -3.51709 63.546000 Cu 0.7051 0.178445 0.5 791 63.546 0.00156835 -3.51662 63.546000 Cu 0.735957 0.196563 1 790 63.546 0.000252431 -3.51613 63.546000 Cu 0.740425 0.163411 7.4104e-16 793 63.546 0.000482184 -3.51564 63.546000 Cu 0.771376 0.181583 0.5 796 63.546 0.000873227 -3.51561 63.546000 Cu 0.806784 0.166577 8.63742e-16 794 63.546 0.00387855 -3.51536 63.546000 Cu 0.802302 0.199608 1.10987e-15 835 63.546 0.00217996 -3.51618 63.546000 Cu 0.842224 0.151427 0.5 470 63.546 0.0059795 -3.51571 63.546000 Cu 0.837781 0.184415 0.5 487 63.546 0.00368394 -3.51631 63.546000 Cu 0.873281 0.169025 1 489 63.546 0.00326341 -3.51652 63.546000 Cu 0.908776 0.153425 0.5 491 63.546 0.00199921 -3.51665 63.546000 Cu 0.904249 0.186542 0.5 492 63.546 0.00186414 -3.51677 63.546000 Cu 0.939773 0.170807 1 490 63.546 0.00111331 -3.51669 63.546000 Cu 0.975267 0.154916 0.5 496 63.546 0.000310381 -3.51645 63.546000 Cu 0.970683 0.188168 0.5 521 63.546 0.000362675 -3.51634 63.546000 Cu 0.0632501 0.240336 1 558 63.546 0.00108968 -3.51673 63.546000 Cu 0.0324058 0.222901 0.5 559 63.546 0.000435499 -3.51648 63.546000 Cu 0.0679086 0.20706 1 561 63.546 0.00143096 -3.51678 63.546000 Cu 0.0987637 0.224612 0.5 564 63.546 0.00215176 -3.51689 63.546000 Cu 0.00154684 0.205525 1 520 63.546 2.37342e-05 -3.51623 63.546000 Cu 0.134234 0.209047 2.01488e-16 562 63.546 0.00270288 -3.51707 63.546000 Cu 0.129639 0.242245 1 607 63.546 0.00273073 -3.51678 63.546000 Cu 0.196026 0.244765 1 608 63.546 0.00187517 -3.51609 63.546000 Cu 0.165111 0.226866 0.5 609 63.546 0.00232602 -3.51669 63.546000 Cu 0.200537 0.211644 6.65874e-16 611 63.546 0.00134085 -3.51652 63.546000 Cu 0.266844 0.214663 1 612 63.546 0.000256544 -3.51608 63.546000 Cu 0.231434 0.229686 0.5 614 63.546 0.000334404 -3.51601 63.546000 Cu 0.262337 0.247785 1.00985e-16 665 63.546 0.000185337 -3.51597 63.546000 Cu 0.297733 0.232713 0.5 667 63.546 0.00158211 -3.51648 63.546000 Cu 0.333209 0.2175 2.9644e-16 669 63.546 0.00278232 -3.51681 63.546000 Cu 0.399593 0.21972 2.46732e-16 670 63.546 0.0018743 -3.51695 63.546000 Cu 0.368723 0.202112 0.5 671 63.546 0.00267147 -3.51683 63.546000 Cu 0.36406 0.235286 0.5 672 63.546 0.00263844 -3.51709 63.546000 Cu 0.435136 0.204014 0.5 676 63.546 0.00116578 -3.51658 63.546000 Cu 0.430434 0.237256 0.5 729 63.546 0.00125119 -3.51685 63.546000 Cu 0.466011 0.221426 3.36617e-17 731 63.546 0.000387663 -3.51643 63.546000 Cu 0.496853 0.238814 0.5 734 63.546 1.94433e-05 -3.51645 63.546000 Cu 0.501547 0.205525 0.5 733 63.546 2.37342e-05 -3.51623 63.546000 Cu 0.532406 0.222901 4.92981e-16 732 63.546 0.000435499 -3.51648 63.546000 Cu 0.567909 0.20706 0.5 738 63.546 0.00143096 -3.51678 63.546000 Cu 0.56325 0.240336 0.5 783 63.546 0.00108968 -3.51673 63.546000 Cu 0.598764 0.224612 2.46008e-16 785 63.546 0.00215176 -3.51689 63.546000 Cu 0.665111 0.226866 1.10975e-15 786 63.546 0.00232602 -3.51669 63.546000 Cu 0.634234 0.209047 0.5 787 63.546 0.00270288 -3.51707 63.546000 Cu 0.629639 0.242245 0.5 788 63.546 0.00273073 -3.51678 63.546000 Cu 0.696026 0.244765 0.5 829 63.546 0.00187517 -3.51609 63.546000 Cu 0.700537 0.211644 0.5 792 63.546 0.00134085 -3.51652 63.546000 Cu 0.731434 0.229686 9.85841e-16 831 63.546 0.000334404 -3.51601 63.546000 Cu 0.766844 0.214663 0.5 833 63.546 0.000256544 -3.51608 63.546000 Cu 0.762337 0.247785 0.5 834 63.546 0.000185337 -3.51597 63.546000 Cu 0.797733 0.232713 6.60083e-16 832 63.546 0.00158211 -3.51648 63.546000 Cu 0.868723 0.202112 3.16589e-16 486 63.546 0.00267147 -3.51683 63.546000 Cu 0.833209 0.2175 0.5 488 63.546 0.00278232 -3.51681 63.546000 Cu 0.86406 0.235286 6.15562e-16 515 63.546 0.00263844 -3.51709 63.546000 Cu 0.899593 0.21972 0.5 517 63.546 0.0018743 -3.51695 63.546000 Cu 0.930434 0.237256 3.36617e-17 516 63.546 0.00125119 -3.51685 63.546000 Cu 0.935136 0.204014 3.56524e-16 519 63.546 0.00116578 -3.51658 63.546000 Cu 0.966011 0.221426 0.5 522 63.546 0.000387663 -3.51643 63.546000 Cu 0.996853 0.238814 1 557 63.546 1.94433e-05 -3.51645 63.546000 Cu 0.0277196 0.256184 0.5 560 63.546 0.000194169 -3.51655 63.546000 Cu 0.0231136 0.289441 0.5 601 63.546 0.000211505 -3.51634 63.546000 Cu 0.0586149 0.273557 1 603 63.546 0.000899364 -3.51667 63.546000 Cu 0.0941428 0.257808 0.5 605 63.546 0.00214809 -3.51689 63.546000 Cu 0.0895902 0.290945 0.5 606 63.546 0.00205304 -3.51668 63.546000 Cu 0.125106 0.275346 1 604 63.546 0.00332544 -3.51671 63.546000 Cu 0.160586 0.259965 0.5 610 63.546 0.00322439 -3.51633 63.546000 Cu 0.156145 0.292964 0.5 659 63.546 0.00524781 -3.51574 63.546000 Cu 0.191599 0.277805 1.23788e-16 661 63.546 0.00340479 -3.51544 63.546000 Cu 0.257964 0.280936 1 662 63.546 0.000397533 -3.5158 63.546000 Cu 0.226989 0.262789 0.5 663 63.546 0.000748174 -3.51559 63.546000 Cu 0.222635 0.295833 0.5 664 63.546 0.00216663 -3.5147 63.546000 Cu 0.29325 0.265905 0.5 668 63.546 0.00173165 -3.51649 63.546000 Cu 0.288903 0.299173 0.5 721 63.546 0.00266229 -3.5165 63.546000 Cu 0.328611 0.250684 3.69796e-16 666 63.546 0.00271764 -3.51693 63.546000 Cu 0.324189 0.283979 1.1305e-16 723 63.546 0.0035331 -3.51707 63.546000 Cu 0.390427 0.286334 3.36617e-17 724 63.546 0.00309792 -3.51692 63.546000 Cu 0.359505 0.268566 0.5 725 63.546 0.00321706 -3.51719 63.546000 Cu 0.394909 0.25298 2.25376e-16 727 63.546 0.00242126 -3.51708 63.546000 Cu 0.425806 0.27056 0.5 730 63.546 0.00153117 -3.51676 63.546000 Cu 0.461299 0.254709 1 728 63.546 0.00050219 -3.51658 63.546000 Cu 0.456723 0.288035 1 777 63.546 0.000676267 -3.51628 63.546000 Cu 0.492194 0.272095 0.5 779 63.546 8.52218e-05 -3.51641 63.546000 Cu 0.523114 0.289441 3.69917e-16 778 63.546 0.000211505 -3.51634 63.546000 Cu 0.52772 0.256184 1.24186e-15 781 63.546 0.000194169 -3.51655 63.546000 Cu 0.594143 0.257808 6.45605e-16 782 63.546 0.00214809 -3.51689 63.546000 Cu 0.558615 0.273557 0.5 784 63.546 0.000899364 -3.51667 63.546000 Cu 0.58959 0.290945 2.14518e-16 823 63.546 0.00205304 -3.51668 63.546000 Cu 0.656145 0.292964 4.94911e-16 824 63.546 0.00524781 -3.51574 63.546000 Cu 0.625106 0.275346 0.5 825 63.546 0.00332544 -3.51671 63.546000 Cu 0.660586 0.259965 1.22823e-16 827 63.546 0.00322439 -3.51633 63.546000 Cu 0.691599 0.277805 0.5 830 63.546 0.00340479 -3.51544 63.546000 Cu 0.726989 0.262789 1 828 63.546 0.000748174 -3.51559 63.546000 Cu 0.722635 0.295833 3.76552e-16 861 63.546 0.00216663 -3.5147 63.546000 Cu 0.757964 0.280936 0.5 863 63.546 0.000397533 -3.5158 63.546000 Cu 0.788903 0.299173 4.94067e-16 862 63.546 0.00266229 -3.5165 63.546000 Cu 0.79325 0.265905 1.21254e-16 865 63.546 0.00173165 -3.51649 63.546000 Cu 0.859505 0.268566 5.17956e-16 513 63.546 0.00321706 -3.51719 63.546000 Cu 0.828611 0.250684 0.5 514 63.546 0.00271764 -3.51693 63.546000 Cu 0.824189 0.283979 0.5 866 63.546 0.0035331 -3.51707 63.546000 Cu 0.894909 0.25298 0.5 518 63.546 0.00242126 -3.51708 63.546000 Cu 0.890427 0.286334 0.5 551 63.546 0.00309792 -3.51692 63.546000 Cu 0.925806 0.27056 1 553 63.546 0.00153117 -3.51676 63.546000 Cu 0.992194 0.272095 1 554 63.546 8.52218e-05 -3.51641 63.546000 Cu 0.961299 0.254709 0.5 555 63.546 0.00050219 -3.51658 63.546000 Cu 0.956723 0.288035 0.5 556 63.546 0.000676267 -3.51628 63.546000 Cu 0.0541033 0.306729 3.60868e-16 600 63.546 0.000916489 -3.51641 63.546000 Cu 0.0185987 0.32268 0.5 602 63.546 0.000313177 -3.5162 63.546000 Cu 0.0496691 0.339852 3.70037e-16 653 63.546 0.00104721 -3.51634 63.546000 Cu 0.0851746 0.324 0.5 655 63.546 0.00219118 -3.51649 63.546000 Cu 0.116345 0.341272 7.92437e-16 654 63.546 0.00516892 -3.51578 63.546000 Cu 0.120674 0.308355 1.41283e-16 657 63.546 0.00421866 -3.51629 63.546000 Cu 0.187275 0.310732 3.70158e-16 658 63.546 0.00778843 -3.514 63.546000 Cu 0.151835 0.32585 0.5 660 63.546 0.00879471 -3.51477 63.546000 Cu 0.183095 0.343517 1.35696e-15 715 63.546 0.0188344 -3.51131 63.546000 Cu 0.218439 0.328809 0.5 717 63.546 0.00646819 -3.51228 63.546000 Cu 0.249568 0.347332 1.23667e-16 716 63.546 0.00408924 -3.51237 63.546000 Cu 0.253668 0.314113 7.12325e-16 719 63.546 0.00129381 -3.51486 63.546000 Cu 0.284615 0.332564 0.5 722 63.546 0.00580182 -3.51572 63.546000 Cu 0.319769 0.3174 1 720 63.546 0.00589816 -3.51686 63.546000 Cu 0.355049 0.301962 0.5 726 63.546 0.00462314 -3.51709 63.546000 Cu 0.350612 0.335527 0.5 771 63.546 0.0081356 -3.5166 63.546000 Cu 0.385889 0.319802 1 773 63.546 0.00452998 -3.51662 63.546000 Cu 0.421277 0.303949 0.5 775 63.546 0.00201815 -3.51638 63.546000 Cu 0.416768 0.337431 0.5 776 63.546 0.00294449 -3.51596 63.546000 Cu 0.452161 0.321416 7.23907e-19 774 63.546 0.00113685 -3.51607 63.546000 Cu 0.487615 0.305406 0.5 780 63.546 0.000313558 -3.5162 63.546000 Cu 0.483134 0.338721 0.5 817 63.546 0.000532015 -3.51596 63.546000 Cu 0.518599 0.32268 1.24633e-16 819 63.546 0.000313177 -3.5162 63.546000 Cu 0.554103 0.306729 0.5 821 63.546 0.000916489 -3.51641 63.546000 Cu 0.549669 0.339852 0.5 822 63.546 0.00104721 -3.51634 63.546000 Cu 0.585175 0.324 2.34667e-16 820 63.546 0.00219118 -3.51649 63.546000 Cu 0.620674 0.308355 0.5 826 63.546 0.00421866 -3.51629 63.546000 Cu 0.616345 0.341272 0.5 855 63.546 0.00516892 -3.51578 63.546000 Cu 0.651835 0.32585 1 857 63.546 0.00879471 -3.51477 63.546000 Cu 0.687275 0.310732 0.5 859 63.546 0.00778843 -3.514 63.546000 Cu 0.683095 0.343517 0.5 860 63.546 0.0188344 -3.51131 63.546000 Cu 0.718439 0.328809 3.38547e-16 858 63.546 0.00646819 -3.51228 63.546000 Cu 0.753668 0.314113 0.5 864 63.546 0.00129381 -3.51486 63.546000 Cu 0.749568 0.347332 0.5 884 63.546 0.00408924 -3.51237 63.546000 Cu 0.784615 0.332564 5.51135e-16 886 63.546 0.00580182 -3.51572 63.546000 Cu 0.850612 0.335527 2.63623e-16 548 63.546 0.0081356 -3.5166 63.546000 Cu 0.855049 0.301962 4.57871e-16 549 63.546 0.00462314 -3.51709 63.546000 Cu 0.885889 0.319802 0.5 552 63.546 0.00452998 -3.51662 63.546000 Cu 0.819769 0.3174 0.5 887 63.546 0.00589816 -3.51686 63.546000 Cu 0.921277 0.303949 2.47214e-16 550 63.546 0.00201815 -3.51638 63.546000 Cu 0.916768 0.337431 1 595 63.546 0.00294449 -3.51596 63.546000 Cu 0.983134 0.338721 1.23064e-16 596 63.546 0.000532015 -3.51596 63.546000 Cu 0.952161 0.321416 0.5 597 63.546 0.00113685 -3.51607 63.546000 Cu 0.987615 0.305406 1 599 63.546 0.000313558 -3.5162 63.546000 Cu 0.0453484 0.37296 1 650 63.546 0.000909014 -3.51593 63.546000 Cu 0.0142078 0.355902 0.5 651 63.546 0.000396051 -3.5159 63.546000 Cu 0.0808437 0.356996 0.5 656 63.546 0.00218411 -3.51624 63.546000 Cu 0.0765716 0.389939 0.5 709 63.546 0.00192266 -3.5158 63.546000 Cu 0.00989451 0.389124 0.5 652 63.546 0.000539923 -3.5153 63.546000 Cu 0.112095 0.374079 7.38747e-16 711 63.546 0.00612643 -3.51529 63.546000 Cu 0.179042 0.376071 1.06233e-15 712 63.546 0.0492238 -3.50655 63.546000 Cu 0.147633 0.358579 0.5 713 63.546 0.0157245 -3.51341 63.546000 Cu 0.143488 0.391153 0.5 714 63.546 0.0236461 -3.51262 63.546000 Cu 0.21056 0.394202 0.5 763 63.546 0.0936356 -3.48962 63.546000 Cu 0.214436 0.361648 0.5 718 63.546 0.0220384 -3.50652 63.546000 Cu 0.245673 0.380639 3.67262e-16 765 63.546 0.0154565 -3.50586 63.546000 Cu 0.280491 0.366138 0.5 767 63.546 0.0155026 -3.51391 63.546000 Cu 0.315487 0.35103 1 769 63.546 0.0129527 -3.51606 63.546000 Cu 0.31126 0.384944 3.36617e-17 766 63.546 0.0325311 -3.51368 63.546000 Cu 0.381483 0.353412 1.24633e-16 770 63.546 0.00670002 -3.51566 63.546000 Cu 0.346284 0.369291 0.5 772 63.546 0.0152111 -3.51521 63.546000 Cu 0.377121 0.387173 1 811 63.546 0.00917253 -3.51375 63.546000 Cu 0.44341 0.388318 4.94308e-16 812 63.546 0.0014678 -3.51442 63.546000 Cu 0.412407 0.370997 0.5 813 63.546 0.00340261 -3.51489 63.546000 Cu 0.447745 0.354845 2.47456e-16 815 63.546 0.00138834 -3.51557 63.546000 Cu 0.478799 0.372062 0.5 818 63.546 0.000592932 -3.51529 63.546000 Cu 0.509895 0.389124 4.94067e-16 849 63.546 0.000539923 -3.5153 63.546000 Cu 0.514208 0.355902 1.08586e-18 816 63.546 0.000396051 -3.5159 63.546000 Cu 0.545348 0.37296 0.5 851 63.546 0.000909014 -3.51593 63.546000 Cu 0.576572 0.389939 6.09409e-16 850 63.546 0.00192266 -3.5158 63.546000 Cu 0.580844 0.356996 1.38146e-16 853 63.546 0.00218411 -3.51624 63.546000 Cu 0.647633 0.358579 2.68208e-16 854 63.546 0.0157245 -3.51341 63.546000 Cu 0.612095 0.374079 0.5 856 63.546 0.00612643 -3.51529 63.546000 Cu 0.643488 0.391153 7.41764e-16 878 63.546 0.0236461 -3.51262 63.546000 Cu 0.679042 0.376071 0.5 880 63.546 0.0492238 -3.50655 63.546000 Cu 0.71056 0.394202 1.16839e-15 879 63.546 0.0936356 -3.48962 63.546000 Cu 0.714436 0.361648 1 882 63.546 0.0220384 -3.50652 63.546000 Cu 0.745673 0.380639 0.5 885 63.546 0.0154565 -3.50586 63.546000 Cu 0.780491 0.366138 1 883 63.546 0.0155026 -3.51391 63.546000 Cu 0.815487 0.35103 0.5 888 63.546 0.0129527 -3.51606 63.546000 Cu 0.81126 0.384944 0.5 454 63.546 0.0325311 -3.51368 63.546000 Cu 0.846284 0.369291 4.82605e-19 591 63.546 0.0152111 -3.51521 63.546000 Cu 0.881483 0.353412 0.5 593 63.546 0.00670002 -3.51566 63.546000 Cu 0.877121 0.387173 0.5 594 63.546 0.00917253 -3.51375 63.546000 Cu 0.912407 0.370997 1 592 63.546 0.00340261 -3.51489 63.546000 Cu 0.947745 0.354845 0.5 598 63.546 0.00138834 -3.51557 63.546000 Cu 0.94341 0.388318 0.5 647 63.546 0.0014678 -3.51442 63.546000 Cu 0.978799 0.372062 1.03639e-15 649 63.546 0.000592932 -3.51529 63.546000 Cu 0.0371797 0.439119 1.59947e-15 704 63.546 0.00970308 -3.51555 63.546000 Cu 0.0410865 0.406042 6.24129e-16 707 63.546 0.00108384 -3.51553 63.546000 Cu 0.0723704 0.422829 0.5 710 63.546 0.00307356 -3.51554 63.546000 Cu 0.00569928 0.42235 0.5 705 63.546 0.00277672 -3.51492 63.546000 Cu 0.107893 0.406797 2.60534e-15 708 63.546 0.00545456 -3.51536 63.546000 Cu 0.103759 0.439466 5.53789e-15 757 63.546 0.0123888 -3.51448 63.546000 Cu 0.170518 0.44019 1.53879e-14 758 63.546 0.391447 -3.48396 63.546000 Cu 0.139227 0.423568 0.5 759 63.546 0.0254944 -3.51368 63.546000 Cu 0.175004 0.40832 4.18563e-15 761 63.546 0.131491 -3.49872 63.546000 Cu 0.206516 0.426143 0.5 764 63.546 0.513312 -3.4355 63.546000 Cu 0.276394 0.400019 0.5 768 63.546 0.048868 -3.50887 63.546000 Cu 0.241997 0.414194 4.67765e-15 762 63.546 0.0822559 -3.48446 63.546000 Cu 0.238351 0.448587 1.64949e-14 803 63.546 5.7572 -3.36346 63.546000 Cu 0.271919 0.434535 0.5 805 63.546 0.249781 -3.47806 63.546000 Cu 0.306953 0.41936 9.1526e-16 807 63.546 0.0924204 -3.50504 63.546000 Cu 0.372787 0.421137 1 808 63.546 0.0109739 -3.50852 63.546000 Cu 0.341935 0.40335 0.5 809 63.546 0.0298467 -3.51177 63.546000 Cu 0.337405 0.437759 0.5 810 63.546 0.0573351 -3.50036 63.546000 Cu 0.408081 0.40467 0.5 814 63.546 0.00354313 -3.51258 63.546000 Cu 0.403941 0.438417 0.5 843 63.546 0.00954182 -3.51105 63.546000 Cu 0.439155 0.421839 1 845 63.546 0.0027824 -3.51285 63.546000 Cu 0.474488 0.405415 0.5 847 63.546 0.000959681 -3.51436 63.546000 Cu 0.470584 0.438801 0.5 848 63.546 0.00909829 -3.51484 63.546000 Cu 0.505699 0.42235 1 846 63.546 0.00277672 -3.51492 63.546000 Cu 0.541087 0.406042 0.5 852 63.546 0.00108384 -3.51553 63.546000 Cu 0.53718 0.439119 0.5 872 63.546 0.00970308 -3.51555 63.546000 Cu 0.57237 0.422829 3.69313e-16 874 63.546 0.00307356 -3.51554 63.546000 Cu 0.607893 0.406797 0.5 876 63.546 0.00545456 -3.51536 63.546000 Cu 0.603759 0.439466 0.5 877 63.546 0.0123888 -3.51448 63.546000 Cu 0.639227 0.423568 2.73878e-16 875 63.546 0.0254944 -3.51368 63.546000 Cu 0.675004 0.40832 0.5 881 63.546 0.131491 -3.49872 63.546000 Cu 0.670518 0.44019 0.5 894 63.546 0.391447 -3.48396 63.546000 Cu 0.776394 0.400019 8.44558e-19 900 63.546 0.048868 -3.50887 63.546000 Cu 0.706516 0.426143 1.23366e-15 896 63.546 0.513312 -3.4355 63.546000 Cu 0.771919 0.434535 3.68469e-16 897 63.546 0.249781 -3.47806 63.546000 Cu 0.741997 0.414194 0.5 898 63.546 0.0822559 -3.48446 63.546000 Cu 0.738351 0.448587 0.5 899 63.546 5.7572 -3.36346 63.546000 Cu 0.806953 0.41936 0.5 450 63.546 0.0924204 -3.50504 63.546000 Cu 0.841935 0.40335 6.17614e-16 590 63.546 0.0298467 -3.51177 63.546000 Cu 0.837405 0.437759 1 641 63.546 0.0573351 -3.50036 63.546000 Cu 0.872787 0.421137 0.5 643 63.546 0.0109739 -3.50852 63.546000 Cu 0.903941 0.438417 8.63863e-16 642 63.546 0.00954182 -3.51105 63.546000 Cu 0.908081 0.40467 1.23426e-16 645 63.546 0.00354313 -3.51258 63.546000 Cu 0.974488 0.405415 1.56183e-15 646 63.546 0.000959681 -3.51436 63.546000 Cu 0.939155 0.421839 0.5 648 63.546 0.0027824 -3.51285 63.546000 Cu 0.970584 0.438801 2.0004e-16 703 63.546 0.00909829 -3.51484 63.546000 Cu 0.0355373 0.47225 1.59959e-15 753 63.546 0.0281449 -3.51705 63.546000 Cu 0.0690897 0.455764 0.5 755 63.546 0.0260887 -3.51571 63.546000 Cu 0.0694459 0.488755 0.5 756 63.546 0.0233998 -3.51539 63.546000 Cu 0.00260583 0.455599 0.5 706 63.546 0.0220124 -3.51662 63.546000 Cu 0.00293623 0.488859 0.5 752 63.546 0.0203675 -3.51589 63.546000 Cu 0.101902 0.472245 7.01538e-15 754 63.546 0.0337806 -3.51526 63.546000 Cu 0.135251 0.455981 0.5 760 63.546 0.0527115 -3.51043 63.546000 Cu 0.13565 0.488462 0.5 798 63.546 0.0476263 -3.51066 63.546000 Cu 0.168225 0.472195 2.47427e-14 799 63.546 3.32313 -3.43933 63.546000 Cu 0.200953 0.457015 0.5 801 63.546 5.60154 -3.23072 63.546000 Cu 0.201443 0.487274 0.5 802 63.546 7.03401 -3.23554 63.546000 Cu 0.238767 0.495923 1.31716e-14 800 63.546 5.68327 -3.3672 63.546000 Cu 0.264206 0.472199 0.5 806 63.546 4.57429 -3.46263 63.546000 Cu 0.301948 0.454714 7.45021e-16 804 63.546 0.364444 -3.47066 63.546000 Cu 0.302287 0.489631 3.68107e-16 837 63.546 0.363667 -3.4709 63.546000 Cu 0.369184 0.489048 1 838 63.546 0.0369651 -3.50806 63.546000 Cu 0.33404 0.472137 0.5 839 63.546 0.14632 -3.49456 63.546000 Cu 0.368864 0.455179 4.93222e-16 841 63.546 0.0364001 -3.50874 63.546000 Cu 0.401823 0.472127 0.5 844 63.546 0.0471574 -3.51491 63.546000 Cu 0.435855 0.455402 1 842 63.546 0.024838 -3.51554 63.546000 Cu 0.436184 0.488897 4.93101e-16 867 63.546 0.0232985 -3.51464 63.546000 Cu 0.468882 0.472191 0.5 869 63.546 0.0300609 -3.5171 63.546000 Cu 0.502936 0.488859 1 868 63.546 0.0203675 -3.51589 63.546000 Cu 0.502606 0.455599 1 870 63.546 0.0220124 -3.51662 63.546000 Cu 0.535537 0.47225 0.5 873 63.546 0.0281449 -3.51705 63.546000 Cu 0.56909 0.455764 1.26467e-15 871 63.546 0.0260887 -3.51571 63.546000 Cu 0.569446 0.488755 2.46249e-16 889 63.546 0.0233998 -3.51539 63.546000 Cu 0.601902 0.472245 0.5 891 63.546 0.0337806 -3.51526 63.546000 Cu 0.63565 0.488462 1 890 63.546 0.0476263 -3.51066 63.546000 Cu 0.635251 0.455981 9.8572e-16 892 63.546 0.0527115 -3.51043 63.546000 Cu 0.668225 0.472195 0.5 895 63.546 3.32313 -3.43933 63.546000 Cu 0.701443 0.487274 1.84524e-15 411 63.546 7.03401 -3.23554 63.546000 Cu 0.700953 0.457015 1.22907e-15 893 63.546 5.60154 -3.23072 63.546000 Cu 0.764206 0.472199 2.46852e-16 135 63.546 4.57429 -3.46263 63.546000 Cu 0.738767 0.495923 0.5 136 63.546 5.68327 -3.3672 63.546000 Cu 0.801948 0.454714 0.5 33 63.546 0.364444 -3.47066 63.546000 Cu 0.802287 0.489631 0.5 13 63.546 0.363667 -3.4709 63.546000 Cu 0.83404 0.472137 8.68689e-17 640 63.546 0.14632 -3.49456 63.546000 Cu 0.868864 0.455179 0.5 644 63.546 0.0364001 -3.50874 63.546000 Cu 0.869184 0.489048 0.5 698 63.546 0.0369651 -3.50806 63.546000 Cu 0.901823 0.472127 1 699 63.546 0.0471574 -3.51491 63.546000 Cu 0.968882 0.472191 8.62535e-16 700 63.546 0.0300609 -3.5171 63.546000 Cu 0.935855 0.455402 0.5 701 63.546 0.024838 -3.51554 63.546000 Cu 0.936184 0.488897 0.5 702 63.546 0.0232985 -3.51464 63.546000 Cu 0.0378044 0.505373 1.73255e-15 4 63.546 0.00883376 -3.5146 63.546000 Cu 0.0421996 0.538431 1.10818e-15 5 63.546 0.00128054 -3.51458 63.546000 Cu 0.0732449 0.52167 0.5 6 63.546 0.00362664 -3.51463 63.546000 Cu 0.00656705 0.522094 0.5 7 63.546 0.00248857 -3.51362 63.546000 Cu 0.104391 0.505024 6.03328e-15 1 63.546 0.0126114 -3.5141 63.546000 Cu 0.109019 0.537666 2.33955e-15 8 63.546 0.00645456 -3.51495 63.546000 Cu 0.140133 0.520852 0.5 2 63.546 0.0259846 -3.51337 63.546000 Cu 0.171185 0.504158 1.30488e-14 184 63.546 0.360297 -3.48388 63.546000 Cu 0.176116 0.536039 3.81813e-15 185 63.546 0.123109 -3.49974 63.546000 Cu 0.207392 0.518153 0.5 186 63.546 0.466 -3.44158 63.546000 Cu 0.27267 0.509815 0.5 836 63.546 0.245212 -3.4788 63.546000 Cu 0.242961 0.530215 3.44604e-15 187 63.546 0.0688769 -3.48722 63.546000 Cu 0.277577 0.544286 0.5 189 63.546 0.0477649 -3.50911 63.546000 Cu 0.307858 0.524925 1.23185e-15 134 63.546 0.0947469 -3.50585 63.546000 Cu 0.373682 0.523087 3.19364e-16 137 63.546 0.0123398 -3.50809 63.546000 Cu 0.343079 0.54086 0.5 140 63.546 0.0334627 -3.51176 63.546000 Cu 0.338072 0.506492 0.5 840 63.546 0.0586102 -3.50002 63.546000 Cu 0.440024 0.522449 1 92 63.546 0.00270827 -3.51187 63.546000 Cu 0.404561 0.505818 0.5 94 63.546 0.00940665 -3.51012 63.546000 Cu 0.409167 0.539569 0.5 139 63.546 0.00420192 -3.51182 63.546000 Cu 0.471194 0.505564 0.5 93 63.546 0.00820113 -3.5135 63.546000 Cu 0.47558 0.538942 0.5 98 63.546 0.000950078 -3.51339 63.546000 Cu 0.537804 0.505373 0.5 60 63.546 0.00883376 -3.5146 63.546000 Cu 0.506567 0.522094 1 95 63.546 0.00248857 -3.51362 63.546000 Cu 0.5422 0.538431 0.5 97 63.546 0.00128054 -3.51458 63.546000 Cu 0.573245 0.52167 1 58 63.546 0.00362664 -3.51463 63.546000 Cu 0.604391 0.505024 0.5 59 63.546 0.0126114 -3.5141 63.546000 Cu 0.640133 0.520852 9.86203e-16 61 63.546 0.0259846 -3.51337 63.546000 Cu 0.609019 0.537666 0.5 64 63.546 0.00645456 -3.51495 63.546000 Cu 0.671185 0.504158 0.5 32 63.546 0.360297 -3.48388 63.546000 Cu 0.676116 0.536039 0.5 63 63.546 0.123109 -3.49974 63.546000 Cu 0.77267 0.509815 2.44319e-16 410 63.546 0.245212 -3.4788 63.546000 Cu 0.707392 0.518153 1 31 63.546 0.466 -3.44158 63.546000 Cu 0.777577 0.544286 1 34 63.546 0.0477649 -3.50911 63.546000 Cu 0.742961 0.530215 0.5 36 63.546 0.0688769 -3.48722 63.546000 Cu 0.873682 0.523087 0.5 17 63.546 0.0123398 -3.50809 63.546000 Cu 0.807858 0.524925 0.5 35 63.546 0.0947469 -3.50585 63.546000 Cu 0.843079 0.54086 2.47335e-16 37 63.546 0.0334627 -3.51176 63.546000 Cu 0.838072 0.506492 2.65071e-16 697 63.546 0.0586102 -3.50002 63.546000 Cu 0.971194 0.505564 7.38627e-16 3 63.546 0.00820113 -3.5135 63.546000 Cu 0.904561 0.505818 1 14 63.546 0.00940665 -3.51012 63.546000 Cu 0.909167 0.539569 5.42448e-16 15 63.546 0.00420192 -3.51182 63.546000 Cu 0.940024 0.522449 0.5 16 63.546 0.00270827 -3.51187 63.546000 Cu 0.97558 0.538942 1.2234e-16 18 63.546 0.000950078 -3.51339 63.546000 Cu 0.0779066 0.554547 0.5 11 63.546 0.0028278 -3.51515 63.546000 Cu 0.0111925 0.555305 0.5 20 63.546 0.00071064 -3.51453 63.546000 Cu 0.0468641 0.571479 1 22 63.546 0.0011859 -3.51528 63.546000 Cu 0.0824882 0.587452 0.5 24 63.546 0.00277063 -3.51576 63.546000 Cu 0.0158496 0.588511 0.5 25 63.546 0.000550567 -3.51542 63.546000 Cu 0.113638 0.570363 1.10975e-15 9 63.546 0.00696536 -3.51508 63.546000 Cu 0.144822 0.553254 0.5 10 63.546 0.023386 -3.51242 63.546000 Cu 0.149274 0.585826 0.5 12 63.546 0.0157189 -3.51358 63.546000 Cu 0.180527 0.568289 1.11059e-15 242 63.546 0.04595 -3.50708 63.546000 Cu 0.211836 0.550139 0.5 190 63.546 0.0886756 -3.49213 63.546000 Cu 0.216015 0.58271 0.5 244 63.546 0.0221826 -3.50731 63.546000 Cu 0.24704 0.563724 8.62897e-16 188 63.546 0.0128425 -3.50645 63.546000 Cu 0.282022 0.578134 0.5 194 63.546 0.0156078 -3.51388 63.546000 Cu 0.251234 0.597011 4.64025e-16 245 63.546 0.00363101 -3.51239 63.546000 Cu 0.312606 0.559284 4.60767e-16 191 63.546 0.0357469 -3.51407 63.546000 Cu 0.31713 0.593168 5.56202e-17 192 63.546 0.0161376 -3.51617 63.546000 Cu 0.378453 0.557024 1 138 63.546 0.0110698 -3.51328 63.546000 Cu 0.347791 0.574889 0.5 193 63.546 0.0185015 -3.51531 63.546000 Cu 0.38312 0.590791 4.13713e-16 195 63.546 0.00798781 -3.51565 63.546000 Cu 0.413883 0.573238 0.5 144 63.546 0.00416513 -3.51434 63.546000 Cu 0.444695 0.555984 1 141 63.546 0.00154027 -3.51365 63.546000 Cu 0.449377 0.589463 1 142 63.546 0.00137611 -3.51517 63.546000 Cu 0.480266 0.572296 0.5 143 63.546 0.000646222 -3.51466 63.546000 Cu 0.511193 0.555305 1.23354e-15 96 63.546 0.00071064 -3.51453 63.546000 Cu 0.546864 0.571479 0.5 102 63.546 0.0011859 -3.51528 63.546000 Cu 0.51585 0.588511 1 145 63.546 0.000550567 -3.51542 63.546000 Cu 0.577907 0.554547 4.93101e-16 99 63.546 0.0028278 -3.51515 63.546000 Cu 0.582488 0.587452 8.63259e-16 100 63.546 0.00277063 -3.51576 63.546000 Cu 0.644822 0.553254 8.40336e-16 62 63.546 0.023386 -3.51242 63.546000 Cu 0.613638 0.570363 0.5 101 63.546 0.00696536 -3.51508 63.546000 Cu 0.649274 0.585826 7.00863e-16 103 63.546 0.0157189 -3.51358 63.546000 Cu 0.680527 0.568289 0.5 68 63.546 0.04595 -3.50708 63.546000 Cu 0.711836 0.550139 7.62274e-16 65 63.546 0.0886756 -3.49213 63.546000 Cu 0.716015 0.58271 1 66 63.546 0.0221826 -3.50731 63.546000 Cu 0.74704 0.563724 0.5 67 63.546 0.0128425 -3.50645 63.546000 Cu 0.751234 0.597011 0.5 72 63.546 0.00363101 -3.51239 63.546000 Cu 0.782022 0.578134 6.1689e-16 69 63.546 0.0156078 -3.51388 63.546000 Cu 0.847791 0.574889 2.47456e-16 38 63.546 0.0185015 -3.51531 63.546000 Cu 0.878453 0.557024 0.5 39 63.546 0.0110698 -3.51328 63.546000 Cu 0.812606 0.559284 0.5 40 63.546 0.0357469 -3.51407 63.546000 Cu 0.88312 0.590791 0.5 44 63.546 0.00798781 -3.51565 63.546000 Cu 0.81713 0.593168 0.5 71 63.546 0.0161376 -3.51617 63.546000 Cu 0.980266 0.572296 7.16065e-16 19 63.546 0.000646222 -3.51466 63.546000 Cu 0.944695 0.555984 0.5 21 63.546 0.00154027 -3.51365 63.546000 Cu 0.913883 0.573238 1 41 63.546 0.00416513 -3.51434 63.546000 Cu 0.949377 0.589463 0.5 43 63.546 0.00137611 -3.51517 63.546000 Cu 0.0514127 0.604556 1 23 63.546 0.00104828 -3.51595 63.546000 Cu 0.0869689 0.620427 0.5 29 63.546 0.002643 -3.51622 63.546000 Cu 0.020395 0.621718 0.5 47 63.546 0.000398614 -3.51588 63.546000 Cu 0.0559472 0.637672 1 49 63.546 0.000967979 -3.51624 63.546000 Cu 0.184813 0.600864 1 243 63.546 0.0183246 -3.51174 63.546000 Cu 0.118084 0.603162 3.72812e-17 26 63.546 0.00604217 -3.5157 63.546000 Cu 0.122504 0.636062 3.36617e-17 27 63.546 0.00472686 -3.51617 63.546000 Cu 0.15362 0.618561 0.5 28 63.546 0.00934901 -3.51482 63.546000 Cu 0.189102 0.633644 1.12085e-16 296 63.546 0.0075794 -3.51415 63.546000 Cu 0.220225 0.615555 0.5 248 63.546 0.00715264 -3.51239 63.546000 Cu 0.25549 0.630218 2.46852e-16 246 63.546 0.00116516 -3.51461 63.546000 Cu 0.286369 0.611698 0.5 247 63.546 0.00602093 -3.51549 63.546000 Cu 0.224514 0.648526 0.5 298 63.546 0.0025171 -3.51472 63.546000 Cu 0.290764 0.645081 0.5 252 63.546 0.00284897 -3.51612 63.546000 Cu 0.321582 0.626785 2.4649e-16 249 63.546 0.0082226 -3.51677 63.546000 Cu 0.387686 0.624397 1.02071e-16 196 63.546 0.0056543 -3.51649 63.546000 Cu 0.352352 0.608655 0.5 198 63.546 0.0104372 -3.51659 63.546000 Cu 0.356888 0.642204 0.5 251 63.546 0.00691516 -3.51704 63.546000 Cu 0.418505 0.606819 0.5 197 63.546 0.00316817 -3.51577 63.546000 Cu 0.423118 0.640303 0.5 202 63.546 0.00214748 -3.51629 63.546000 Cu 0.484878 0.605627 0.5 148 63.546 0.000464769 -3.51554 63.546000 Cu 0.453969 0.622894 3.36617e-17 199 63.546 0.00092315 -3.51585 63.546000 Cu 0.48946 0.638943 0.5 201 63.546 0.000246176 -3.51593 63.546000 Cu 0.520395 0.621718 1.83993e-16 146 63.546 0.000398614 -3.51588 63.546000 Cu 0.551413 0.604556 0.5 147 63.546 0.00104828 -3.51595 63.546000 Cu 0.586969 0.620427 1 149 63.546 0.002643 -3.51622 63.546000 Cu 0.555947 0.637672 0.5 152 63.546 0.000967979 -3.51624 63.546000 Cu 0.65362 0.618561 1 104 63.546 0.00934901 -3.51482 63.546000 Cu 0.618084 0.603162 0.5 106 63.546 0.00604217 -3.5157 63.546000 Cu 0.622504 0.636062 0.5 151 63.546 0.00472686 -3.51617 63.546000 Cu 0.684813 0.600864 0.5 105 63.546 0.0183246 -3.51174 63.546000 Cu 0.689102 0.633644 0.5 110 63.546 0.0075794 -3.51415 63.546000 Cu 0.720225 0.615555 1 107 63.546 0.00715264 -3.51239 63.546000 Cu 0.724514 0.648526 1 108 63.546 0.0025171 -3.51472 63.546000 Cu 0.75549 0.630218 0.5 109 63.546 0.00116516 -3.51461 63.546000 Cu 0.786369 0.611698 2.06434e-16 70 63.546 0.00602093 -3.51549 63.546000 Cu 0.790764 0.645081 7.23907e-19 111 63.546 0.00284897 -3.51612 63.546000 Cu 0.852352 0.608655 1 73 63.546 0.0104372 -3.51659 63.546000 Cu 0.856888 0.642204 1 74 63.546 0.00691516 -3.51704 63.546000 Cu 0.887686 0.624397 0.5 75 63.546 0.0056543 -3.51649 63.546000 Cu 0.821582 0.626785 0.5 76 63.546 0.0082226 -3.51677 63.546000 Cu 0.98946 0.638943 3.49165e-16 46 63.546 0.000246176 -3.51593 63.546000 Cu 0.918505 0.606819 6.1689e-16 42 63.546 0.00316817 -3.51577 63.546000 Cu 0.984878 0.605627 1 45 63.546 0.000464769 -3.51554 63.546000 Cu 0.953969 0.622894 0.5 48 63.546 0.00092315 -3.51585 63.546000 Cu 0.923118 0.640303 1 77 63.546 0.00214748 -3.51629 63.546000 Cu 0.0604228 0.670834 6.16286e-16 50 63.546 0.000905695 -3.5166 63.546000 Cu 0.0249606 0.654941 0.5 52 63.546 0.000286649 -3.51633 63.546000 Cu 0.0294024 0.688183 0.5 83 63.546 0.000250593 -3.51659 63.546000 Cu 0.0914717 0.653476 0.5 51 63.546 0.0024087 -3.51657 63.546000 Cu 0.095875 0.686597 0.5 56 63.546 0.00226225 -3.51692 63.546000 Cu 0.15801 0.651447 0.5 30 63.546 0.00579921 -3.51583 63.546000 Cu 0.126938 0.669081 1 53 63.546 0.00404248 -3.51673 63.546000 Cu 0.162366 0.684457 0.5 55 63.546 0.00387148 -3.51645 63.546000 Cu 0.193445 0.666584 1.43575e-16 297 63.546 0.00360436 -3.51554 63.546000 Cu 0.1977 0.699644 7.40919e-16 342 63.546 0.00217899 -3.51591 63.546000 Cu 0.259831 0.663388 5.44137e-17 299 63.546 0.000421372 -3.51546 63.546000 Cu 0.264023 0.696561 1.23426e-16 300 63.546 0.000125304 -3.51543 63.546000 Cu 0.228785 0.681591 0.5 302 63.546 0.00114744 -3.51542 63.546000 Cu 0.295062 0.678362 0.5 301 63.546 0.0019204 -3.51613 63.546000 Cu 0.326021 0.66021 3.72209e-16 250 63.546 0.00541426 -3.51685 63.546000 Cu 0.330283 0.693536 1 303 63.546 0.00399382 -3.51681 63.546000 Cu 0.361296 0.675617 0.5 256 63.546 0.00506417 -3.51721 63.546000 Cu 0.392243 0.657875 7.39833e-16 253 63.546 0.00389239 -3.51688 63.546000 Cu 0.3966 0.691248 1 254 63.546 0.00300678 -3.51712 63.546000 Cu 0.427595 0.6737 0.5 255 63.546 0.00156355 -3.51665 63.546000 Cu 0.458542 0.656273 8.61691e-16 200 63.546 0.000597531 -3.51621 63.546000 Cu 0.462978 0.68961 1 257 63.546 0.000335508 -3.51661 63.546000 Cu 0.49396 0.672245 0.5 206 63.546 9.96445e-05 -3.5164 63.546000 Cu 0.524961 0.654941 3.36617e-17 203 63.546 0.000286649 -3.51633 63.546000 Cu 0.529402 0.688183 4.15523e-16 204 63.546 0.000250593 -3.51659 63.546000 Cu 0.560423 0.670834 0.5 205 63.546 0.000905695 -3.5166 63.546000 Cu 0.591472 0.653476 1 150 63.546 0.0024087 -3.51657 63.546000 Cu 0.595875 0.686597 1 207 63.546 0.00226225 -3.51692 63.546000 Cu 0.65801 0.651447 2.07279e-16 153 63.546 0.00579921 -3.51583 63.546000 Cu 0.662366 0.684457 1 154 63.546 0.00387148 -3.51645 63.546000 Cu 0.626938 0.669081 0.5 156 63.546 0.00404248 -3.51673 63.546000 Cu 0.693445 0.666584 0.5 155 63.546 0.00360436 -3.51554 63.546000 Cu 0.6977 0.699644 0.5 160 63.546 0.00217899 -3.51591 63.546000 Cu 0.759831 0.663388 0.5 114 63.546 0.000421372 -3.51546 63.546000 Cu 0.728785 0.681591 1 157 63.546 0.00114744 -3.51542 63.546000 Cu 0.764023 0.696561 0.5 159 63.546 0.000125304 -3.51543 63.546000 Cu 0.795062 0.678362 1 112 63.546 0.0019204 -3.51613 63.546000 Cu 0.826021 0.66021 0.5 113 63.546 0.00541426 -3.51685 63.546000 Cu 0.861296 0.675617 9.87892e-16 115 63.546 0.00506417 -3.51721 63.546000 Cu 0.830283 0.693536 0.5 118 63.546 0.00399382 -3.51681 63.546000 Cu 0.892243 0.657875 0.5 80 63.546 0.00389239 -3.51688 63.546000 Cu 0.8966 0.691248 0.5 117 63.546 0.00300678 -3.51712 63.546000 Cu 0.99396 0.672245 1 81 63.546 9.96445e-05 -3.5164 63.546000 Cu 0.927595 0.6737 1 78 63.546 0.00156355 -3.51665 63.546000 Cu 0.958542 0.656273 0.5 79 63.546 0.000597531 -3.51621 63.546000 Cu 0.962978 0.68961 0.5 84 63.546 0.000335508 -3.51661 63.546000 Cu 0.0648167 0.704036 1 85 63.546 0.00088345 -3.51692 63.546000 Cu 0.0690794 0.737309 1 86 63.546 0.00112881 -3.51691 63.546000 Cu 0.0337472 0.721446 0.5 88 63.546 0.000294177 -3.51681 63.546000 Cu 0.00268537 0.738821 1 123 63.546 3.09549e-05 -3.51653 63.546000 Cu 0.100174 0.719793 0.5 87 63.546 0.00229864 -3.51709 63.546000 Cu 0.13128 0.702189 1 54 63.546 0.00363225 -3.51697 63.546000 Cu 0.166568 0.717581 0.5 57 63.546 0.00319953 -3.51661 63.546000 Cu 0.13544 0.735394 1 89 63.546 0.00339405 -3.51699 63.546000 Cu 0.201772 0.732795 2.47094e-16 343 63.546 0.00177991 -3.51625 63.546000 Cu 0.23292 0.714708 0.5 344 63.546 0.000476375 -3.5155 63.546000 Cu 0.268112 0.729707 1 345 63.546 0.000150195 -3.51547 63.546000 Cu 0.236979 0.747857 0.5 348 63.546 0.000428011 -3.51569 63.546000 Cu 0.29923 0.711585 0.5 306 63.546 0.00163812 -3.51588 63.546000 Cu 0.303363 0.74472 0.5 347 63.546 0.00227912 -3.51587 63.546000 Cu 0.334466 0.726756 1 304 63.546 0.00388669 -3.51672 63.546000 Cu 0.365551 0.708928 0.5 305 63.546 0.00422701 -3.51717 63.546000 Cu 0.3698 0.742141 0.5 310 63.546 0.00379055 -3.51709 63.546000 Cu 0.431941 0.707032 0.5 260 63.546 0.0011239 -3.51689 63.546000 Cu 0.400874 0.724529 1 307 63.546 0.0025893 -3.51713 63.546000 Cu 0.436246 0.74029 0.5 309 63.546 0.00104331 -3.51678 63.546000 Cu 0.467315 0.722901 1 258 63.546 0.000219613 -3.51665 63.546000 Cu 0.498363 0.705535 0.5 259 63.546 1.55178e-05 -3.51666 63.546000 Cu 0.533747 0.721446 6.67322e-16 261 63.546 0.000294177 -3.51681 63.546000 Cu 0.502685 0.738821 0.5 264 63.546 3.09549e-05 -3.51653 63.546000 Cu 0.564817 0.704036 0.5 210 63.546 0.00088345 -3.51692 63.546000 Cu 0.569079 0.737309 0.5 263 63.546 0.00112881 -3.51691 63.546000 Cu 0.600174 0.719793 2.28513e-16 208 63.546 0.00229864 -3.51709 63.546000 Cu 0.63128 0.702189 0.5 209 63.546 0.00363225 -3.51697 63.546000 Cu 0.666568 0.717581 4.54372e-16 211 63.546 0.00319953 -3.51661 63.546000 Cu 0.63544 0.735394 0.5 214 63.546 0.00339405 -3.51699 63.546000 Cu 0.73292 0.714708 1 158 63.546 0.000476375 -3.5155 63.546000 Cu 0.768112 0.729707 0.5 164 63.546 0.000150195 -3.51547 63.546000 Cu 0.701772 0.732795 0.5 213 63.546 0.00177991 -3.51625 63.546000 Cu 0.736979 0.747857 1 215 63.546 0.000428011 -3.51569 63.546000 Cu 0.79923 0.711585 1 161 63.546 0.00163812 -3.51588 63.546000 Cu 0.865551 0.708928 2.95716e-16 116 63.546 0.00422701 -3.51717 63.546000 Cu 0.803363 0.74472 2.47094e-16 162 63.546 0.00227912 -3.51587 63.546000 Cu 0.834466 0.726756 0.5 163 63.546 0.00388669 -3.51672 63.546000 Cu 0.8698 0.742141 1 165 63.546 0.00379055 -3.51709 63.546000 Cu 0.998363 0.705535 1 82 63.546 1.55178e-05 -3.51666 63.546000 Cu 0.931941 0.707032 4.92981e-16 119 63.546 0.0011239 -3.51689 63.546000 Cu 0.936246 0.74029 1 120 63.546 0.00104331 -3.51678 63.546000 Cu 0.967315 0.722901 0.5 121 63.546 0.000219613 -3.51665 63.546000 Cu 0.900874 0.724529 0.5 122 63.546 0.0025893 -3.51713 63.546000 Cu 0.00698872 0.772117 1 124 63.546 0.000115383 -3.51648 63.546000 Cu 0.0380337 0.754755 0.5 125 63.546 0.000499775 -3.51661 63.546000 Cu 0.0733871 0.770651 1 127 63.546 0.00163219 -3.51673 63.546000 Cu 0.0423938 0.788082 0.5 130 63.546 0.000658881 -3.51641 63.546000 Cu 0.104387 0.753089 0.5 91 63.546 0.00279201 -3.51702 63.546000 Cu 0.108738 0.786461 0.5 129 63.546 0.00364511 -3.51698 63.546000 Cu 0.17068 0.750806 0.5 380 63.546 0.00335391 -3.51694 63.546000 Cu 0.139685 0.768709 1 90 63.546 0.00413896 -3.51722 63.546000 Cu 0.174971 0.784131 0.5 384 63.546 0.00480269 -3.51699 63.546000 Cu 0.205932 0.766012 1 381 63.546 0.00215072 -3.51635 63.546000 Cu 0.210166 0.799293 8.01607e-16 382 63.546 0.00334639 -3.51604 63.546000 Cu 0.272236 0.762802 1 346 63.546 0.000692299 -3.5151 63.546000 Cu 0.24117 0.781001 0.5 383 63.546 0.000498256 -3.51517 63.546000 Cu 0.276427 0.79584 0 385 63.546 0.00231513 -3.51405 63.546000 Cu 0.307545 0.77776 0.5 352 63.546 0.00398259 -3.51509 63.546000 Cu 0.338675 0.759872 1 349 63.546 0.00455134 -3.51636 63.546000 Cu 0.342912 0.792887 1 350 63.546 0.0063576 -3.51565 63.546000 Cu 0.374025 0.775253 0.5 351 63.546 0.0042525 -3.51665 63.546000 Cu 0.405142 0.757728 2.64226e-17 308 63.546 0.0025033 -3.51698 63.546000 Cu 0.440517 0.773507 0.5 314 63.546 0.000969226 -3.5168 63.546000 Cu 0.409451 0.790871 1 353 63.546 0.0023188 -3.51671 63.546000 Cu 0.47161 0.756164 2.21757e-16 311 63.546 0.00022222 -3.51659 63.546000 Cu 0.475947 0.789411 2.86667e-16 312 63.546 0.000232201 -3.51645 63.546000 Cu 0.538034 0.754755 1 262 63.546 0.000499775 -3.51661 63.546000 Cu 0.506989 0.772117 0.5 313 63.546 0.000115383 -3.51648 63.546000 Cu 0.542394 0.788082 7.30784e-16 315 63.546 0.000658881 -3.51641 63.546000 Cu 0.573387 0.770651 0.5 268 63.546 0.00163219 -3.51673 63.546000 Cu 0.604387 0.753089 6.16407e-16 265 63.546 0.00279201 -3.51702 63.546000 Cu 0.608738 0.786461 6.16648e-16 266 63.546 0.00364511 -3.51698 63.546000 Cu 0.639685 0.768709 0.5 267 63.546 0.00413896 -3.51722 63.546000 Cu 0.67068 0.750806 2.46008e-16 212 63.546 0.00335391 -3.51694 63.546000 Cu 0.674971 0.784131 1.06137e-15 269 63.546 0.00480269 -3.51699 63.546000 Cu 0.74117 0.781001 1 216 63.546 0.000498256 -3.51517 63.546000 Cu 0.772236 0.762802 0.5 217 63.546 0.000692299 -3.5151 63.546000 Cu 0.705932 0.766012 0.5 218 63.546 0.00215072 -3.51635 63.546000 Cu 0.776427 0.79584 0.5 222 63.546 0.00231513 -3.51405 63.546000 Cu 0.710166 0.799293 0.5 271 63.546 0.00334639 -3.51604 63.546000 Cu 0.874025 0.775253 1 166 63.546 0.0042525 -3.51665 63.546000 Cu 0.838675 0.759872 0.5 168 63.546 0.00455134 -3.51636 63.546000 Cu 0.807545 0.77776 3.36617e-17 219 63.546 0.00398259 -3.51509 63.546000 Cu 0.842912 0.792887 0.5 221 63.546 0.0063576 -3.51565 63.546000 Cu 0.97161 0.756164 0.5 126 63.546 0.00022222 -3.51659 63.546000 Cu 0.905142 0.757728 0.5 167 63.546 0.0025033 -3.51698 63.546000 Cu 0.940517 0.773507 1 169 63.546 0.000969226 -3.5168 63.546000 Cu 0.975947 0.789411 0.5 171 63.546 0.000232201 -3.51645 63.546000 Cu 0.909451 0.790871 0.5 172 63.546 0.0023188 -3.51671 63.546000 Cu 0.0777732 0.804034 5.58736e-16 128 63.546 0.00206421 -3.51653 63.546000 Cu 0.0113959 0.805409 5.97223e-17 173 63.546 0.000201131 -3.51612 63.546000 Cu 0.0158795 0.838721 1.2415e-16 174 63.546 0.000369017 -3.5156 63.546000 Cu 0.0468076 0.821453 0.5 175 63.546 0.000965957 -3.5159 63.546000 Cu 0.0822475 0.837512 3.67624e-16 177 63.546 0.00287993 -3.51574 63.546000 Cu 0.144031 0.802123 6.92055e-16 131 63.546 0.00604569 -3.51715 63.546000 Cu 0.148409 0.835693 4.35551e-17 132 63.546 0.0102089 -3.51671 63.546000 Cu 0.113106 0.819931 0.5 133 63.546 0.00510375 -3.51669 63.546000 Cu 0.179235 0.817571 0.5 412 63.546 0.00813563 -3.51691 63.546000 Cu 0.214396 0.832687 5.24471e-16 413 63.546 0.00713862 -3.51549 63.546000 Cu 0.280586 0.8288 1 386 63.546 0.00706021 -3.51205 63.546000 Cu 0.245333 0.814169 0.5 388 63.546 0.00137895 -3.51431 63.546000 Cu 0.249531 0.847353 0.5 415 63.546 0.00373919 -3.51205 63.546000 Cu 0.31174 0.810692 0.5 387 63.546 0.00836768 -3.51393 63.546000 Cu 0.315991 0.843473 0.5 392 63.546 0.0189855 -3.51166 63.546000 Cu 0.378346 0.808269 0.5 356 63.546 0.00518847 -3.51629 63.546000 Cu 0.347194 0.825767 6.19785e-16 389 63.546 0.0103077 -3.51504 63.546000 Cu 0.382722 0.841184 0.5 391 63.546 0.00622751 -3.51584 63.546000 Cu 0.413847 0.823927 1 354 63.546 0.00249522 -3.51634 63.546000 Cu 0.444922 0.806684 0.5 355 63.546 0.000878894 -3.51645 63.546000 Cu 0.480393 0.822649 7.24269e-16 357 63.546 0.000278307 -3.516 63.546000 Cu 0.44937 0.839812 0.5 360 63.546 0.000903132 -3.51596 63.546000 Cu 0.546808 0.821453 6.15442e-16 316 63.546 0.000965957 -3.5159 63.546000 Cu 0.511396 0.805409 0.5 318 63.546 0.000201131 -3.51612 63.546000 Cu 0.515879 0.838721 0.5 359 63.546 0.000369017 -3.5156 63.546000 Cu 0.577773 0.804034 0.5 317 63.546 0.00206421 -3.51653 63.546000 Cu 0.582247 0.837512 0.5 322 63.546 0.00287993 -3.51574 63.546000 Cu 0.644031 0.802123 0.5 272 63.546 0.00604569 -3.51715 63.546000 Cu 0.613106 0.819931 1.2234e-16 319 63.546 0.00510375 -3.51669 63.546000 Cu 0.648409 0.835693 0.5 321 63.546 0.0102089 -3.51671 63.546000 Cu 0.679235 0.817571 5.27246e-17 270 63.546 0.00813563 -3.51691 63.546000 Cu 0.745333 0.814169 1 273 63.546 0.00137895 -3.51431 63.546000 Cu 0.749531 0.847353 1 274 63.546 0.00373919 -3.51205 63.546000 Cu 0.714396 0.832687 0.5 276 63.546 0.00713862 -3.51549 63.546000 Cu 0.780586 0.8288 0.5 275 63.546 0.00706021 -3.51205 63.546000 Cu 0.81174 0.810692 0 220 63.546 0.00836768 -3.51393 63.546000 Cu 0.878346 0.808269 2.46973e-16 223 63.546 0.00518847 -3.51629 63.546000 Cu 0.882722 0.841184 1 224 63.546 0.00622751 -3.51584 63.546000 Cu 0.847194 0.825767 0.5 226 63.546 0.0103077 -3.51504 63.546000 Cu 0.815991 0.843473 1 277 63.546 0.0189855 -3.51166 63.546000 Cu 0.944922 0.806684 1.24029e-16 170 63.546 0.000878894 -3.51645 63.546000 Cu 0.980393 0.822649 0.5 176 63.546 0.000278307 -3.516 63.546000 Cu 0.913847 0.823927 0.5 225 63.546 0.00249522 -3.51634 63.546000 Cu 0.94937 0.839812 1 227 63.546 0.000903132 -3.51596 63.546000 Cu 0.086842 0.871071 2.46611e-16 178 63.546 0.00345118 -3.51445 63.546000 Cu 0.0513763 0.854873 0.5 180 63.546 0.00118121 -3.5151 63.546000 Cu 0.0204723 0.872047 3.34566e-16 231 63.546 0.000639972 -3.51481 63.546000 Cu 0.0559641 0.888353 0.5 233 63.546 0.00155008 -3.51382 63.546000 Cu 0.183609 0.851189 0.5 416 63.546 0.0165416 -3.5162 63.546000 Cu 0.117628 0.853539 0.5 179 63.546 0.00760993 -3.51548 63.546000 Cu 0.152928 0.869448 1 181 63.546 0.0185841 -3.5154 63.546000 Cu 0.122199 0.887309 0.5 183 63.546 0.0109331 -3.51351 63.546000 Cu 0.188061 0.885063 0.5 434 63.546 0.0370195 -3.51424 63.546000 Cu 0.218719 0.866218 6.67925e-16 414 63.546 0.0166585 -3.51382 63.546000 Cu 0.284783 0.861611 3.70158e-16 417 63.546 0.0234314 -3.50678 63.546000 Cu 0.253673 0.880599 0.5 420 63.546 0.0132293 -3.50594 63.546000 Cu 0.288857 0.894148 9.02109e-16 418 63.546 0.0949246 -3.49096 63.546000 Cu 0.32027 0.876032 0.5 419 63.546 0.0474441 -3.50694 63.546000 Cu 0.351553 0.858517 3.3903e-17 390 63.546 0.0159312 -3.5138 63.546000 Cu 0.387175 0.874004 0.5 396 63.546 0.00665538 -3.51531 63.546000 Cu 0.355898 0.8911 7.64205e-16 421 63.546 0.022827 -3.51267 63.546000 Cu 0.418298 0.856918 5.9481e-17 393 63.546 0.00252904 -3.51578 63.546000 Cu 0.422788 0.889852 7.81096e-16 394 63.546 0.00228568 -3.51557 63.546000 Cu 0.484917 0.855871 4.92016e-16 358 63.546 0.000400105 -3.51541 63.546000 Cu 0.45391 0.872898 0.5 395 63.546 0.000980118 -3.51537 63.546000 Cu 0.489479 0.889073 5.16628e-16 397 63.546 0.000646225 -3.5148 63.546000 Cu 0.551376 0.854873 1.21858e-16 361 63.546 0.00118121 -3.5151 63.546000 Cu 0.520472 0.872047 0.5 364 63.546 0.000639972 -3.51481 63.546000 Cu 0.555964 0.888353 3.81258e-17 362 63.546 0.00155008 -3.51382 63.546000 Cu 0.586842 0.871071 0.5 363 63.546 0.00345118 -3.51445 63.546000 Cu 0.617628 0.853539 1.22461e-16 320 63.546 0.00760993 -3.51548 63.546000 Cu 0.652928 0.869448 0.5 326 63.546 0.0185841 -3.5154 63.546000 Cu 0.622199 0.887309 2.46852e-16 365 63.546 0.0109331 -3.51351 63.546000 Cu 0.683609 0.851189 1.30665e-16 323 63.546 0.0165416 -3.5162 63.546000 Cu 0.688061 0.885063 9.62797e-17 324 63.546 0.0370195 -3.51424 63.546000 Cu 0.718719 0.866218 0.5 325 63.546 0.0166585 -3.51382 63.546000 Cu 0.753673 0.880599 1 327 63.546 0.0132293 -3.50594 63.546000 Cu 0.784783 0.861611 0.5 280 63.546 0.0234314 -3.50678 63.546000 Cu 0.788857 0.894148 0.5 329 63.546 0.0949246 -3.49096 63.546000 Cu 0.82027 0.876032 1 278 63.546 0.0474441 -3.50694 63.546000 Cu 0.851553 0.858517 0.5 279 63.546 0.0159312 -3.5138 63.546000 Cu 0.887175 0.874004 1 281 63.546 0.00665538 -3.51531 63.546000 Cu 0.855898 0.8911 0.5 284 63.546 0.022827 -3.51267 63.546000 Cu 0.989479 0.889073 0.5 234 63.546 0.000646225 -3.5148 63.546000 Cu 0.95391 0.872898 1 228 63.546 0.000980118 -3.51537 63.546000 Cu 0.984917 0.855871 0.5 229 63.546 0.000400105 -3.51541 63.546000 Cu 0.918298 0.856918 0.5 230 63.546 0.00252904 -3.51578 63.546000 Cu 0.922788 0.889852 0.5 283 63.546 0.00228568 -3.51557 63.546000 Cu 0.024998 0.905396 1 232 63.546 0.00117725 -3.51386 63.546000 Cu 0.0604015 0.921885 0.5 238 63.546 0.00305452 -3.51242 63.546000 Cu 0.02904 0.938786 1 289 63.546 0.00927446 -3.51443 63.546000 Cu 0.0913892 0.904752 1 235 63.546 0.00385338 -3.51213 63.546000 Cu 0.0956979 0.938501 1 236 63.546 0.0100812 -3.51061 63.546000 Cu 0.157501 0.903484 3.61954e-19 182 63.546 0.0345266 -3.51222 63.546000 Cu 0.12676 0.921265 0.5 237 63.546 0.0133687 -3.50841 63.546000 Cu 0.162214 0.937833 5.91673e-16 239 63.546 0.060355 -3.50056 63.546000 Cu 0.192594 0.91941 0.5 438 63.546 0.0957993 -3.50568 63.546000 Cu 0.22305 0.900036 3.16709e-16 435 63.546 0.0476377 -3.50885 63.546000 Cu 0.227651 0.934475 1.59947e-15 436 63.546 0.243997 -3.47752 63.546000 Cu 0.257541 0.914098 0.5 437 63.546 0.0705944 -3.48546 63.546000 Cu 0.261329 0.948415 0.5 442 63.546 5.69467 -3.36317 63.546000 Cu 0.293002 0.926115 2.46165e-15 439 63.546 0.489804 -3.4378 63.546000 Cu 0.324468 0.908281 0.5 424 63.546 0.126183 -3.4993 63.546000 Cu 0.329001 0.940156 0.5 441 63.546 0.373047 -3.48409 63.546000 Cu 0.360282 0.923514 2.16955e-15 422 63.546 0.0251939 -3.51378 63.546000 Cu 0.391576 0.906727 0.5 423 63.546 0.00572751 -3.51531 63.546000 Cu 0.395811 0.93939 0.5 428 63.546 0.0124263 -3.51455 63.546000 Cu 0.427157 0.922742 6.13753e-16 425 63.546 0.00354837 -3.5154 63.546000 Cu 0.458384 0.905964 0.5 400 63.546 0.00135478 -3.51516 63.546000 Cu 0.462424 0.939041 0.5 427 63.546 0.0100253 -3.51532 63.546000 Cu 0.493836 0.922293 6.16045e-16 398 63.546 0.00287252 -3.51458 63.546000 Cu 0.524998 0.905396 0.5 399 63.546 0.00117725 -3.51386 63.546000 Cu 0.52904 0.938786 0.5 404 63.546 0.00927446 -3.51443 63.546000 Cu 0.560402 0.921885 1 401 63.546 0.00305452 -3.51242 63.546000 Cu 0.591389 0.904752 0.5 368 63.546 0.00385338 -3.51213 63.546000 Cu 0.595698 0.938501 0.5 403 63.546 0.0100812 -3.51061 63.546000 Cu 0.62676 0.921265 2.48059e-16 366 63.546 0.0133687 -3.50841 63.546000 Cu 0.657501 0.903484 0.5 367 63.546 0.0345266 -3.51222 63.546000 Cu 0.662214 0.937833 0.5 372 63.546 0.060355 -3.50056 63.546000 Cu 0.692594 0.91941 1 369 63.546 0.0957993 -3.50568 63.546000 Cu 0.72305 0.900036 0.5 330 63.546 0.0476377 -3.50885 63.546000 Cu 0.757541 0.914098 1 328 63.546 0.0705944 -3.48546 63.546000 Cu 0.727651 0.934475 0.5 371 63.546 0.243997 -3.47752 63.546000 Cu 0.761329 0.948415 1 373 63.546 5.69467 -3.36317 63.546000 Cu 0.793002 0.926115 0.5 334 63.546 0.489804 -3.4378 63.546000 Cu 0.824468 0.908281 1 331 63.546 0.126183 -3.4993 63.546000 Cu 0.829001 0.940156 1 332 63.546 0.373047 -3.48409 63.546000 Cu 0.860282 0.923514 0.5 333 63.546 0.0251939 -3.51378 63.546000 Cu 0.891576 0.906727 1 282 63.546 0.00572751 -3.51531 63.546000 Cu 0.895811 0.93939 1 335 63.546 0.0124263 -3.51455 63.546000 Cu 0.993836 0.922293 0.5 287 63.546 0.00287252 -3.51458 63.546000 Cu 0.958384 0.905964 1 285 63.546 0.00135478 -3.51516 63.546000 Cu 0.962424 0.939041 1 286 63.546 0.0100253 -3.51532 63.546000 Cu 0.927157 0.922742 0.5 288 63.546 0.00354837 -3.5154 63.546000 Cu 0.0308746 0.972179 1 290 63.546 0.0285978 -3.51727 63.546000 Cu 0.0638314 0.955437 0.5 291 63.546 0.0236691 -3.51539 63.546000 Cu 0.063707 0.98893 0.5 295 63.546 0.0230544 -3.5152 63.546000 Cu 0.0979897 0.972201 9.88013e-16 293 63.546 0.0461018 -3.51501 63.546000 Cu 0.197795 0.954698 0.5 448 63.546 0.365608 -3.47107 63.546000 Cu 0.165832 0.972195 1 240 63.546 0.148988 -3.49457 63.546000 Cu 0.130881 0.955281 0.5 241 63.546 0.037937 -3.50869 63.546000 Cu 0.130766 0.989124 0.5 294 63.546 0.0370697 -3.50821 63.546000 Cu 0.197679 0.989643 0.5 452 63.546 0.37739 -3.47008 63.546000 Cu 0.235598 0.972161 3.69193e-16 449 63.546 4.60518 -3.46048 63.546000 Cu 0.261165 0.995956 0.5 451 63.546 5.67526 -3.36436 63.546000 Cu 0.29859 0.956974 9.47824e-15 440 63.546 5.56912 -3.23336 63.546000 Cu 0.298391 0.987296 9.97086e-15 453 63.546 7.02053 -3.23544 63.546000 Cu 0.331438 0.972156 0.5 446 63.546 3.36869 -3.43985 63.546000 Cu 0.364318 0.955916 5.16834e-15 443 63.546 0.0485674 -3.51062 63.546000 Cu 0.364172 0.988391 5.77762e-15 444 63.546 0.0466651 -3.51069 63.546000 Cu 0.397804 0.972157 0.5 445 63.546 0.0320152 -3.51525 63.546000 Cu 0.43054 0.95567 1.36818e-15 426 63.546 0.0243409 -3.51573 63.546000 Cu 0.43041 0.988652 5.71283e-16 447 63.546 0.0236987 -3.51561 63.546000 Cu 0.464196 0.972168 0.5 432 63.546 0.026581 -3.51703 63.546000 Cu 0.497046 0.95554 6.87229e-16 429 63.546 0.0207289 -3.51653 63.546000 Cu 0.496911 0.9888 6.7444e-17 430 63.546 0.0198526 -3.5163 63.546000 Cu 0.530875 0.972179 0.5 431 63.546 0.0285978 -3.51727 63.546000 Cu 0.563831 0.955437 4.93463e-16 402 63.546 0.0236691 -3.51539 63.546000 Cu 0.563707 0.98893 1 433 63.546 0.0230544 -3.5152 63.546000 Cu 0.59799 0.972201 0.5 408 63.546 0.0461018 -3.51501 63.546000 Cu 0.630881 0.955281 3.60747e-17 405 63.546 0.037937 -3.50869 63.546000 Cu 0.630766 0.989124 5.16508e-16 406 63.546 0.0370697 -3.50821 63.546000 Cu 0.665832 0.972195 0.5 407 63.546 0.148988 -3.49457 63.546000 Cu 0.697795 0.954698 1 370 63.546 0.365608 -3.47107 63.546000 Cu 0.697679 0.989643 1 409 63.546 0.37739 -3.47008 63.546000 Cu 0.761165 0.995956 1 374 63.546 5.67526 -3.36436 63.546000 Cu 0.735598 0.972161 0.5 376 63.546 4.60518 -3.46048 63.546000 Cu 0.79859 0.956974 0.5 375 63.546 5.56912 -3.23336 63.546000 Cu 0.798391 0.987296 0.5 379 63.546 7.02053 -3.23544 63.546000 Cu 0.864318 0.955916 0.5 338 63.546 0.0485674 -3.51062 63.546000 Cu 0.831438 0.972156 1 377 63.546 3.36869 -3.43985 63.546000 Cu 0.864172 0.988391 0.5 378 63.546 0.0466651 -3.51069 63.546000 Cu 0.897804 0.972157 1 336 63.546 0.0320152 -3.51525 63.546000 Cu 0.997046 0.95554 0.5 292 63.546 0.0207289 -3.51653 63.546000 Cu 0.996911 0.9888 0.5 340 63.546 0.0198526 -3.5163 63.546000 Cu 0.93054 0.95567 0.5 337 63.546 0.0243409 -3.51573 63.546000 Cu 0.964196 0.972168 1 339 63.546 0.026581 -3.51703 63.546000 Cu 0.93041 0.988652 0.5 341 63.546 0.0236987 -3.51561