Number of particles = 930 A = 1 Angstrom (basic length-scale) H0(1,1) = 27.521 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 111.418 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60587 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 0.0395171 0.00635393 1 466 63.546 7.64784 -3.58302 63.546000 Cu 0.103174 0.00413336 0.5 468 63.546 13.1239 -3.33201 63.546000 Cu 0.00436162 0.031034 1 470 63.546 0.216197 -3.52031 63.546000 Cu 0.088651 0.0402904 4.97921e-17 471 63.546 0.0217022 -3.53135 63.546000 Cu 0.0633945 0.0245781 0.5 472 63.546 0.294707 -3.50056 63.546000 Cu 0.123939 0.0189352 4.81083e-19 474 63.546 1.36174 -3.48017 63.546000 Cu 0.184182 0.0145049 0.5 476 63.546 9.13733 -3.31326 63.546000 Cu 0.148388 0.0347963 0.5 477 63.546 0.204011 -3.50634 63.546000 Cu 0.211254 0.0280257 1 475 63.546 0.129745 -3.48968 63.546000 Cu 0.244236 0.00485198 1 478 63.546 7.91751 -3.53325 63.546000 Cu 0.32869 0.0146915 0 479 63.546 2.68528 -3.37451 63.546000 Cu 0.271372 0.0202881 0.5 480 63.546 1.28798 -3.49374 63.546000 Cu 0.386325 0.0067703 0.5 482 63.546 3.68374 -3.54653 63.546000 Cu 0.236473 0.0425131 0.5 492 63.546 0.0358949 -3.54286 63.546000 Cu 0.29659 0.0361787 1 494 63.546 0.0335665 -3.52782 63.546000 Cu 0.382191 0.0449339 2.16487e-18 495 63.546 0.0310565 -3.51829 63.546000 Cu 0.356416 0.0295778 0.5 496 63.546 0.0718915 -3.5034 63.546000 Cu 0.448233 0.00394518 1 481 63.546 9.54435 -3.21336 63.546000 Cu 0.414962 0.0238041 4.97921e-17 498 63.546 0.350697 -3.48751 63.546000 Cu 0.504362 0.031034 4.9311e-17 499 63.546 0.216197 -3.52031 63.546000 Cu 0.479453 0.0166283 0.5 500 63.546 1.01604 -3.45106 63.546000 Cu 0.443122 0.0381728 0.5 501 63.546 0.0171703 -3.53549 63.546000 Cu 0.539517 0.00635393 6.25408e-17 502 63.546 7.64784 -3.58302 63.546000 Cu 0.563395 0.0245781 0.5 505 63.546 0.294707 -3.50056 63.546000 Cu 0.588651 0.0402904 9.21274e-17 529 63.546 0.0217022 -3.53135 63.546000 Cu 0.603174 0.00413336 0.5 504 63.546 13.1239 -3.33201 63.546000 Cu 0.623939 0.0189352 1 503 63.546 1.36174 -3.48017 63.546000 Cu 0.744236 0.00485198 1 506 63.546 7.91751 -3.53325 63.546000 Cu 0.684182 0.0145049 0.5 507 63.546 9.13733 -3.31326 63.546000 Cu 0.648388 0.0347963 0.5 531 63.546 0.204011 -3.50634 63.546000 Cu 0.711254 0.0280257 1 533 63.546 0.129745 -3.48968 63.546000 Cu 0.79659 0.0361787 1 534 63.546 0.0335665 -3.52782 63.546000 Cu 0.771372 0.0202881 0.5 535 63.546 1.28798 -3.49374 63.546000 Cu 0.736473 0.0425131 0.5 536 63.546 0.0358949 -3.54286 63.546000 Cu 0.948233 0.00394518 1 465 63.546 9.54435 -3.21336 63.546000 Cu 0.979453 0.0166283 0.5 467 63.546 1.01604 -3.45106 63.546000 Cu 0.82869 0.0146915 7.21625e-19 537 63.546 2.68528 -3.37451 63.546000 Cu 0.914962 0.0238041 1 538 63.546 0.350697 -3.48751 63.546000 Cu 0.886325 0.0067703 0.5 539 63.546 3.68374 -3.54653 63.546000 Cu 0.856416 0.0295778 0.5 540 63.546 0.0718915 -3.5034 63.546000 Cu 0.882191 0.0449339 1 571 63.546 0.0310565 -3.51829 63.546000 Cu 0.943122 0.0381728 0.5 572 63.546 0.0171703 -3.53549 63.546000 Cu 0.0291636 0.0465048 0.5 473 63.546 0.0144682 -3.53834 63.546000 Cu 0.0200484 0.0831819 1 483 63.546 0.000596462 -3.53926 63.546000 Cu 0.054496 0.061783 1 486 63.546 0.00251469 -3.53698 63.546000 Cu 0.140631 0.0705421 4.97921e-17 487 63.546 0.00239125 -3.53847 63.546000 Cu 0.114347 0.0557103 0.5 488 63.546 0.028119 -3.52605 63.546000 Cu 0.0801845 0.0769257 0.5 489 63.546 0.00449057 -3.5351 63.546000 Cu 0.175288 0.049273 1 490 63.546 0.0125674 -3.53916 63.546000 Cu 0.166615 0.085396 0.5 515 63.546 0.000262253 -3.54103 63.546000 Cu 0.26174 0.0575723 5.05137e-17 491 63.546 0.00178899 -3.53921 63.546000 Cu 0.201289 0.0639991 0.5 493 63.546 0.00338712 -3.54369 63.546000 Cu 0.322191 0.0511484 0.5 497 63.546 0.00263565 -3.5379 63.546000 Cu 0.227022 0.0789578 1.22676e-16 517 63.546 0.000267016 -3.54091 63.546000 Cu 0.313252 0.0875017 1.22676e-17 518 63.546 0.000400016 -3.53877 63.546000 Cu 0.287457 0.0725393 0.5 519 63.546 0.000156413 -3.54057 63.546000 Cu 0.347805 0.066175 1 521 63.546 0.00316529 -3.53559 63.546000 Cu 0.37376 0.0810304 0.5 524 63.546 0.000277973 -3.54019 63.546000 Cu 0.529164 0.0465048 0.5 527 63.546 0.0144682 -3.53834 63.546000 Cu 0.434307 0.0744874 1.08965e-16 522 63.546 0.00386195 -3.54311 63.546000 Cu 0.408538 0.0596389 0.5 523 63.546 0.00231764 -3.53797 63.546000 Cu 0.469177 0.0529002 1.52263e-16 525 63.546 0.0224306 -3.54337 63.546000 Cu 0.554496 0.061783 5.05137e-17 526 63.546 0.00251469 -3.53698 63.546000 Cu 0.494519 0.0680539 0.5 528 63.546 0.00356029 -3.54135 63.546000 Cu 0.459889 0.0895207 0.5 557 63.546 0.000844136 -3.54108 63.546000 Cu 0.520048 0.0831819 1 559 63.546 0.000596462 -3.53926 63.546000 Cu 0.580184 0.0769257 0.5 561 63.546 0.00449057 -3.5351 63.546000 Cu 0.675288 0.049273 1.49136e-17 530 63.546 0.0125674 -3.53916 63.546000 Cu 0.614347 0.0557103 0.5 532 63.546 0.028119 -3.52605 63.546000 Cu 0.640631 0.0705421 1 563 63.546 0.00239125 -3.53847 63.546000 Cu 0.727022 0.0789578 1 564 63.546 0.000267016 -3.54091 63.546000 Cu 0.701289 0.0639991 0.5 565 63.546 0.00338712 -3.54369 63.546000 Cu 0.666615 0.085396 0.5 566 63.546 0.000262253 -3.54103 63.546000 Cu 0.76174 0.0575723 1 567 63.546 0.00178899 -3.53921 63.546000 Cu 0.787457 0.0725393 0.5 570 63.546 0.000156413 -3.54057 63.546000 Cu 0.969177 0.0529002 0 469 63.546 0.0224306 -3.54337 63.546000 Cu 0.994519 0.0680539 0.5 484 63.546 0.00356029 -3.54135 63.546000 Cu 0.959889 0.0895207 0.5 485 63.546 0.000844136 -3.54108 63.546000 Cu 0.847805 0.066175 1 568 63.546 0.00316529 -3.53559 63.546000 Cu 0.822191 0.0511484 0.5 569 63.546 0.00263565 -3.5379 63.546000 Cu 0.908538 0.0596389 0.5 573 63.546 0.00231764 -3.53797 63.546000 Cu 0.813252 0.0875017 1 602 63.546 0.000400016 -3.53877 63.546000 Cu 0.87376 0.0810304 0.5 604 63.546 0.000277973 -3.54019 63.546000 Cu 0.934307 0.0744874 1 606 63.546 0.00386195 -3.54311 63.546000 Cu 0.106136 0.091841 1 513 63.546 0.000614232 -3.53868 63.546000 Cu 0.0716396 0.113148 1 510 63.546 0.000182209 -3.53883 63.546000 Cu 0.0457822 0.0982129 0.5 511 63.546 0.000776895 -3.53762 63.546000 Cu 0.0112618 0.119527 0.5 512 63.546 0.000170111 -3.53929 63.546000 Cu 0.192427 0.100318 4.81083e-19 514 63.546 4.17073e-05 -3.54009 63.546000 Cu 0.132034 0.10674 0.5 516 63.546 3.95285e-05 -3.53986 63.546000 Cu 0.0370227 0.13447 1 543 63.546 7.042e-05 -3.53971 63.546000 Cu 0.0974325 0.128059 0.5 545 63.546 3.14562e-05 -3.53962 63.546000 Cu 0.157846 0.12166 1 547 63.546 1.23053e-05 -3.53964 63.546000 Cu 0.252827 0.0939019 0.5 520 63.546 1.50433e-05 -3.54007 63.546000 Cu 0.244042 0.130173 1 548 63.546 8.04611e-06 -3.53979 63.546000 Cu 0.218235 0.115251 0.5 549 63.546 1.10828e-05 -3.53957 63.546000 Cu 0.278609 0.108839 1 551 63.546 0.000108356 -3.53911 63.546000 Cu 0.364869 0.117309 1 552 63.546 0.000302321 -3.54006 63.546000 Cu 0.339082 0.102398 0.5 553 63.546 4.04051e-05 -3.53934 63.546000 Cu 0.304465 0.123744 0.5 554 63.546 6.00093e-05 -3.53987 63.546000 Cu 0.399549 0.0959384 1 555 63.546 0.000679483 -3.5411 63.546000 Cu 0.390608 0.132276 0.5 588 63.546 5.4211e-05 -3.54052 63.546000 Cu 0.485545 0.10454 7.62517e-17 556 63.546 0.000108125 -3.53958 63.546000 Cu 0.425209 0.110908 0.5 558 63.546 0.000193695 -3.54026 63.546000 Cu 0.545782 0.0982129 0.5 562 63.546 0.000776895 -3.53762 63.546000 Cu 0.450923 0.125889 1 590 63.546 2.39568e-05 -3.54015 63.546000 Cu 0.537023 0.13447 5.02732e-17 591 63.546 7.042e-05 -3.53971 63.546000 Cu 0.511262 0.119527 0.5 592 63.546 0.000170111 -3.53929 63.546000 Cu 0.57164 0.113148 1 594 63.546 0.000182209 -3.53883 63.546000 Cu 0.597432 0.128059 0.5 597 63.546 3.14562e-05 -3.53962 63.546000 Cu 0.606136 0.091841 1 560 63.546 0.000614232 -3.53868 63.546000 Cu 0.657846 0.12166 1 595 63.546 1.23053e-05 -3.53964 63.546000 Cu 0.632034 0.10674 0.5 596 63.546 3.95285e-05 -3.53986 63.546000 Cu 0.692427 0.100318 1 598 63.546 4.17073e-05 -3.54009 63.546000 Cu 0.778609 0.108839 1 599 63.546 0.000108356 -3.53911 63.546000 Cu 0.752827 0.0939019 0.5 600 63.546 1.50433e-05 -3.54007 63.546000 Cu 0.718235 0.115251 0.5 601 63.546 1.10828e-05 -3.53957 63.546000 Cu 0.744042 0.130173 1 633 63.546 8.04611e-06 -3.53979 63.546000 Cu 0.950923 0.125889 1 508 63.546 2.39568e-05 -3.54015 63.546000 Cu 0.985545 0.10454 1.92433e-18 509 63.546 0.000108125 -3.53958 63.546000 Cu 0.899549 0.0959384 1 603 63.546 0.000679483 -3.5411 63.546000 Cu 0.839082 0.102398 0.5 605 63.546 4.04051e-05 -3.53934 63.546000 Cu 0.804465 0.123744 0.5 635 63.546 6.00093e-05 -3.53987 63.546000 Cu 0.864869 0.117309 1 637 63.546 0.000302321 -3.54006 63.546000 Cu 0.925209 0.110908 0.5 638 63.546 0.000193695 -3.54026 63.546000 Cu 0.890608 0.132276 0.5 639 63.546 5.4211e-05 -3.54052 63.546000 Cu 0.183602 0.136589 0.5 550 63.546 3.87376e-05 -3.54035 63.546000 Cu 0.00245337 0.155814 1.49136e-17 541 63.546 5.10363e-05 -3.54011 63.546000 Cu 0.123213 0.142998 1 544 63.546 1.8107e-05 -3.54066 63.546000 Cu 0.0628432 0.149407 0.5 546 63.546 5.36415e-06 -3.54058 63.546000 Cu 0.0282882 0.17075 0.5 576 63.546 2.41029e-05 -3.5399 63.546000 Cu 0.0886695 0.164348 1 578 63.546 1.75183e-05 -3.54024 63.546000 Cu 0.174878 0.17286 1 579 63.546 5.29071e-06 -3.53952 63.546000 Cu 0.14906 0.157941 0.5 580 63.546 3.83912e-05 -3.54034 63.546000 Cu 0.114495 0.179274 0.5 581 63.546 9.86596e-06 -3.53933 63.546000 Cu 0.209458 0.151521 1 582 63.546 1.00516e-05 -3.54026 63.546000 Cu 0.295623 0.160042 1.49136e-17 583 63.546 1.56288e-05 -3.53986 63.546000 Cu 0.269841 0.145098 0.5 584 63.546 3.73999e-05 -3.54038 63.546000 Cu 0.235282 0.166446 0.5 585 63.546 3.41323e-05 -3.53954 63.546000 Cu 0.330253 0.138681 1 586 63.546 8.06452e-05 -3.54076 63.546000 Cu 0.355973 0.153639 0.5 589 63.546 3.79087e-05 -3.54012 63.546000 Cu 0.261041 0.181379 1 617 63.546 2.90121e-05 -3.53992 63.546000 Cu 0.321418 0.174976 0.5 619 63.546 6.48675e-06 -3.53967 63.546000 Cu 0.381782 0.168581 4.97921e-17 621 63.546 1.46084e-05 -3.53932 63.546000 Cu 0.416322 0.147245 1 587 63.546 2.58228e-05 -3.54001 63.546000 Cu 0.476682 0.140864 0.5 593 63.546 5.2134e-05 -3.53988 63.546000 Cu 0.467935 0.17714 1 622 63.546 1.25949e-05 -3.53936 63.546000 Cu 0.442097 0.1622 0.5 623 63.546 2.66688e-05 -3.53944 63.546000 Cu 0.502453 0.155814 1 625 63.546 5.10363e-05 -3.54011 63.546000 Cu 0.58867 0.164348 8.9722e-17 626 63.546 1.75183e-05 -3.54024 63.546000 Cu 0.562843 0.149407 0.5 627 63.546 5.36415e-06 -3.54058 63.546000 Cu 0.528288 0.17075 0.5 628 63.546 2.41029e-05 -3.5399 63.546000 Cu 0.683602 0.136589 0.5 631 63.546 3.87376e-05 -3.54035 63.546000 Cu 0.623213 0.142998 1 629 63.546 1.8107e-05 -3.54066 63.546000 Cu 0.709458 0.151521 1.51541e-17 630 63.546 1.00516e-05 -3.54026 63.546000 Cu 0.64906 0.157941 0.5 632 63.546 3.83912e-05 -3.54034 63.546000 Cu 0.769841 0.145098 0.5 636 63.546 3.73999e-05 -3.54038 63.546000 Cu 0.614495 0.179274 0.5 662 63.546 9.86596e-06 -3.53933 63.546000 Cu 0.674878 0.17286 1 664 63.546 5.29071e-06 -3.53952 63.546000 Cu 0.761041 0.181379 1 665 63.546 2.90121e-05 -3.53992 63.546000 Cu 0.735282 0.166446 0.5 666 63.546 3.41323e-05 -3.53954 63.546000 Cu 0.795623 0.160042 1 668 63.546 1.56288e-05 -3.53986 63.546000 Cu 0.976682 0.140864 0.5 542 63.546 5.2134e-05 -3.53988 63.546000 Cu 0.967935 0.17714 1.49136e-17 574 63.546 1.25949e-05 -3.53936 63.546000 Cu 0.830253 0.138681 1 634 63.546 8.06452e-05 -3.54076 63.546000 Cu 0.881782 0.168581 1 669 63.546 1.46084e-05 -3.53932 63.546000 Cu 0.855973 0.153639 0.5 670 63.546 3.79087e-05 -3.54012 63.546000 Cu 0.821418 0.174976 0.5 671 63.546 6.48675e-06 -3.53967 63.546000 Cu 0.916322 0.147245 1 672 63.546 2.58228e-05 -3.54001 63.546000 Cu 0.942097 0.1622 0.5 673 63.546 2.66688e-05 -3.53944 63.546000 Cu 0.0541243 0.185677 1 575 63.546 1.6086e-05 -3.53952 63.546000 Cu 0.019663 0.207011 1 609 63.546 3.51023e-05 -3.5401 63.546000 Cu 0.10594 0.215533 1 610 63.546 2.95523e-06 -3.54001 63.546000 Cu 0.0799932 0.200602 0.5 611 63.546 2.62578e-05 -3.54008 63.546000 Cu 0.0456217 0.221941 0.5 612 63.546 5.74627e-06 -3.53989 63.546000 Cu 0.140334 0.194191 1 613 63.546 3.76976e-05 -3.5399 63.546000 Cu 0.166251 0.209125 0.5 616 63.546 1.15077e-05 -3.54002 63.546000 Cu 0.192216 0.224052 7.21625e-19 648 63.546 1.07337e-05 -3.53976 63.546000 Cu 0.226572 0.20272 1 614 63.546 1.7345e-05 -3.54006 63.546000 Cu 0.200687 0.187784 0.5 615 63.546 3.59758e-05 -3.53999 63.546000 Cu 0.347245 0.18991 1 618 63.546 3.19284e-05 -3.54023 63.546000 Cu 0.2869 0.196315 0.5 620 63.546 2.08504e-05 -3.54024 63.546000 Cu 0.252519 0.217652 0.5 650 63.546 6.10353e-06 -3.5396 63.546000 Cu 0.312815 0.211253 4.97921e-17 652 63.546 1.30117e-05 -3.53995 63.546000 Cu 0.399059 0.2198 1 653 63.546 4.30846e-06 -3.53996 63.546000 Cu 0.373123 0.204857 0.5 654 63.546 1.55302e-05 -3.54032 63.546000 Cu 0.338768 0.226195 0.5 655 63.546 2.19439e-06 -3.53985 63.546000 Cu 0.407582 0.183518 0.5 624 63.546 2.40875e-05 -3.53965 63.546000 Cu 0.433445 0.198464 1 656 63.546 1.55176e-05 -3.54019 63.546000 Cu 0.519663 0.207011 1 657 63.546 3.51023e-05 -3.5401 63.546000 Cu 0.493776 0.192071 0.5 658 63.546 2.16778e-05 -3.53982 63.546000 Cu 0.45936 0.213407 0.5 659 63.546 1.10441e-05 -3.54002 63.546000 Cu 0.554124 0.185677 1 660 63.546 1.6086e-05 -3.53952 63.546000 Cu 0.579993 0.200602 0.5 663 63.546 2.62578e-05 -3.54008 63.546000 Cu 0.545622 0.221941 0.5 693 63.546 5.74627e-06 -3.53989 63.546000 Cu 0.640334 0.194191 1 661 63.546 3.76976e-05 -3.5399 63.546000 Cu 0.700687 0.187784 0.5 667 63.546 3.59758e-05 -3.53999 63.546000 Cu 0.60594 0.215533 1 695 63.546 2.95523e-06 -3.54001 63.546000 Cu 0.692216 0.224052 1 696 63.546 1.07337e-05 -3.53976 63.546000 Cu 0.666251 0.209125 0.5 697 63.546 1.15077e-05 -3.54002 63.546000 Cu 0.726572 0.20272 4.81083e-19 699 63.546 1.7345e-05 -3.54006 63.546000 Cu 0.7869 0.196315 0.5 701 63.546 2.08504e-05 -3.54024 63.546000 Cu 0.752519 0.217652 0.5 702 63.546 6.10353e-06 -3.5396 63.546000 Cu 0.993776 0.192071 0.5 577 63.546 2.16778e-05 -3.53982 63.546000 Cu 0.95936 0.213407 0.5 608 63.546 1.10441e-05 -3.54002 63.546000 Cu 0.812815 0.211253 1 700 63.546 1.30117e-05 -3.53995 63.546000 Cu 0.847245 0.18991 1 703 63.546 3.19284e-05 -3.54023 63.546000 Cu 0.933445 0.198464 1.49136e-17 704 63.546 1.55176e-05 -3.54019 63.546000 Cu 0.907582 0.183518 0.5 705 63.546 2.40875e-05 -3.53965 63.546000 Cu 0.873123 0.204857 0.5 706 63.546 1.55302e-05 -3.54032 63.546000 Cu 0.838768 0.226195 0.5 736 63.546 2.19439e-06 -3.53985 63.546000 Cu 0.899059 0.2198 4.97921e-17 738 63.546 4.30846e-06 -3.53996 63.546000 Cu 0.0372629 0.258219 6.15787e-17 641 63.546 1.9952e-06 -3.54037 63.546000 Cu 0.0112941 0.243278 0.5 642 63.546 3.28712e-06 -3.54001 63.546000 Cu 0.0715963 0.236873 1 644 63.546 3.35884e-06 -3.54001 63.546000 Cu 0.157871 0.245402 0 645 63.546 1.31031e-06 -3.54054 63.546000 Cu 0.131904 0.23046 0.5 646 63.546 1.02558e-05 -3.54005 63.546000 Cu 0.0975633 0.251812 0.5 647 63.546 1.34108e-06 -3.54035 63.546000 Cu 0.123544 0.266749 1 679 63.546 7.60438e-06 -3.53997 63.546000 Cu 0.183846 0.26034 0.5 681 63.546 4.84003e-06 -3.54005 63.546000 Cu 0.278482 0.232588 9.59761e-17 649 63.546 1.05985e-05 -3.54008 63.546000 Cu 0.218184 0.23899 0.5 651 63.546 9.46612e-06 -3.54051 63.546000 Cu 0.244157 0.253936 1 683 63.546 7.70405e-06 -3.54018 63.546000 Cu 0.330413 0.262472 1 684 63.546 1.87449e-06 -3.53964 63.546000 Cu 0.304449 0.247536 0.5 685 63.546 4.70797e-06 -3.54006 63.546000 Cu 0.270119 0.26887 0.5 686 63.546 4.55503e-06 -3.53983 63.546000 Cu 0.364737 0.241134 0 687 63.546 3.49577e-06 -3.53991 63.546000 Cu 0.3907 0.256079 0.5 690 63.546 2.68424e-06 -3.53973 63.546000 Cu 0.450991 0.249679 1 688 63.546 2.52981e-06 -3.53996 63.546000 Cu 0.425017 0.234743 0.5 689 63.546 6.13528e-06 -3.53983 63.546000 Cu 0.485317 0.228346 1 691 63.546 8.29802e-06 -3.5398 63.546000 Cu 0.571596 0.236873 1 692 63.546 3.35884e-06 -3.54001 63.546000 Cu 0.511294 0.243278 0.5 694 63.546 3.28712e-06 -3.54001 63.546000 Cu 0.416672 0.271016 1 722 63.546 5.63259e-06 -3.54 63.546000 Cu 0.476958 0.264623 0.5 724 63.546 5.52804e-06 -3.54016 63.546000 Cu 0.537263 0.258219 1 726 63.546 1.9952e-06 -3.54037 63.546000 Cu 0.597563 0.251812 0.5 728 63.546 1.34108e-06 -3.54035 63.546000 Cu 0.631904 0.23046 0.5 698 63.546 1.02558e-05 -3.54005 63.546000 Cu 0.623544 0.266749 4.97921e-17 727 63.546 7.60438e-06 -3.53997 63.546000 Cu 0.657871 0.245402 4.97921e-17 730 63.546 1.31031e-06 -3.54054 63.546000 Cu 0.744157 0.253936 1 731 63.546 7.70405e-06 -3.54018 63.546000 Cu 0.718184 0.23899 0.5 732 63.546 9.46612e-06 -3.54051 63.546000 Cu 0.683846 0.26034 0.5 733 63.546 4.84003e-06 -3.54005 63.546000 Cu 0.778482 0.232588 1 734 63.546 1.05985e-05 -3.54008 63.546000 Cu 0.770119 0.26887 0.5 767 63.546 4.55503e-06 -3.53983 63.546000 Cu 0.985317 0.228346 4.95516e-17 607 63.546 8.29802e-06 -3.5398 63.546000 Cu 0.950991 0.249679 1 640 63.546 2.52981e-06 -3.53996 63.546000 Cu 0.976958 0.264623 0.5 643 63.546 5.52804e-06 -3.54016 63.546000 Cu 0.864737 0.241134 1 735 63.546 3.49577e-06 -3.53991 63.546000 Cu 0.804449 0.247536 0.5 737 63.546 4.70797e-06 -3.54006 63.546000 Cu 0.925017 0.234743 0.5 739 63.546 6.13528e-06 -3.53983 63.546000 Cu 0.830413 0.262472 1 769 63.546 1.87449e-06 -3.53964 63.546000 Cu 0.916672 0.271016 1 770 63.546 5.63259e-06 -3.54 63.546000 Cu 0.8907 0.256079 0.5 771 63.546 2.68424e-06 -3.53973 63.546000 Cu 0.00292335 0.279561 3.48785e-17 675 63.546 1.41805e-05 -3.54013 63.546000 Cu 0.0891903 0.288083 1 676 63.546 3.27211e-05 -3.54015 63.546000 Cu 0.0632298 0.27316 0.5 677 63.546 1.80953e-05 -3.54012 63.546000 Cu 0.028857 0.294494 0.5 678 63.546 7.21339e-05 -3.54006 63.546000 Cu 0.149514 0.281674 0.5 682 63.546 2.43534e-05 -3.53993 63.546000 Cu 0.0546733 0.309414 1.51301e-16 710 63.546 8.70413e-05 -3.53961 63.546000 Cu 0.115066 0.303008 0.5 712 63.546 0.000101922 -3.53971 63.546000 Cu 0.175416 0.296603 1 714 63.546 6.08523e-05 -3.53978 63.546000 Cu 0.140811 0.317913 1 711 63.546 3.8034e-05 -3.53948 63.546000 Cu 0.209811 0.275272 1.49136e-17 680 63.546 5.42686e-06 -3.53986 63.546000 Cu 0.26161 0.305133 8.03409e-17 715 63.546 7.31546e-05 -3.53975 63.546000 Cu 0.235747 0.290204 0.5 716 63.546 3.3565e-05 -3.54005 63.546000 Cu 0.201218 0.311522 0.5 717 63.546 4.18239e-05 -3.53922 63.546000 Cu 0.29607 0.283808 1 718 63.546 1.98466e-05 -3.54024 63.546000 Cu 0.382306 0.292359 4.32975e-17 719 63.546 6.10135e-05 -3.54029 63.546000 Cu 0.356376 0.277411 0.5 720 63.546 1.20145e-05 -3.54019 63.546000 Cu 0.321967 0.298747 0.5 721 63.546 6.74868e-05 -3.5401 63.546000 Cu 0.347728 0.313692 1 753 63.546 3.09841e-05 -3.53987 63.546000 Cu 0.502923 0.279561 1 723 63.546 1.41805e-05 -3.54013 63.546000 Cu 0.442615 0.285963 0.5 725 63.546 2.85922e-05 -3.5402 63.546000 Cu 0.56323 0.27316 0.5 729 63.546 1.80953e-05 -3.54012 63.546000 Cu 0.408132 0.307297 0.5 755 63.546 7.96746e-05 -3.54016 63.546000 Cu 0.468505 0.300899 6.56679e-17 757 63.546 9.57992e-05 -3.53994 63.546000 Cu 0.554673 0.309414 1 758 63.546 8.70413e-05 -3.53961 63.546000 Cu 0.528857 0.294494 0.5 759 63.546 7.21339e-05 -3.54006 63.546000 Cu 0.494255 0.315823 0.5 760 63.546 4.99493e-05 -3.5397 63.546000 Cu 0.58919 0.288083 1 761 63.546 3.27211e-05 -3.54015 63.546000 Cu 0.675416 0.296603 1 762 63.546 6.08523e-05 -3.53978 63.546000 Cu 0.649514 0.281674 0.5 763 63.546 2.43534e-05 -3.53993 63.546000 Cu 0.615066 0.303008 0.5 764 63.546 0.000101922 -3.53971 63.546000 Cu 0.709811 0.275272 1 765 63.546 5.42686e-06 -3.53986 63.546000 Cu 0.79607 0.283808 5.02732e-17 766 63.546 1.98466e-05 -3.54024 63.546000 Cu 0.735747 0.290204 0.5 768 63.546 3.3565e-05 -3.54005 63.546000 Cu 0.701218 0.311522 0.5 797 63.546 4.18239e-05 -3.53922 63.546000 Cu 0.76161 0.305133 1 799 63.546 7.31546e-05 -3.53975 63.546000 Cu 0.640811 0.317913 1 795 63.546 3.8034e-05 -3.53948 63.546000 Cu 0.968505 0.300899 4.9311e-17 674 63.546 9.57992e-05 -3.53994 63.546000 Cu 0.994255 0.315823 0.5 708 63.546 4.99493e-05 -3.5397 63.546000 Cu 0.856376 0.277411 0.5 772 63.546 1.20145e-05 -3.54019 63.546000 Cu 0.847728 0.313692 1 800 63.546 3.09841e-05 -3.53987 63.546000 Cu 0.821967 0.298747 0.5 801 63.546 6.74868e-05 -3.5401 63.546000 Cu 0.882306 0.292359 1.25563e-16 803 63.546 6.10135e-05 -3.54029 63.546000 Cu 0.942615 0.285963 0.5 804 63.546 2.85922e-05 -3.5402 63.546000 Cu 0.908132 0.307297 0.5 805 63.546 7.96746e-05 -3.54016 63.546000 Cu 0.0199096 0.33074 5.02732e-17 707 63.546 3.12981e-05 -3.53973 63.546000 Cu 0.0803424 0.324323 0.5 713 63.546 2.11227e-05 -3.53969 63.546000 Cu 0.0713933 0.360529 1 742 63.546 6.68906e-05 -3.53995 63.546000 Cu 0.0456553 0.345642 0.5 743 63.546 4.02116e-05 -3.54006 63.546000 Cu 0.106078 0.339226 1 745 63.546 3.69084e-05 -3.54002 63.546000 Cu 0.192309 0.347742 1 746 63.546 0.000127724 -3.53961 63.546000 Cu 0.166538 0.33282 0.5 747 63.546 8.14641e-05 -3.53992 63.546000 Cu 0.131899 0.354116 0.5 748 63.546 0.000188427 -3.53992 63.546000 Cu 0.226957 0.326439 5.05137e-17 749 63.546 4.64005e-05 -3.53957 63.546000 Cu 0.313051 0.335013 1 750 63.546 3.69141e-05 -3.53994 63.546000 Cu 0.287352 0.320069 0.5 751 63.546 2.3591e-05 -3.53956 63.546000 Cu 0.252656 0.341379 0.5 752 63.546 5.55674e-05 -3.53968 63.546000 Cu 0.373415 0.328639 0.5 756 63.546 5.21427e-05 -3.54004 63.546000 Cu 0.278355 0.356339 1 783 63.546 8.25394e-05 -3.5395 63.546000 Cu 0.338666 0.349983 0.5 785 63.546 0.00010101 -3.5402 63.546000 Cu 0.39905 0.343587 5.02732e-17 787 63.546 0.00012294 -3.54046 63.546000 Cu 0.21805 0.362677 0.5 781 63.546 0.000298537 -3.53956 63.546000 Cu 0.433822 0.322236 5.67678e-17 754 63.546 3.45655e-05 -3.54027 63.546000 Cu 0.485148 0.352078 1 788 63.546 6.42822e-05 -3.54076 63.546000 Cu 0.45948 0.337165 0.5 789 63.546 5.2765e-05 -3.54042 63.546000 Cu 0.424646 0.358523 0.5 790 63.546 0.000231363 -3.54083 63.546000 Cu 0.51991 0.33074 4.97921e-17 791 63.546 3.12981e-05 -3.53973 63.546000 Cu 0.580342 0.324323 0.5 793 63.546 2.11227e-05 -3.53969 63.546000 Cu 0.545655 0.345642 0.5 794 63.546 4.02116e-05 -3.54006 63.546000 Cu 0.571393 0.360529 1 826 63.546 6.68906e-05 -3.53995 63.546000 Cu 0.606078 0.339226 1 792 63.546 3.69084e-05 -3.54002 63.546000 Cu 0.726957 0.326439 6.39841e-17 796 63.546 4.64005e-05 -3.53957 63.546000 Cu 0.666538 0.33282 0.5 798 63.546 8.14641e-05 -3.53992 63.546000 Cu 0.787352 0.320069 0.5 802 63.546 2.3591e-05 -3.53956 63.546000 Cu 0.631899 0.354116 0.5 828 63.546 0.000188427 -3.53992 63.546000 Cu 0.692309 0.347742 5.05137e-17 830 63.546 0.000127724 -3.53961 63.546000 Cu 0.778355 0.356339 1 831 63.546 8.25394e-05 -3.5395 63.546000 Cu 0.752656 0.341379 0.5 832 63.546 5.55674e-05 -3.53968 63.546000 Cu 0.71805 0.362677 0.5 833 63.546 0.000298537 -3.53956 63.546000 Cu 0.95948 0.337165 0.5 709 63.546 5.2765e-05 -3.54042 63.546000 Cu 0.985148 0.352078 1 741 63.546 6.42822e-05 -3.54076 63.546000 Cu 0.813051 0.335013 1 834 63.546 3.69141e-05 -3.53994 63.546000 Cu 0.89905 0.343587 4.95516e-17 835 63.546 0.00012294 -3.54046 63.546000 Cu 0.873415 0.328639 0.5 836 63.546 5.21427e-05 -3.54004 63.546000 Cu 0.838666 0.349983 0.5 837 63.546 0.00010101 -3.5402 63.546000 Cu 0.933822 0.322236 1.66214e-16 838 63.546 3.45655e-05 -3.54027 63.546000 Cu 0.924646 0.358523 0.5 870 63.546 0.000231363 -3.54083 63.546000 Cu 0.0108506 0.366961 0.5 744 63.546 7.4522e-05 -3.54018 63.546000 Cu 0.00178578 0.40307 4.95516e-17 773 63.546 0.000318668 -3.53986 63.546000 Cu 0.0366338 0.38181 1 775 63.546 0.000136248 -3.53952 63.546000 Cu 0.122925 0.390271 4.95516e-17 776 63.546 0.00101704 -3.53815 63.546000 Cu 0.0971653 0.375392 0.5 777 63.546 0.000357344 -3.53913 63.546000 Cu 0.0624389 0.396636 0.5 778 63.546 0.000818503 -3.53869 63.546000 Cu 0.157623 0.369028 7.8176e-17 779 63.546 0.000289969 -3.53953 63.546000 Cu 0.183303 0.38396 0.5 782 63.546 0.000621585 -3.5387 63.546000 Cu 0.148576 0.405218 0.5 812 63.546 0.00143778 -3.53859 63.546000 Cu 0.243626 0.377657 1 780 63.546 0.000194422 -3.53958 63.546000 Cu 0.36424 0.364954 1 784 63.546 0.000414529 -3.54051 63.546000 Cu 0.303934 0.371332 0.5 786 63.546 0.000231997 -3.54011 63.546000 Cu 0.208787 0.39896 1 814 63.546 0.000483317 -3.53887 63.546000 Cu 0.269024 0.392685 0.5 816 63.546 0.000443498 -3.5402 63.546000 Cu 0.329388 0.386328 1 818 63.546 0.00100037 -3.54064 63.546000 Cu 0.389846 0.379892 0.5 820 63.546 0.000687521 -3.54036 63.546000 Cu 0.35479 0.401275 0.5 821 63.546 0.00173899 -3.54134 63.546000 Cu 0.294342 0.407734 1 815 63.546 0.00243179 -3.54137 63.546000 Cu 0.415393 0.394765 1 819 63.546 0.000522377 -3.53979 63.546000 Cu 0.450333 0.373423 1 822 63.546 0.000210284 -3.54018 63.546000 Cu 0.536634 0.38181 1 823 63.546 0.000136248 -3.53952 63.546000 Cu 0.510851 0.366961 0.5 824 63.546 7.4522e-05 -3.54018 63.546000 Cu 0.476039 0.388266 0.5 825 63.546 0.000139675 -3.53944 63.546000 Cu 0.597165 0.375392 0.5 829 63.546 0.000357344 -3.53913 63.546000 Cu 0.501786 0.40307 2.01814e-16 857 63.546 0.000318668 -3.53986 63.546000 Cu 0.562439 0.396636 0.5 859 63.546 0.000818503 -3.53869 63.546000 Cu 0.657623 0.369028 1 827 63.546 0.000289969 -3.53953 63.546000 Cu 0.622925 0.390271 3.65623e-17 861 63.546 0.00101704 -3.53815 63.546000 Cu 0.708787 0.39896 3.89677e-17 862 63.546 0.000483317 -3.53887 63.546000 Cu 0.683303 0.38396 0.5 863 63.546 0.000621585 -3.5387 63.546000 Cu 0.648576 0.405218 0.5 864 63.546 0.00143778 -3.53859 63.546000 Cu 0.743626 0.377657 1 865 63.546 0.000194422 -3.53958 63.546000 Cu 0.769024 0.392685 0.5 868 63.546 0.000443498 -3.5402 63.546000 Cu 0.794342 0.407734 8.9722e-17 897 63.546 0.00243179 -3.54137 63.546000 Cu 0.950333 0.373423 7.31246e-17 740 63.546 0.000210284 -3.54018 63.546000 Cu 0.976039 0.388266 0.5 774 63.546 0.000139675 -3.53944 63.546000 Cu 0.829388 0.386328 6.54273e-17 866 63.546 0.00100037 -3.54064 63.546000 Cu 0.803934 0.371332 0.5 867 63.546 0.000231997 -3.54011 63.546000 Cu 0.86424 0.364954 3.10299e-17 869 63.546 0.000414529 -3.54051 63.546000 Cu 0.889846 0.379892 0.5 871 63.546 0.000687521 -3.54036 63.546000 Cu 0.85479 0.401275 0.5 899 63.546 0.00173899 -3.54134 63.546000 Cu 0.915393 0.394765 1.83052e-16 901 63.546 0.000522377 -3.53979 63.546000 Cu 0.0536907 0.432601 1 807 63.546 0.00968094 -3.53343 63.546000 Cu 0.0276821 0.417828 0.5 808 63.546 0.00234936 -3.53784 63.546000 Cu 0.0882461 0.411478 1 810 63.546 0.00287076 -3.53709 63.546000 Cu 0.174065 0.420264 1 811 63.546 0.00156337 -3.53793 63.546000 Cu 0.113907 0.426443 0.5 813 63.546 0.00336013 -3.53776 63.546000 Cu 0.079357 0.447621 0.5 843 63.546 0.00899361 -3.53666 63.546000 Cu 0.139415 0.441534 1 845 63.546 0.00705676 -3.53286 63.546000 Cu 0.199159 0.435476 0.5 847 63.546 0.00223073 -3.53807 63.546000 Cu 0.0193118 0.453589 1 841 63.546 0.039223 -3.51991 63.546000 Cu 0.234143 0.414066 0.5 817 63.546 0.000972482 -3.54035 63.546000 Cu 0.223938 0.450755 1 846 63.546 0.0157747 -3.53826 63.546000 Cu 0.259261 0.429208 1.65974e-17 849 63.546 0.00610142 -3.54094 63.546000 Cu 0.345072 0.437549 4.97921e-17 850 63.546 0.00351488 -3.53935 63.546000 Cu 0.319648 0.422743 0.5 851 63.546 0.00631701 -3.5428 63.546000 Cu 0.284102 0.444337 0.5 852 63.546 0.0269679 -3.54293 63.546000 Cu 0.380322 0.416137 1 853 63.546 0.00137164 -3.54077 63.546000 Cu 0.370984 0.45215 0.5 883 63.546 0.00803504 -3.52885 63.546000 Cu 0.46688 0.424327 5.02732e-17 854 63.546 0.000758514 -3.54082 63.546000 Cu 0.441082 0.409564 0.5 855 63.546 0.0002951 -3.53963 63.546000 Cu 0.406137 0.430881 0.5 856 63.546 0.000696771 -3.53779 63.546000 Cu 0.588246 0.411478 1.5996e-16 858 63.546 0.00287076 -3.53709 63.546000 Cu 0.527682 0.417828 0.5 860 63.546 0.00234936 -3.53784 63.546000 Cu 0.431799 0.445623 1 885 63.546 0.00488531 -3.54282 63.546000 Cu 0.492953 0.438965 0.5 887 63.546 0.00681795 -3.5371 63.546000 Cu 0.553691 0.432601 1 889 63.546 0.00968094 -3.53343 63.546000 Cu 0.579357 0.447621 0.5 892 63.546 0.00899361 -3.53666 63.546000 Cu 0.519312 0.453589 1 886 63.546 0.039223 -3.51991 63.546000 Cu 0.639415 0.441534 7.62517e-17 890 63.546 0.00705676 -3.53286 63.546000 Cu 0.613907 0.426443 0.5 891 63.546 0.00336013 -3.53776 63.546000 Cu 0.674065 0.420264 2.95866e-17 893 63.546 0.00156337 -3.53793 63.546000 Cu 0.759261 0.429208 7.04787e-17 894 63.546 0.00610142 -3.54094 63.546000 Cu 0.734143 0.414066 0.5 895 63.546 0.000972482 -3.54035 63.546000 Cu 0.699159 0.435476 0.5 896 63.546 0.00223073 -3.53807 63.546000 Cu 0.723938 0.450755 4.95516e-17 915 63.546 0.0157747 -3.53826 63.546000 Cu 0.784102 0.444337 0.5 917 63.546 0.0269679 -3.54293 63.546000 Cu 0.96688 0.424327 5.14759e-17 806 63.546 0.000758514 -3.54082 63.546000 Cu 0.992953 0.438965 0.5 809 63.546 0.00681795 -3.5371 63.546000 Cu 0.880322 0.416137 7.36057e-17 898 63.546 0.00137164 -3.54077 63.546000 Cu 0.819648 0.422743 0.5 900 63.546 0.00631701 -3.5428 63.546000 Cu 0.941082 0.409564 0.5 902 63.546 0.0002951 -3.53963 63.546000 Cu 0.845072 0.437549 1 919 63.546 0.00351488 -3.53935 63.546000 Cu 0.931799 0.445623 1 920 63.546 0.00488531 -3.54282 63.546000 Cu 0.906137 0.430881 0.5 921 63.546 0.000696771 -3.53779 63.546000 Cu 0.870984 0.45215 0.5 922 63.546 0.00803504 -3.52885 63.546000 Cu 0.104859 0.462669 1 842 63.546 0.0399635 -3.52317 63.546000 Cu 0.0446151 0.468829 0.5 844 63.546 0.0442722 -3.51629 63.546000 Cu 0.164278 0.457022 0.5 848 63.546 0.0113954 -3.53387 63.546000 Cu 0.0111732 0.490885 0.5 873 63.546 3.26414 -3.5424 63.546000 Cu 0.0699595 0.483598 5.05137e-17 874 63.546 2.21558 -3.39581 63.546000 Cu 0.151003 0.493506 1 875 63.546 12.0711 -3.31761 63.546000 Cu 0.129447 0.478593 0.5 876 63.546 0.814247 -3.47278 63.546000 Cu 0.189176 0.47266 1 877 63.546 0.208145 -3.50367 63.546000 Cu 0.272599 0.48075 1 878 63.546 0.685348 -3.45829 63.546000 Cu 0.248177 0.46624 0.5 879 63.546 0.183293 -3.52213 63.546000 Cu 0.212942 0.490598 0.5 880 63.546 5.33182 -3.55263 63.546000 Cu 0.309393 0.459041 1 881 63.546 0.0108572 -3.53536 63.546000 Cu 0.395913 0.467051 1.27487e-17 882 63.546 0.0861464 -3.53084 63.546000 Cu 0.336048 0.473451 0.5 884 63.546 0.192597 -3.50085 63.546000 Cu 0.302983 0.493792 0.5 903 63.546 9.59973 -3.22237 63.546000 Cu 0.361579 0.490153 1 904 63.546 3.78013 -3.55015 63.546000 Cu 0.457952 0.460043 0.5 888 63.546 0.0225279 -3.5331 63.546000 Cu 0.421491 0.481076 0.5 906 63.546 0.547209 -3.45729 63.546000 Cu 0.4851 0.474256 4.97921e-17 907 63.546 0.303184 -3.48539 63.546000 Cu 0.569959 0.483598 5.00327e-17 908 63.546 2.21558 -3.39581 63.546000 Cu 0.544615 0.468829 0.5 909 63.546 0.0442722 -3.51629 63.546000 Cu 0.511173 0.490885 0.5 910 63.546 3.26414 -3.5424 63.546000 Cu 0.450349 0.49394 5.00327e-17 905 63.546 8.94887 -3.21565 63.546000 Cu 0.604859 0.462669 4.6184e-17 911 63.546 0.0399635 -3.52317 63.546000 Cu 0.689176 0.47266 6.27814e-17 912 63.546 0.208145 -3.50367 63.546000 Cu 0.664278 0.457022 0.5 913 63.546 0.0113954 -3.53387 63.546000 Cu 0.629447 0.478593 0.5 914 63.546 0.814247 -3.47278 63.546000 Cu 0.748177 0.46624 0.5 918 63.546 0.183293 -3.52213 63.546000 Cu 0.651003 0.493506 1.69582e-16 923 63.546 12.0711 -3.31761 63.546000 Cu 0.712942 0.490598 0.5 924 63.546 5.33182 -3.55263 63.546000 Cu 0.772599 0.48075 2.91055e-17 925 63.546 0.685348 -3.45829 63.546000 Cu 0.9851 0.474256 1 839 63.546 0.303184 -3.48539 63.546000 Cu 0.957952 0.460043 0.5 840 63.546 0.0225279 -3.5331 63.546000 Cu 0.809393 0.459041 4.95516e-17 916 63.546 0.0108572 -3.53536 63.546000 Cu 0.861579 0.490153 4.97921e-17 926 63.546 3.78013 -3.55015 63.546000 Cu 0.836048 0.473451 0.5 927 63.546 0.192597 -3.50085 63.546000 Cu 0.802983 0.493792 0.5 928 63.546 9.59973 -3.22237 63.546000 Cu 0.895913 0.467051 5.05137e-17 929 63.546 0.0861464 -3.53084 63.546000 Cu 0.921491 0.481076 0.5 930 63.546 0.547209 -3.45729 63.546000 Cu 0.950349 0.49394 2.83839e-17 872 63.546 8.94887 -3.21565 63.546000 Cu 0.023332 0.518418 0.5 3 63.546 1.157 -3.4837 63.546000 Cu 0.0449854 0.504122 1.05838e-16 43 63.546 10.9978 -3.33644 63.546000 Cu 0.0851801 0.523963 2.40542e-19 44 63.546 0.195322 -3.50291 63.546000 Cu 0.110454 0.506509 0.5 45 63.546 7.4497 -3.56048 63.546000 Cu 0.170161 0.514596 1.98206e-16 46 63.546 2.69787 -3.3743 63.546000 Cu 0.143467 0.529607 0.5 49 63.546 0.0701418 -3.50096 63.546000 Cu 0.0591417 0.539464 0.5 76 63.546 0.0337724 -3.53355 63.546000 Cu 0.254989 0.504856 3.39164e-17 18 63.546 7.80698 -3.51254 63.546000 Cu 0.37467 0.519674 1 19 63.546 1.37058 -3.50028 63.546000 Cu 0.316765 0.514397 0.5 21 63.546 4.10958 -3.33068 63.546000 Cu 0.202849 0.536258 1.44325e-18 47 63.546 0.0340952 -3.5256 63.546000 Cu 0.228413 0.520207 0.5 48 63.546 1.19777 -3.49582 63.546000 Cu 0.287762 0.528087 1 50 63.546 0.105736 -3.4891 63.546000 Cu 0.349734 0.535327 0.5 52 63.546 0.079082 -3.51229 63.546000 Cu 0.262433 0.542721 0.5 53 63.546 0.055592 -3.53761 63.546000 Cu 0.544985 0.504122 6.39841e-17 4 63.546 10.9978 -3.33644 63.546000 Cu 0.401359 0.504575 0.5 20 63.546 8.11763 -3.54822 63.546000 Cu 0.46278 0.514162 4.47407e-17 22 63.546 6.50538 -3.30132 63.546000 Cu 0.499271 0.534099 1 23 63.546 0.243218 -3.49995 63.546000 Cu 0.523332 0.518418 0.5 24 63.546 1.157 -3.4837 63.546000 Cu 0.435379 0.527347 0.5 25 63.546 0.133611 -3.48204 63.546000 Cu 0.58518 0.523963 1 26 63.546 0.195322 -3.50291 63.546000 Cu 0.559142 0.539464 0.5 29 63.546 0.0337724 -3.53355 63.546000 Cu 0.41036 0.541625 1 54 63.546 0.0257931 -3.5414 63.546000 Cu 0.670161 0.514596 1.39514e-17 5 63.546 2.69787 -3.3743 63.546000 Cu 0.610454 0.506509 0.5 6 63.546 7.4497 -3.56048 63.546000 Cu 0.754989 0.504856 5.05137e-17 7 63.546 7.80698 -3.51254 63.546000 Cu 0.787762 0.528087 7.21625e-19 8 63.546 0.105736 -3.4891 63.546000 Cu 0.728413 0.520207 0.5 10 63.546 1.19777 -3.49582 63.546000 Cu 0.643467 0.529607 0.5 28 63.546 0.0701418 -3.50096 63.546000 Cu 0.702849 0.536258 7.21625e-19 30 63.546 0.0340952 -3.5256 63.546000 Cu 0.762433 0.542721 0.5 32 63.546 0.055592 -3.53761 63.546000 Cu 0.96278 0.514162 7.21625e-19 1 63.546 6.50538 -3.30132 63.546000 Cu 0.901359 0.504575 0.5 2 63.546 8.11763 -3.54822 63.546000 Cu 0.816765 0.514397 0.5 9 63.546 4.10958 -3.33068 63.546000 Cu 0.87467 0.519674 1.08484e-16 11 63.546 1.37058 -3.50028 63.546000 Cu 0.91036 0.541625 1 12 63.546 0.0257931 -3.5414 63.546000 Cu 0.935379 0.527347 0.5 13 63.546 0.133611 -3.48204 63.546000 Cu 0.849734 0.535327 0.5 14 63.546 0.079082 -3.51229 63.546000 Cu 0.999271 0.534099 1 15 63.546 0.243218 -3.49995 63.546000 Cu 0.118273 0.545461 2.29477e-16 77 63.546 0.00967445 -3.52941 63.546000 Cu 0.0329706 0.55479 2.03017e-16 16 63.546 0.040356 -3.52192 63.546000 Cu 0.0064458 0.56948 0.5 40 63.546 0.0045948 -3.53714 63.546000 Cu 0.0408055 0.590653 0.5 42 63.546 0.00172556 -3.5381 63.546000 Cu 0.15254 0.566846 5.74894e-17 78 63.546 0.00207974 -3.53751 63.546000 Cu 0.177523 0.551489 0.5 79 63.546 0.0104606 -3.53853 63.546000 Cu 0.0927641 0.56076 0.5 80 63.546 0.00763926 -3.53453 63.546000 Cu 0.0669418 0.575842 7.21625e-19 109 63.546 0.00944516 -3.5333 63.546000 Cu 0.127073 0.581999 0.5 111 63.546 0.00267369 -3.53791 63.546000 Cu 0.18713 0.588199 0 112 63.546 0.000639489 -3.53982 63.546000 Cu 0.323404 0.549698 2.40542e-18 51 63.546 0.00753685 -3.53815 63.546000 Cu 0.384912 0.55645 0.5 57 63.546 0.00483635 -3.53373 63.546000 Cu 0.237552 0.557913 1.44325e-18 81 63.546 0.00793105 -3.53892 63.546000 Cu 0.272658 0.579411 1.068e-16 82 63.546 0.00364086 -3.54136 63.546000 Cu 0.297985 0.564404 0.5 83 63.546 0.0112106 -3.54346 63.546000 Cu 0.212422 0.573037 0.5 84 63.546 0.00263468 -3.54112 63.546000 Cu 0.358826 0.571093 7.40868e-17 85 63.546 0.00195455 -3.54067 63.546000 Cu 0.333032 0.585904 0.5 88 63.546 0.00298168 -3.54185 63.546000 Cu 0.471959 0.548353 0.5 56 63.546 0.0179622 -3.53912 63.546000 Cu 0.445663 0.562922 5.05137e-17 55 63.546 0.00196913 -3.5422 63.546000 Cu 0.532971 0.55479 5.00327e-17 58 63.546 0.040356 -3.52192 63.546000 Cu 0.566942 0.575842 1 59 63.546 0.00944516 -3.5333 63.546000 Cu 0.592764 0.56076 0.5 60 63.546 0.00763926 -3.53453 63.546000 Cu 0.506446 0.56948 0.5 61 63.546 0.0045948 -3.53714 63.546000 Cu 0.419651 0.577697 0.5 87 63.546 0.000427597 -3.53846 63.546000 Cu 0.480221 0.5842 1 89 63.546 0.000405202 -3.54 63.546000 Cu 0.540806 0.590653 0.5 91 63.546 0.00172556 -3.5381 63.546000 Cu 0.618273 0.545461 3.7765e-17 27 63.546 0.00967445 -3.52941 63.546000 Cu 0.737552 0.557913 1.05838e-17 31 63.546 0.00793105 -3.53892 63.546000 Cu 0.677523 0.551489 0.5 33 63.546 0.0104606 -3.53853 63.546000 Cu 0.797985 0.564404 0.5 37 63.546 0.0112106 -3.54346 63.546000 Cu 0.65254 0.566846 0 62 63.546 0.00207974 -3.53751 63.546000 Cu 0.68713 0.588199 5.00327e-17 63 63.546 0.000639489 -3.53982 63.546000 Cu 0.712422 0.573037 0.5 64 63.546 0.00263468 -3.54112 63.546000 Cu 0.627073 0.581999 0.5 65 63.546 0.00267369 -3.53791 63.546000 Cu 0.772658 0.579411 5.62867e-17 66 63.546 0.00364086 -3.54136 63.546000 Cu 0.971959 0.548353 0.5 17 63.546 0.0179622 -3.53912 63.546000 Cu 0.823404 0.549698 9.86221e-18 34 63.546 0.00753685 -3.53815 63.546000 Cu 0.858826 0.571093 1.69341e-16 35 63.546 0.00195455 -3.54067 63.546000 Cu 0.884912 0.55645 0.5 36 63.546 0.00483635 -3.53373 63.546000 Cu 0.945663 0.562922 1 38 63.546 0.00196913 -3.5422 63.546000 Cu 0.980221 0.5842 4.40191e-17 39 63.546 0.000405202 -3.54 63.546000 Cu 0.919651 0.577697 0.5 41 63.546 0.000427597 -3.53846 63.546000 Cu 0.833032 0.585904 0.5 68 63.546 0.00298168 -3.54185 63.546000 Cu 0.0147876 0.605454 1.09687e-16 74 63.546 0.00026118 -3.53962 63.546000 Cu 0.101284 0.596992 1 110 63.546 0.00240023 -3.5373 63.546000 Cu 0.161498 0.603262 0.5 115 63.546 0.000946961 -3.53873 63.546000 Cu 0.0493548 0.626716 1.16422e-16 142 63.546 0.000134884 -3.5399 63.546000 Cu 0.0752767 0.611868 0.5 143 63.546 0.000627092 -3.53883 63.546000 Cu 0.135682 0.618216 1.33741e-16 144 63.546 0.000568192 -3.53843 63.546000 Cu 0.196018 0.624537 0.5 146 63.546 0.000217262 -3.53942 63.546000 Cu 0.10985 0.633121 0.5 147 63.546 0.000223534 -3.53958 63.546000 Cu 0.393587 0.592458 0 86 63.546 0.000921312 -3.54048 63.546000 Cu 0.221697 0.609548 1.26284e-16 113 63.546 0.000305835 -3.53971 63.546000 Cu 0.247223 0.594474 0.5 114 63.546 0.000967763 -3.54109 63.546000 Cu 0.307445 0.600859 3.96894e-17 116 63.546 0.00146811 -3.54075 63.546000 Cu 0.342216 0.622253 1 117 63.546 0.000556763 -3.54053 63.546000 Cu 0.367871 0.607323 0.5 118 63.546 0.000834763 -3.54085 63.546000 Cu 0.281931 0.615864 0.5 119 63.546 0.000370073 -3.54014 63.546000 Cu 0.256314 0.63087 1 148 63.546 8.05634e-05 -3.53996 63.546000 Cu 0.514788 0.605454 1 90 63.546 0.00026118 -3.53962 63.546000 Cu 0.454247 0.598987 0.5 92 63.546 0.000180471 -3.53948 63.546000 Cu 0.575277 0.611868 0.5 96 63.546 0.000627092 -3.53883 63.546000 Cu 0.428349 0.613808 1 120 63.546 0.000326133 -3.54017 63.546000 Cu 0.463062 0.635155 1 121 63.546 9.29217e-05 -3.54019 63.546000 Cu 0.488852 0.62029 0.5 122 63.546 0.000169607 -3.53983 63.546000 Cu 0.402614 0.628695 0.5 123 63.546 0.000339293 -3.5405 63.546000 Cu 0.549355 0.626716 1 124 63.546 0.000134884 -3.5399 63.546000 Cu 0.747223 0.594474 0.5 69 63.546 0.000967763 -3.54109 63.546000 Cu 0.601284 0.596992 1 93 63.546 0.00240023 -3.5373 63.546000 Cu 0.635682 0.618216 4.97921e-17 94 63.546 0.000568192 -3.53843 63.546000 Cu 0.661498 0.603262 0.5 95 63.546 0.000946961 -3.53873 63.546000 Cu 0.721697 0.609548 4.95516e-17 97 63.546 0.000305835 -3.53971 63.546000 Cu 0.756314 0.63087 4.97921e-17 98 63.546 8.05634e-05 -3.53996 63.546000 Cu 0.781931 0.615864 0.5 99 63.546 0.000370073 -3.54014 63.546000 Cu 0.696018 0.624537 0.5 100 63.546 0.000217262 -3.53942 63.546000 Cu 0.60985 0.633121 0.5 126 63.546 0.000223534 -3.53958 63.546000 Cu 0.893587 0.592458 5.05137e-17 70 63.546 0.000921312 -3.54048 63.546000 Cu 0.807445 0.600859 4.95516e-17 67 63.546 0.00146811 -3.54075 63.546000 Cu 0.928349 0.613808 4.95516e-17 71 63.546 0.000326133 -3.54017 63.546000 Cu 0.954247 0.598987 0.5 72 63.546 0.000180471 -3.53948 63.546000 Cu 0.867871 0.607323 0.5 73 63.546 0.000834763 -3.54085 63.546000 Cu 0.988852 0.62029 0.5 75 63.546 0.000169607 -3.53983 63.546000 Cu 0.842216 0.622253 2.14082e-17 101 63.546 0.000556763 -3.54053 63.546000 Cu 0.902614 0.628695 0.5 103 63.546 0.000339293 -3.5405 63.546000 Cu 0.963062 0.635155 8.34679e-17 105 63.546 9.29217e-05 -3.54019 63.546000 Cu 0.0235571 0.641601 0.5 107 63.546 6.44084e-05 -3.54009 63.546000 Cu 0.0324473 0.677814 1.45287e-16 140 63.546 2.8401e-05 -3.53946 63.546000 Cu 0.170237 0.639491 5.00327e-17 145 63.546 0.000203434 -3.53979 63.546000 Cu 0.0840405 0.648005 1 176 63.546 3.04418e-05 -3.5396 63.546000 Cu 0.118636 0.669304 1.76317e-16 177 63.546 1.08467e-05 -3.53963 63.546000 Cu 0.144482 0.65441 0.5 178 63.546 0.000123106 -3.53959 63.546000 Cu 0.0582515 0.662903 0.5 179 63.546 2.696e-05 -3.53981 63.546000 Cu 0.179072 0.675709 0.5 183 63.546 8.86894e-05 -3.53962 63.546000 Cu 0.316595 0.637232 0.5 150 63.546 0.000113829 -3.54059 63.546000 Cu 0.290946 0.652206 1 149 63.546 5.38737e-05 -3.5399 63.546000 Cu 0.230617 0.645845 0.5 151 63.546 7.97308e-05 -3.53981 63.546000 Cu 0.376951 0.64363 5.05137e-17 152 63.546 0.000180598 -3.54068 63.546000 Cu 0.351293 0.658589 0.5 155 63.546 2.84979e-05 -3.54018 63.546000 Cu 0.204865 0.66079 4.97921e-17 180 63.546 0.000109591 -3.53955 63.546000 Cu 0.2652 0.667151 0.5 182 63.546 1.81239e-05 -3.53962 63.546000 Cu 0.32558 0.673534 1 184 63.546 2.16075e-05 -3.53986 63.546000 Cu 0.385939 0.679928 0.5 186 63.546 3.11395e-05 -3.53981 63.546000 Cu 0.58404 0.648005 1 125 63.546 3.04418e-05 -3.5396 63.546000 Cu 0.523557 0.641601 0.5 127 63.546 6.44084e-05 -3.54009 63.546000 Cu 0.411632 0.664981 1 153 63.546 8.17664e-05 -3.54004 63.546000 Cu 0.437353 0.650055 0.5 154 63.546 0.000128807 -3.54022 63.546000 Cu 0.497804 0.656486 1 156 63.546 4.00865e-05 -3.54046 63.546000 Cu 0.532447 0.677814 5.02732e-17 157 63.546 2.8401e-05 -3.53946 63.546000 Cu 0.558251 0.662903 0.5 158 63.546 2.696e-05 -3.53981 63.546000 Cu 0.472016 0.671399 0.5 159 63.546 5.1215e-05 -3.54036 63.546000 Cu 0.670237 0.639491 4.97921e-17 128 63.546 0.000203434 -3.53979 63.546000 Cu 0.704865 0.66079 1 129 63.546 0.000109591 -3.53955 63.546000 Cu 0.730617 0.645845 0.5 130 63.546 7.97308e-05 -3.53981 63.546000 Cu 0.644482 0.65441 0.5 131 63.546 0.000123106 -3.53959 63.546000 Cu 0.790946 0.652206 1 132 63.546 5.38737e-05 -3.5399 63.546000 Cu 0.7652 0.667151 0.5 135 63.546 1.81239e-05 -3.53962 63.546000 Cu 0.618636 0.669304 1 160 63.546 1.08467e-05 -3.53963 63.546000 Cu 0.679072 0.675709 0.5 162 63.546 8.86894e-05 -3.53962 63.546000 Cu 0.816595 0.637232 0.5 104 63.546 0.000113829 -3.54059 63.546000 Cu 0.876951 0.64363 1 102 63.546 0.000180598 -3.54068 63.546000 Cu 0.997804 0.656486 4.95516e-17 106 63.546 4.00865e-05 -3.54046 63.546000 Cu 0.937353 0.650055 0.5 108 63.546 0.000128807 -3.54022 63.546000 Cu 0.82558 0.673534 4.97921e-17 133 63.546 2.16075e-05 -3.53986 63.546000 Cu 0.851293 0.658589 0.5 134 63.546 2.84979e-05 -3.54018 63.546000 Cu 0.911632 0.664981 4.95516e-17 136 63.546 8.17664e-05 -3.54004 63.546000 Cu 0.972016 0.671399 0.5 138 63.546 5.1215e-05 -3.54036 63.546000 Cu 0.885939 0.679928 0.5 139 63.546 3.11395e-05 -3.53981 63.546000 Cu 0.00666661 0.692724 0.5 141 63.546 8.6584e-05 -3.53972 63.546000 Cu 0.0411199 0.714062 0.5 174 63.546 1.9729e-05 -3.54051 63.546000 Cu 0.067011 0.699125 1 209 63.546 5.77352e-05 -3.53984 63.546000 Cu 0.0928337 0.684205 0.5 210 63.546 2.97658e-05 -3.53934 63.546000 Cu 0.153241 0.690609 2.11677e-17 211 63.546 3.74153e-05 -3.53974 63.546000 Cu 0.187683 0.71193 9.30896e-17 212 63.546 1.8654e-05 -3.54021 63.546000 Cu 0.127357 0.705525 0.5 214 63.546 4.68976e-05 -3.54038 63.546000 Cu 0.101424 0.720464 0 242 63.546 1.08401e-05 -3.54061 63.546000 Cu 0.161729 0.726867 0.5 244 63.546 1.25666e-05 -3.53993 63.546000 Cu 0.239458 0.682091 5.00327e-17 181 63.546 7.06651e-05 -3.53936 63.546000 Cu 0.36014 0.69486 1 185 63.546 3.2156e-05 -3.54005 63.546000 Cu 0.299802 0.688467 0.5 187 63.546 3.3776e-05 -3.53953 63.546000 Cu 0.213604 0.697008 0.5 213 63.546 4.16398e-05 -3.5395 63.546000 Cu 0.273955 0.703399 3.53596e-17 215 63.546 5.6639e-05 -3.53988 63.546000 Cu 0.308306 0.724732 3.53596e-17 216 63.546 7.12713e-06 -3.54006 63.546000 Cu 0.334262 0.709796 0.5 217 63.546 2.52424e-05 -3.54024 63.546000 Cu 0.24799 0.718331 0.5 218 63.546 4.05801e-06 -3.54005 63.546000 Cu 0.394579 0.716204 1.34222e-16 219 63.546 1.30382e-05 -3.54014 63.546000 Cu 0.592834 0.684205 0.5 163 63.546 2.97658e-05 -3.53934 63.546000 Cu 0.446299 0.686324 7.74544e-17 188 63.546 4.51646e-05 -3.54015 63.546000 Cu 0.480824 0.707672 1.41438e-16 189 63.546 4.85079e-05 -3.54035 63.546000 Cu 0.506667 0.692724 0.5 190 63.546 8.6584e-05 -3.53972 63.546000 Cu 0.4205 0.701269 0.5 191 63.546 6.20836e-05 -3.54052 63.546000 Cu 0.567011 0.699125 1 192 63.546 5.77352e-05 -3.53984 63.546000 Cu 0.54112 0.714062 0.5 195 63.546 1.9729e-05 -3.54051 63.546000 Cu 0.45488 0.722608 0.5 221 63.546 6.78256e-06 -3.53995 63.546000 Cu 0.739458 0.682091 1 164 63.546 7.06651e-05 -3.53936 63.546000 Cu 0.653241 0.690609 7.21625e-19 161 63.546 3.74153e-05 -3.53974 63.546000 Cu 0.773955 0.703399 1.24119e-16 165 63.546 5.6639e-05 -3.53988 63.546000 Cu 0.799802 0.688467 0.5 166 63.546 3.3776e-05 -3.53953 63.546000 Cu 0.713604 0.697008 0.5 167 63.546 4.16398e-05 -3.5395 63.546000 Cu 0.601424 0.720464 2.18171e-16 193 63.546 1.08401e-05 -3.54061 63.546000 Cu 0.627357 0.705525 0.5 194 63.546 4.68976e-05 -3.54038 63.546000 Cu 0.687683 0.71193 3.29542e-17 196 63.546 1.8654e-05 -3.54021 63.546000 Cu 0.74799 0.718331 0.5 198 63.546 4.05801e-06 -3.54005 63.546000 Cu 0.661729 0.726867 0.5 199 63.546 1.25666e-05 -3.53993 63.546000 Cu 0.946299 0.686324 5.02732e-17 137 63.546 4.51646e-05 -3.54015 63.546000 Cu 0.86014 0.69486 3.60812e-18 168 63.546 3.2156e-05 -3.54005 63.546000 Cu 0.894579 0.716204 1 169 63.546 1.30382e-05 -3.54014 63.546000 Cu 0.9205 0.701269 0.5 170 63.546 6.20836e-05 -3.54052 63.546000 Cu 0.834262 0.709796 0.5 171 63.546 2.52424e-05 -3.54024 63.546000 Cu 0.980824 0.707672 2.79028e-17 172 63.546 4.85079e-05 -3.54035 63.546000 Cu 0.95488 0.722608 0.5 175 63.546 6.78256e-06 -3.53995 63.546000 Cu 0.808306 0.724732 1 200 63.546 7.12713e-06 -3.54006 63.546000 Cu 0.0151892 0.729015 8.56328e-17 173 63.546 2.36146e-05 -3.54008 63.546000 Cu 0.0235519 0.765294 0.5 208 63.546 8.21663e-06 -3.54032 63.546000 Cu 0.135757 0.7418 7.21625e-19 243 63.546 7.01176e-06 -3.53957 63.546000 Cu 0.0754791 0.73541 0.5 245 63.546 5.76185e-06 -3.53993 63.546000 Cu 0.19603 0.748193 0.5 249 63.546 1.26823e-05 -3.53973 63.546000 Cu 0.0495242 0.750348 2.38136e-17 275 63.546 6.04435e-06 -3.53989 63.546000 Cu 0.0838358 0.771687 1 276 63.546 2.9174e-06 -3.54012 63.546000 Cu 0.109804 0.756745 0.5 277 63.546 3.48714e-06 -3.53977 63.546000 Cu 0.170073 0.763134 1.38552e-16 278 63.546 6.12938e-06 -3.53998 63.546000 Cu 0.36861 0.731137 0.5 222 63.546 2.82132e-06 -3.5401 63.546000 Cu 0.222011 0.73326 1.44325e-18 246 63.546 5.01281e-06 -3.53961 63.546000 Cu 0.256331 0.75459 2.81434e-17 247 63.546 1.00004e-05 -3.54 63.546000 Cu 0.282314 0.739657 0.5 248 63.546 1.14411e-05 -3.53987 63.546000 Cu 0.342625 0.746069 1 250 63.546 1.78433e-06 -3.54002 63.546000 Cu 0.376948 0.767413 1 251 63.546 5.50829e-06 -3.53996 63.546000 Cu 0.316635 0.760994 0.5 253 63.546 1.27144e-05 -3.53993 63.546000 Cu 0.230362 0.769528 0.5 280 63.546 1.35212e-05 -3.54001 63.546000 Cu 0.428917 0.737547 6.9276e-17 220 63.546 5.28015e-06 -3.53999 63.546000 Cu 0.515189 0.729015 2.98272e-17 223 63.546 2.36146e-05 -3.54008 63.546000 Cu 0.549524 0.750348 4.97921e-17 224 63.546 6.04435e-06 -3.53989 63.546000 Cu 0.575479 0.73541 0.5 225 63.546 5.76185e-06 -3.53993 63.546000 Cu 0.489217 0.743948 0.5 226 63.546 3.03824e-06 -3.53995 63.546000 Cu 0.402942 0.75248 0.5 252 63.546 5.73937e-06 -3.54026 63.546000 Cu 0.463249 0.758891 5.38813e-17 254 63.546 6.5677e-06 -3.54046 63.546000 Cu 0.523552 0.765294 0.5 256 63.546 8.21663e-06 -3.54032 63.546000 Cu 0.583836 0.771687 1.76317e-16 258 63.546 2.9174e-06 -3.54012 63.546000 Cu 0.722011 0.73326 9.21274e-17 197 63.546 5.01281e-06 -3.53961 63.546000 Cu 0.782314 0.739657 0.5 203 63.546 1.14411e-05 -3.53987 63.546000 Cu 0.635757 0.7418 1.56352e-17 227 63.546 7.01176e-06 -3.53957 63.546000 Cu 0.670073 0.763134 1 228 63.546 6.12938e-06 -3.53998 63.546000 Cu 0.69603 0.748193 0.5 229 63.546 1.26823e-05 -3.53973 63.546000 Cu 0.609804 0.756745 0.5 230 63.546 3.48714e-06 -3.53977 63.546000 Cu 0.756331 0.75459 1 231 63.546 1.00004e-05 -3.54 63.546000 Cu 0.730362 0.769528 0.5 234 63.546 1.35212e-05 -3.54001 63.546000 Cu 0.842625 0.746069 5.02732e-17 201 63.546 1.78433e-06 -3.54002 63.546000 Cu 0.86861 0.731137 0.5 202 63.546 2.82132e-06 -3.5401 63.546000 Cu 0.928917 0.737547 7.72139e-17 204 63.546 5.28015e-06 -3.53999 63.546000 Cu 0.963249 0.758891 1 205 63.546 6.5677e-06 -3.54046 63.546000 Cu 0.989217 0.743948 0.5 206 63.546 3.03824e-06 -3.53995 63.546000 Cu 0.902942 0.75248 0.5 207 63.546 5.73937e-06 -3.54026 63.546000 Cu 0.816635 0.760994 0.5 233 63.546 1.27144e-05 -3.53993 63.546000 Cu 0.876948 0.767413 4.97921e-17 235 63.546 5.50829e-06 -3.53996 63.546000 Cu 0.0319372 0.801565 1 240 63.546 1.29029e-05 -3.5396 63.546000 Cu 0.00603434 0.816493 0.5 272 63.546 3.13022e-05 -3.53975 63.546000 Cu 0.144128 0.778084 0.5 281 63.546 3.1237e-06 -3.54025 63.546000 Cu 0.0578758 0.786635 0.5 308 63.546 2.19243e-05 -3.53991 63.546000 Cu 0.118167 0.793029 5.05137e-17 309 63.546 2.20232e-05 -3.54012 63.546000 Cu 0.152606 0.814363 1 310 63.546 1.94781e-05 -3.53957 63.546000 Cu 0.178486 0.799422 0.5 311 63.546 1.80815e-05 -3.54016 63.546000 Cu 0.0922658 0.807967 0.5 312 63.546 2.28905e-05 -3.53968 63.546000 Cu 0.204421 0.784476 4.97921e-17 279 63.546 2.41664e-06 -3.54018 63.546000 Cu 0.290658 0.775928 1 282 63.546 2.32139e-05 -3.53984 63.546000 Cu 0.325026 0.797273 1 283 63.546 3.65033e-05 -3.54056 63.546000 Cu 0.35097 0.782335 0.5 284 63.546 2.42307e-05 -3.53988 63.546000 Cu 0.264715 0.790869 0.5 285 63.546 2.2367e-05 -3.54026 63.546000 Cu 0.385356 0.803685 0.5 289 63.546 3.42843e-05 -3.5405 63.546000 Cu 0.238817 0.805819 4.95516e-17 313 63.546 2.33736e-05 -3.54022 63.546000 Cu 0.299167 0.812221 0.5 315 63.546 1.95348e-05 -3.54018 63.546000 Cu 0.49758 0.780234 1 255 63.546 1.9946e-05 -3.53979 63.546000 Cu 0.437273 0.773829 0.5 257 63.546 3.01526e-05 -3.53987 63.546000 Cu 0.557876 0.786635 0.5 261 63.546 2.19243e-05 -3.53991 63.546000 Cu 0.41129 0.788747 7.21625e-19 286 63.546 2.00877e-05 -3.53998 63.546000 Cu 0.445696 0.810092 7.33652e-17 287 63.546 3.1499e-05 -3.54011 63.546000 Cu 0.471618 0.795162 0.5 288 63.546 9.45036e-06 -3.53982 63.546000 Cu 0.531937 0.801565 5.02732e-17 290 63.546 1.29029e-05 -3.5396 63.546000 Cu 0.592266 0.807967 0.5 292 63.546 2.28905e-05 -3.53968 63.546000 Cu 0.506034 0.816493 0.5 293 63.546 3.13022e-05 -3.53975 63.546000 Cu 0.790658 0.775928 5.05137e-17 232 63.546 2.32139e-05 -3.53984 63.546000 Cu 0.618167 0.793029 1 259 63.546 2.20232e-05 -3.54012 63.546000 Cu 0.644128 0.778084 0.5 260 63.546 3.1237e-06 -3.54025 63.546000 Cu 0.704421 0.784476 1 262 63.546 2.41664e-06 -3.54018 63.546000 Cu 0.738817 0.805819 1.10168e-16 263 63.546 2.33736e-05 -3.54022 63.546000 Cu 0.764715 0.790869 0.5 264 63.546 2.2367e-05 -3.54026 63.546000 Cu 0.678486 0.799422 0.5 265 63.546 1.80815e-05 -3.54016 63.546000 Cu 0.799167 0.812221 0.5 269 63.546 1.95348e-05 -3.54018 63.546000 Cu 0.652606 0.814363 4.11326e-17 294 63.546 1.94781e-05 -3.53957 63.546000 Cu 0.91129 0.788747 1 236 63.546 2.00877e-05 -3.53998 63.546000 Cu 0.937273 0.773829 0.5 237 63.546 3.01526e-05 -3.53987 63.546000 Cu 0.85097 0.782335 0.5 238 63.546 2.42307e-05 -3.53988 63.546000 Cu 0.99758 0.780234 1 239 63.546 1.9946e-05 -3.53979 63.546000 Cu 0.971618 0.795162 0.5 241 63.546 9.45036e-06 -3.53982 63.546000 Cu 0.825026 0.797273 1 266 63.546 3.65033e-05 -3.54056 63.546000 Cu 0.885356 0.803685 0.5 268 63.546 3.42843e-05 -3.5405 63.546000 Cu 0.945696 0.810092 1.49136e-17 270 63.546 3.1499e-05 -3.54011 63.546000 Cu 0.0405631 0.837825 0.5 274 63.546 2.66254e-05 -3.54006 63.546000 Cu 0.0147709 0.852769 1.99168e-16 306 63.546 1.25663e-05 -3.54043 63.546000 Cu 0.066403 0.822892 7.33652e-17 341 63.546 7.96037e-06 -3.53977 63.546000 Cu 0.100928 0.84423 1.74633e-16 342 63.546 3.45357e-05 -3.54048 63.546000 Cu 0.126781 0.829293 0.5 343 63.546 8.77314e-06 -3.5397 63.546000 Cu 0.187128 0.835687 4.95516e-17 344 63.546 4.16711e-06 -3.53958 63.546000 Cu 0.161298 0.85063 0.5 347 63.546 2.25958e-05 -3.54021 63.546000 Cu 0.0751745 0.859185 0.5 375 63.546 3.14294e-05 -3.54076 63.546000 Cu 0.273334 0.827152 2.02055e-16 314 63.546 1.85788e-06 -3.53973 63.546000 Cu 0.212964 0.820753 0.5 316 63.546 6.57498e-06 -3.53951 63.546000 Cu 0.359518 0.818623 1 317 63.546 1.07566e-05 -3.53977 63.546000 Cu 0.394064 0.839952 1 318 63.546 1.65997e-05 -3.53958 63.546000 Cu 0.333708 0.833554 0.5 320 63.546 9.33516e-06 -3.53966 63.546000 Cu 0.221647 0.857019 1 345 63.546 3.95607e-05 -3.53995 63.546000 Cu 0.247489 0.842078 0.5 346 63.546 2.34487e-05 -3.53971 63.546000 Cu 0.307852 0.848483 1 348 63.546 2.54186e-06 -3.53991 63.546000 Cu 0.368192 0.854888 0.5 350 63.546 2.29183e-05 -3.54022 63.546000 Cu 0.281978 0.863412 0.5 351 63.546 7.43029e-05 -3.5398 63.546000 Cu 0.566403 0.822892 1 291 63.546 7.96037e-06 -3.53977 63.546000 Cu 0.419869 0.825025 0.5 319 63.546 3.55229e-06 -3.53941 63.546000 Cu 0.480232 0.831427 7.14409e-17 321 63.546 6.49761e-06 -3.53935 63.546000 Cu 0.514771 0.852769 1 322 63.546 1.25663e-05 -3.54043 63.546000 Cu 0.540563 0.837825 0.5 323 63.546 2.66254e-05 -3.54006 63.546000 Cu 0.454399 0.846353 0.5 324 63.546 2.55261e-05 -3.53984 63.546000 Cu 0.575174 0.859185 0.5 328 63.546 3.14294e-05 -3.54076 63.546000 Cu 0.428569 0.861296 1 352 63.546 1.94005e-05 -3.54056 63.546000 Cu 0.687128 0.835687 1 295 63.546 4.16711e-06 -3.53958 63.546000 Cu 0.712964 0.820753 0.5 296 63.546 6.57498e-06 -3.53951 63.546000 Cu 0.626781 0.829293 0.5 297 63.546 8.77314e-06 -3.5397 63.546000 Cu 0.773334 0.827152 4.97921e-17 298 63.546 1.85788e-06 -3.53973 63.546000 Cu 0.747489 0.842078 0.5 301 63.546 2.34487e-05 -3.53971 63.546000 Cu 0.600928 0.84423 5.05137e-17 325 63.546 3.45357e-05 -3.54048 63.546000 Cu 0.661298 0.85063 0.5 327 63.546 2.25958e-05 -3.54021 63.546000 Cu 0.721647 0.857019 1 329 63.546 3.95607e-05 -3.53995 63.546000 Cu 0.781978 0.863412 0.5 331 63.546 7.43029e-05 -3.5398 63.546000 Cu 0.859518 0.818623 1 267 63.546 1.07566e-05 -3.53977 63.546000 Cu 0.980232 0.831427 4.95516e-17 271 63.546 6.49761e-06 -3.53935 63.546000 Cu 0.919869 0.825025 0.5 273 63.546 3.55229e-06 -3.53941 63.546000 Cu 0.807852 0.848483 1 299 63.546 2.54186e-06 -3.53991 63.546000 Cu 0.833708 0.833554 0.5 300 63.546 9.33516e-06 -3.53966 63.546000 Cu 0.894064 0.839952 4.97921e-17 302 63.546 1.65997e-05 -3.53958 63.546000 Cu 0.928569 0.861296 4.95516e-17 303 63.546 1.94005e-05 -3.54056 63.546000 Cu 0.954399 0.846353 0.5 304 63.546 2.55261e-05 -3.53984 63.546000 Cu 0.868192 0.854888 0.5 305 63.546 2.29183e-05 -3.54022 63.546000 Cu 0.023567 0.889052 0.5 339 63.546 6.77308e-05 -3.53918 63.546000 Cu 0.0493778 0.874128 1.11852e-16 374 63.546 2.35114e-05 -3.53998 63.546000 Cu 0.135515 0.865592 4.54624e-17 376 63.546 2.70222e-05 -3.54045 63.546000 Cu 0.170139 0.886953 4.95516e-17 377 63.546 0.000123572 -3.54009 63.546000 Cu 0.195828 0.871984 0.5 378 63.546 6.36344e-05 -3.54023 63.546000 Cu 0.109779 0.880554 0.5 379 63.546 0.000179648 -3.53986 63.546000 Cu 0.0840172 0.895464 0 408 63.546 3.61337e-05 -3.53903 63.546000 Cu 0.144479 0.901907 0.5 410 63.546 0.000384692 -3.54073 63.546000 Cu 0.34238 0.869823 4.95516e-17 349 63.546 1.40608e-05 -3.54006 63.546000 Cu 0.256192 0.878354 1.51541e-17 380 63.546 0.000118122 -3.53946 63.546000 Cu 0.290763 0.89967 8.25058e-17 381 63.546 0.000613738 -3.53798 63.546000 Cu 0.316573 0.88474 0.5 382 63.546 0.000142096 -3.53927 63.546000 Cu 0.23049 0.893329 0.5 383 63.546 6.6034e-05 -3.53946 63.546000 Cu 0.376995 0.891161 1 384 63.546 3.1418e-05 -3.54013 63.546000 Cu 0.351182 0.906058 0.5 387 63.546 0.000415347 -3.53903 63.546000 Cu 0.204842 0.908326 1.09206e-16 412 63.546 0.000607687 -3.54071 63.546000 Cu 0.463185 0.882651 4.06515e-17 353 63.546 1.1724e-05 -3.54012 63.546000 Cu 0.488985 0.867708 0.5 354 63.546 5.06558e-06 -3.5403 63.546000 Cu 0.402798 0.876234 0.5 355 63.546 1.42656e-05 -3.54036 63.546000 Cu 0.549378 0.874128 1 356 63.546 2.35114e-05 -3.53998 63.546000 Cu 0.584017 0.895464 1 357 63.546 3.61337e-05 -3.53903 63.546000 Cu 0.523567 0.889052 0.5 359 63.546 6.77308e-05 -3.53918 63.546000 Cu 0.437415 0.897589 0.5 386 63.546 8.96488e-05 -3.54013 63.546000 Cu 0.497843 0.903998 1 388 63.546 4.16551e-05 -3.53968 63.546000 Cu 0.635515 0.865592 1 326 63.546 2.70222e-05 -3.54045 63.546000 Cu 0.756192 0.878354 4.95516e-17 330 63.546 0.000118122 -3.53946 63.546000 Cu 0.695828 0.871984 0.5 332 63.546 6.36344e-05 -3.54023 63.546000 Cu 0.609779 0.880554 0.5 358 63.546 0.000179648 -3.53986 63.546000 Cu 0.670139 0.886953 8.29869e-17 360 63.546 0.000123572 -3.54009 63.546000 Cu 0.73049 0.893329 0.5 362 63.546 6.6034e-05 -3.53946 63.546000 Cu 0.644479 0.901907 0.5 363 63.546 0.000384692 -3.54073 63.546000 Cu 0.790763 0.89967 1 364 63.546 0.000613738 -3.53798 63.546000 Cu 0.704842 0.908326 4.97921e-17 361 63.546 0.000607687 -3.54071 63.546000 Cu 0.988985 0.867708 0.5 307 63.546 5.06558e-06 -3.5403 63.546000 Cu 0.84238 0.869823 4.95516e-17 333 63.546 1.40608e-05 -3.54006 63.546000 Cu 0.876995 0.891161 1.49136e-17 334 63.546 3.1418e-05 -3.54013 63.546000 Cu 0.902798 0.876234 0.5 335 63.546 1.42656e-05 -3.54036 63.546000 Cu 0.816573 0.88474 0.5 336 63.546 0.000142096 -3.53927 63.546000 Cu 0.963185 0.882651 1.25082e-17 337 63.546 1.1724e-05 -3.54012 63.546000 Cu 0.997843 0.903998 1 338 63.546 4.16551e-05 -3.53968 63.546000 Cu 0.937415 0.897589 0.5 340 63.546 8.96488e-05 -3.54013 63.546000 Cu 0.851182 0.906058 0.5 366 63.546 0.000415347 -3.53903 63.546000 Cu 0.0325231 0.925349 0 372 63.546 0.000215256 -3.54025 63.546000 Cu 0.00697231 0.940351 0.5 373 63.546 0.00213258 -3.54031 63.546000 Cu 0.118709 0.916806 1.56111e-16 409 63.546 0.000283212 -3.53976 63.546000 Cu 0.0582224 0.910373 0.5 411 63.546 0.000398832 -3.53836 63.546000 Cu 0.179271 0.923325 0.5 415 63.546 0.00244507 -3.54274 63.546000 Cu 0.0673484 0.946732 9.64572e-17 438 63.546 0.00212755 -3.53746 63.546000 Cu 0.0928624 0.931684 0.5 439 63.546 0.00306782 -3.53554 63.546000 Cu 0.153525 0.938171 1 440 63.546 0.00194408 -3.53834 63.546000 Cu 0.127354 0.952922 0.5 443 63.546 0.0275179 -3.52098 63.546000 Cu 0.239555 0.92976 1.65733e-16 413 63.546 0.00260328 -3.54122 63.546000 Cu 0.265087 0.914678 0.5 414 63.546 0.000348496 -3.53937 63.546000 Cu 0.325319 0.920964 4.95516e-17 416 63.546 0.00315365 -3.53594 63.546000 Cu 0.359714 0.942186 2.67001e-17 417 63.546 0.021 -3.52834 63.546000 Cu 0.385826 0.92737 0.5 418 63.546 0.00157354 -3.53917 63.546000 Cu 0.299689 0.93605 0.5 419 63.546 0.0017957 -3.53745 63.546000 Cu 0.214254 0.94487 0.5 442 63.546 0.0174249 -3.54425 63.546000 Cu 0.274392 0.951254 4.08921e-17 444 63.546 0.0105953 -3.5389 63.546000 Cu 0.411694 0.912509 4.97921e-17 385 63.546 0.000259063 -3.54106 63.546000 Cu 0.532523 0.925349 4.95516e-17 389 63.546 0.000215256 -3.54025 63.546000 Cu 0.558222 0.910373 0.5 390 63.546 0.000398832 -3.53836 63.546000 Cu 0.472117 0.91895 0.5 391 63.546 0.00044507 -3.54091 63.546000 Cu 0.592862 0.931684 0.5 395 63.546 0.00306782 -3.53554 63.546000 Cu 0.446516 0.933912 1 420 63.546 0.00335592 -3.54351 63.546000 Cu 0.506972 0.940351 0.5 422 63.546 0.00213258 -3.54031 63.546000 Cu 0.420717 0.948657 0.5 423 63.546 0.00894243 -3.53874 63.546000 Cu 0.567348 0.946732 1.84976e-16 424 63.546 0.00212755 -3.53746 63.546000 Cu 0.765087 0.914678 0.5 367 63.546 0.000348496 -3.53937 63.546000 Cu 0.618709 0.916806 4.95516e-17 392 63.546 0.000283212 -3.53976 63.546000 Cu 0.653525 0.938171 4.9311e-17 393 63.546 0.00194408 -3.53834 63.546000 Cu 0.679271 0.923325 0.5 394 63.546 0.00244507 -3.54274 63.546000 Cu 0.739555 0.92976 1 396 63.546 0.00260328 -3.54122 63.546000 Cu 0.774392 0.951254 1 397 63.546 0.0105953 -3.5389 63.546000 Cu 0.799689 0.93605 0.5 398 63.546 0.0017957 -3.53745 63.546000 Cu 0.714254 0.94487 0.5 399 63.546 0.0174249 -3.54425 63.546000 Cu 0.627354 0.952922 0.5 426 63.546 0.0275179 -3.52098 63.546000 Cu 0.825319 0.920964 1 365 63.546 0.00315365 -3.53594 63.546000 Cu 0.911694 0.912509 1 368 63.546 0.000259063 -3.54106 63.546000 Cu 0.946516 0.933912 0 369 63.546 0.00335592 -3.54351 63.546000 Cu 0.972117 0.91895 0.5 370 63.546 0.00044507 -3.54091 63.546000 Cu 0.885826 0.92737 0.5 371 63.546 0.00157354 -3.53917 63.546000 Cu 0.859714 0.942186 7.21625e-19 400 63.546 0.021 -3.52834 63.546000 Cu 0.920717 0.948657 0.5 402 63.546 0.00894243 -3.53874 63.546000 Cu 0.0170403 0.97745 5.05137e-17 405 63.546 0.894551 -3.49582 63.546000 Cu 0.042014 0.961778 0.5 406 63.546 0.0211454 -3.53105 63.546000 Cu 0.188363 0.95958 4.81083e-19 441 63.546 0.0159392 -3.53787 63.546000 Cu 0.101694 0.96828 1 457 63.546 0.0318226 -3.51037 63.546000 Cu 0.134354 0.990341 1 458 63.546 2.97829 -3.51783 63.546000 Cu 0.160844 0.973966 0.5 459 63.546 0.264551 -3.49572 63.546000 Cu 0.0746906 0.983445 0.5 460 63.546 1.65025 -3.4068 63.546000 Cu 0.195273 0.99394 0.5 463 63.546 8.73801 -3.24288 63.546000 Cu 0.309079 0.973007 1 445 63.546 0.201774 -3.50895 63.546000 Cu 0.334209 0.957487 0.5 446 63.546 0.0152238 -3.53333 63.546000 Cu 0.249773 0.966669 0.5 447 63.546 0.16869 -3.52756 63.546000 Cu 0.394086 0.96314 4.95516e-17 448 63.546 0.153807 -3.50899 63.546000 Cu 0.369614 0.978837 0.5 451 63.546 0.979885 -3.47314 63.546000 Cu 0.224967 0.981035 1 461 63.546 0.621047 -3.45718 63.546000 Cu 0.285721 0.990686 0.5 462 63.546 6.82516 -3.56255 63.546000 Cu 0.348044 0.99362 1 464 63.546 11.9411 -3.32618 63.546000 Cu 0.481783 0.955412 6.42246e-17 421 63.546 0.0292192 -3.54308 63.546000 Cu 0.542014 0.961778 0.5 427 63.546 0.0211454 -3.53105 63.546000 Cu 0.429377 0.983669 4.47407e-17 449 63.546 3.4385 -3.34993 63.546000 Cu 0.456574 0.969977 0.5 450 63.546 0.0734239 -3.50006 63.546000 Cu 0.51704 0.97745 4.97921e-17 452 63.546 0.894551 -3.49582 63.546000 Cu 0.574691 0.983445 0.5 453 63.546 1.65025 -3.4068 63.546000 Cu 0.491822 0.99271 0.5 454 63.546 4.17707 -3.50178 63.546000 Cu 0.601694 0.96828 1.19309e-16 425 63.546 0.0318226 -3.51037 63.546000 Cu 0.688363 0.95958 1 428 63.546 0.0159392 -3.53787 63.546000 Cu 0.724967 0.981035 1 429 63.546 0.621047 -3.45718 63.546000 Cu 0.749773 0.966669 0.5 430 63.546 0.16869 -3.52756 63.546000 Cu 0.660844 0.973966 0.5 431 63.546 0.264551 -3.49572 63.546000 Cu 0.785721 0.990686 0.5 435 63.546 6.82516 -3.56255 63.546000 Cu 0.634354 0.990341 1 455 63.546 2.97829 -3.51783 63.546000 Cu 0.695273 0.99394 0.5 456 63.546 8.73801 -3.24288 63.546000 Cu 0.894086 0.96314 4.11326e-17 401 63.546 0.153807 -3.50899 63.546000 Cu 0.834209 0.957487 0.5 403 63.546 0.0152238 -3.53333 63.546000 Cu 0.981783 0.955412 2.29717e-16 404 63.546 0.0292192 -3.54308 63.546000 Cu 0.956574 0.969977 0.5 407 63.546 0.0734239 -3.50006 63.546000 Cu 0.809079 0.973007 0 432 63.546 0.201774 -3.50895 63.546000 Cu 0.848044 0.99362 4.95516e-17 433 63.546 11.9411 -3.32618 63.546000 Cu 0.869614 0.978837 0.5 434 63.546 0.979885 -3.47314 63.546000 Cu 0.929377 0.983669 8.77977e-17 436 63.546 3.4385 -3.34993 63.546000 Cu 0.991822 0.99271 0.5 437 63.546 4.17707 -3.50178