Number of particles = 930 A = 1 Angstrom (basic length-scale) H0(1,1) = 27.4852 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 110.889 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61971 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 0.0681694 0.0134221 6.23017e-18 479 63.546 0.499016 -3.47008 63.546000 Cu 0.0091 0.0195489 0.5 480 63.546 0.376064 -3.51275 63.546000 Cu 0.128831 0.00757448 0.5 482 63.546 1.80993 -3.47757 63.546000 Cu 0.0340754 0.0351187 4.79244e-17 494 63.546 0.0211851 -3.53877 63.546000 Cu 0.0933856 0.0290297 0.5 496 63.546 0.0188655 -3.52428 63.546000 Cu 0.189802 0.00381231 8.7462e-18 481 63.546 8.53057 -3.26282 63.546000 Cu 0.152672 0.0234961 0 498 63.546 0.266294 -3.50836 63.546000 Cu 0.241183 0.0310905 9.41714e-17 499 63.546 0.0656698 -3.54592 63.546000 Cu 0.217045 0.0167661 0.5 500 63.546 0.245707 -3.48296 63.546000 Cu 0.277157 0.00864197 1.19811e-19 502 63.546 2.18765 -3.47079 63.546000 Cu 0.361736 0.0184593 8.75818e-17 503 63.546 0.225229 -3.49715 63.546000 Cu 0.335775 0.00410935 0.5 504 63.546 6.12221 -3.32163 63.546000 Cu 0.301542 0.0249228 0.5 505 63.546 0.0525689 -3.52386 63.546000 Cu 0.419754 0.0129328 0.5 507 63.546 0.881779 -3.4261 63.546000 Cu 0.386933 0.0337913 0.5 531 63.546 0.0511547 -3.52712 63.546000 Cu 0.484288 0.00535009 0 506 63.546 1.7596 -3.44283 63.546000 Cu 0.448538 0.0269268 6.03847e-17 533 63.546 0.0369475 -3.52526 63.546000 Cu 0.534075 0.0351187 0 534 63.546 0.0211851 -3.53877 63.546000 Cu 0.5091 0.0195489 0.5 535 63.546 0.376064 -3.51275 63.546000 Cu 0.568169 0.0134221 1 537 63.546 0.499016 -3.47008 63.546000 Cu 0.689802 0.00381231 1 465 63.546 8.53057 -3.26282 63.546000 Cu 0.652672 0.0234961 1 538 63.546 0.266294 -3.50836 63.546000 Cu 0.628831 0.00757448 0.5 539 63.546 1.80993 -3.47757 63.546000 Cu 0.593386 0.0290297 0.5 540 63.546 0.0188655 -3.52428 63.546000 Cu 0.717045 0.0167661 0.5 467 63.546 0.245707 -3.48296 63.546000 Cu 0.777157 0.00864197 1 466 63.546 2.18765 -3.47079 63.546000 Cu 0.835775 0.00410935 0.5 468 63.546 6.12221 -3.32163 63.546000 Cu 0.741183 0.0310905 4.55282e-17 470 63.546 0.0656698 -3.54592 63.546000 Cu 0.801542 0.0249228 0.5 472 63.546 0.0525689 -3.52386 63.546000 Cu 0.861736 0.0184593 0 474 63.546 0.225229 -3.49715 63.546000 Cu 0.948538 0.0269268 0 475 63.546 0.0369475 -3.52526 63.546000 Cu 0.919754 0.0129328 0.5 476 63.546 0.881779 -3.4261 63.546000 Cu 0.886933 0.0337913 0.5 477 63.546 0.0511547 -3.52712 63.546000 Cu 0.984288 0.00535009 1 478 63.546 1.7596 -3.44283 63.546000 Cu 0.119045 0.0444349 0 495 63.546 0.0340621 -3.53029 63.546000 Cu 0.0591966 0.050513 0.5 497 63.546 0.00319522 -3.53686 63.546000 Cu 0.0847165 0.065707 6.0864e-17 521 63.546 0.0063306 -3.53694 63.546000 Cu 0.179982 0.0378897 0.5 501 63.546 0.0166154 -3.5395 63.546000 Cu 0.14526 0.0592699 0.5 523 63.546 0.00211641 -3.53884 63.546000 Cu 0.20586 0.0526793 1.83311e-17 525 63.546 0.00539875 -3.54316 63.546000 Cu 0.266227 0.046262 0.5 527 63.546 0.00295338 -3.54242 63.546000 Cu 0.231497 0.0677156 0.5 528 63.546 0.000563804 -3.54069 63.546000 Cu 0.291827 0.0613359 0 526 63.546 0.00088087 -3.53912 63.546000 Cu 0.326729 0.0399559 0 529 63.546 0.00412978 -3.53718 63.546000 Cu 0.413275 0.0483798 0 530 63.546 0.00357707 -3.53848 63.546000 Cu 0.352257 0.0549796 0.5 532 63.546 0.00672613 -3.537 63.546000 Cu 0.37825 0.0698125 1.89301e-17 563 63.546 0.000612852 -3.53996 63.546000 Cu 0.474126 0.0415861 0.5 536 63.546 0.0318929 -3.54364 63.546000 Cu 0.438892 0.0632133 0.5 565 63.546 0.00641466 -3.5423 63.546000 Cu 0.49923 0.0567557 3.49848e-17 567 63.546 0.00579334 -3.54167 63.546000 Cu 0.559197 0.050513 0.5 569 63.546 0.00319522 -3.53686 63.546000 Cu 0.70586 0.0526793 7.57205e-17 469 63.546 0.00539875 -3.54316 63.546000 Cu 0.584717 0.065707 1.19811e-19 568 63.546 0.0063306 -3.53694 63.546000 Cu 0.619045 0.0444349 1 571 63.546 0.0340621 -3.53029 63.546000 Cu 0.679982 0.0378897 0.5 572 63.546 0.0166154 -3.5395 63.546000 Cu 0.64526 0.0592699 0.5 573 63.546 0.00211641 -3.53884 63.546000 Cu 0.826729 0.0399559 0 471 63.546 0.00412978 -3.53718 63.546000 Cu 0.766227 0.046262 0.5 473 63.546 0.00295338 -3.54242 63.546000 Cu 0.731497 0.0677156 0.5 484 63.546 0.000563804 -3.54069 63.546000 Cu 0.791827 0.0613359 0 486 63.546 0.00088087 -3.53912 63.546000 Cu 0.852257 0.0549796 0.5 488 63.546 0.00672613 -3.537 63.546000 Cu 0.87825 0.0698125 6.05045e-17 487 63.546 0.000612852 -3.53996 63.546000 Cu 0.913275 0.0483798 0 490 63.546 0.00357707 -3.53848 63.546000 Cu 0.99923 0.0567557 5.05602e-17 491 63.546 0.00579334 -3.54167 63.546000 Cu 0.974126 0.0415861 0.5 492 63.546 0.0318929 -3.54364 63.546000 Cu 0.938892 0.0632133 0.5 493 63.546 0.00641466 -3.5423 63.546000 Cu 0.0245411 0.0719633 0.5 519 63.546 0.00069649 -3.5393 63.546000 Cu 0.0501776 0.0870742 0 518 63.546 0.00147288 -3.53885 63.546000 Cu 0.1106 0.0806596 0.5 524 63.546 0.000653009 -3.53937 63.546000 Cu 0.0760123 0.102067 0.5 553 63.546 0.000234985 -3.53961 63.546000 Cu 0.136461 0.0956094 0 555 63.546 9.29259e-05 -3.54034 63.546000 Cu 0.171102 0.0741695 0 522 63.546 0.00054786 -3.54094 63.546000 Cu 0.222618 0.104181 1.05194e-16 556 63.546 1.89823e-05 -3.53971 63.546000 Cu 0.196875 0.0891626 0.5 557 63.546 0.000173556 -3.54032 63.546000 Cu 0.257239 0.0827558 4.36112e-17 559 63.546 0.000128345 -3.53957 63.546000 Cu 0.283015 0.0977549 0.5 562 63.546 0.000254229 -3.53944 63.546000 Cu 0.343525 0.0912724 1.19811e-19 560 63.546 0.000134744 -3.54003 63.546000 Cu 0.317661 0.0763396 0.5 561 63.546 0.00110931 -3.53888 63.546000 Cu 0.404031 0.0847486 0.5 566 63.546 0.00154592 -3.54109 63.546000 Cu 0.369246 0.106245 0.5 596 63.546 0.000318873 -3.5405 63.546000 Cu 0.524541 0.0719633 0.5 570 63.546 0.00069649 -3.5393 63.546000 Cu 0.464361 0.0782961 3.95376e-18 564 63.546 0.00160515 -3.54117 63.546000 Cu 0.429637 0.0997943 6.31404e-17 598 63.546 0.000515025 -3.54047 63.546000 Cu 0.489916 0.0934177 0.5 600 63.546 0.000182373 -3.53967 63.546000 Cu 0.550178 0.0870742 9.34526e-17 602 63.546 0.00147288 -3.53885 63.546000 Cu 0.696875 0.0891626 0.5 485 63.546 0.000173556 -3.54032 63.546000 Cu 0.636461 0.0956094 0 603 63.546 9.29259e-05 -3.54034 63.546000 Cu 0.6106 0.0806596 0.5 604 63.546 0.000653009 -3.53937 63.546000 Cu 0.576012 0.102067 0.5 605 63.546 0.000234985 -3.53961 63.546000 Cu 0.671102 0.0741695 1.01959e-16 606 63.546 0.00054786 -3.54094 63.546000 Cu 0.757239 0.0827558 2.61188e-17 483 63.546 0.000128345 -3.53957 63.546000 Cu 0.817661 0.0763396 0.5 489 63.546 0.00110931 -3.53888 63.546000 Cu 0.722618 0.104181 1.19811e-19 509 63.546 1.89823e-05 -3.53971 63.546000 Cu 0.783015 0.0977549 0.5 511 63.546 0.000254229 -3.53944 63.546000 Cu 0.843525 0.0912724 0 513 63.546 0.000134744 -3.54003 63.546000 Cu 0.929637 0.0997943 0 514 63.546 0.000515025 -3.54047 63.546000 Cu 0.904031 0.0847486 0.5 515 63.546 0.00154592 -3.54109 63.546000 Cu 0.869246 0.106245 0.5 516 63.546 0.000318873 -3.5405 63.546000 Cu 0.964361 0.0782961 6.61357e-17 517 63.546 0.00160515 -3.54117 63.546000 Cu 0.989916 0.0934177 0.5 520 63.546 0.000182373 -3.53967 63.546000 Cu 0.0155957 0.108479 0 551 63.546 0.000377094 -3.53932 63.546000 Cu 0.101822 0.117043 2.74367e-17 552 63.546 4.8629e-05 -3.54007 63.546000 Cu 0.0413837 0.12348 0.5 554 63.546 6.58845e-05 -3.53964 63.546000 Cu 0.0671532 0.138476 3.60631e-17 586 63.546 2.58453e-05 -3.54002 63.546000 Cu 0.127528 0.132046 0.5 588 63.546 3.02327e-05 -3.54009 63.546000 Cu 0.162248 0.110604 0.5 558 63.546 8.36193e-05 -3.54015 63.546000 Cu 0.187933 0.125619 1 590 63.546 1.04721e-05 -3.5399 63.546000 Cu 0.274083 0.134181 8.57847e-17 591 63.546 5.30341e-05 -3.53996 63.546000 Cu 0.248345 0.119188 0.5 592 63.546 7.22448e-05 -3.53973 63.546000 Cu 0.213665 0.140628 0.5 593 63.546 0.000110077 -3.5399 63.546000 Cu 0.308798 0.112728 8.86601e-18 594 63.546 2.7731e-05 -3.54001 63.546000 Cu 0.394926 0.121263 0 595 63.546 0.00018212 -3.54014 63.546000 Cu 0.334521 0.127716 0.5 597 63.546 5.16911e-05 -3.5402 63.546000 Cu 0.360277 0.142717 1 629 63.546 0.00011968 -3.54008 63.546000 Cu 0.420647 0.136291 0.5 631 63.546 5.59072e-05 -3.5398 63.546000 Cu 0.515596 0.108479 0 599 63.546 0.000377094 -3.53932 63.546000 Cu 0.455257 0.114858 0.5 601 63.546 7.61325e-05 -3.53965 63.546000 Cu 0.480994 0.129889 2.44414e-17 633 63.546 4.93329e-05 -3.53948 63.546000 Cu 0.567153 0.138476 0 634 63.546 2.58453e-05 -3.54002 63.546000 Cu 0.541384 0.12348 0.5 635 63.546 6.58845e-05 -3.53964 63.546000 Cu 0.687933 0.125619 0 508 63.546 1.04721e-05 -3.5399 63.546000 Cu 0.713665 0.140628 0.5 542 63.546 0.000110077 -3.5399 63.546000 Cu 0.601822 0.117043 1.19811e-19 637 63.546 4.8629e-05 -3.54007 63.546000 Cu 0.662248 0.110604 0.5 638 63.546 8.36193e-05 -3.54015 63.546000 Cu 0.627528 0.132046 0.5 639 63.546 3.02327e-05 -3.54009 63.546000 Cu 0.808798 0.112728 1.89301e-17 510 63.546 2.7731e-05 -3.54001 63.546000 Cu 0.748345 0.119188 0.5 512 63.546 7.22448e-05 -3.53973 63.546000 Cu 0.774083 0.134181 1.19811e-19 543 63.546 5.30341e-05 -3.53996 63.546000 Cu 0.834521 0.127716 0.5 545 63.546 5.16911e-05 -3.5402 63.546000 Cu 0.860277 0.142717 0 544 63.546 0.00011968 -3.54008 63.546000 Cu 0.894926 0.121263 5.15187e-18 547 63.546 0.00018212 -3.54014 63.546000 Cu 0.980994 0.129889 4.94819e-17 548 63.546 4.93329e-05 -3.53948 63.546000 Cu 0.955257 0.114858 0.5 549 63.546 7.61325e-05 -3.53965 63.546000 Cu 0.920647 0.136291 0.5 550 63.546 5.59072e-05 -3.5398 63.546000 Cu 0.032637 0.159914 1.36585e-17 583 63.546 2.83755e-05 -3.54017 63.546000 Cu 0.00678899 0.144903 0.5 584 63.546 3.73187e-05 -3.53989 63.546000 Cu 0.0929578 0.153487 0.5 589 63.546 4.69716e-05 -3.54015 63.546000 Cu 0.0585498 0.174917 0.5 619 63.546 2.63944e-05 -3.54012 63.546000 Cu 0.118868 0.168487 3.65423e-17 621 63.546 2.18769e-05 -3.54002 63.546000 Cu 0.153299 0.147059 2.71971e-17 587 63.546 7.28271e-05 -3.54002 63.546000 Cu 0.205162 0.177043 0 622 63.546 1.04159e-05 -3.53993 63.546000 Cu 0.179194 0.162059 0.5 623 63.546 4.1909e-05 -3.53994 63.546000 Cu 0.239534 0.15562 1 625 63.546 5.91e-05 -3.53999 63.546000 Cu 0.2655 0.170603 0.5 628 63.546 1.53891e-05 -3.54007 63.546000 Cu 0.325834 0.164159 3.6782e-17 626 63.546 5.78989e-05 -3.54016 63.546000 Cu 0.299902 0.149167 0.5 627 63.546 6.48633e-05 -3.54008 63.546000 Cu 0.386148 0.157728 0.5 632 63.546 5.16894e-05 -3.5401 63.546000 Cu 0.412035 0.172752 1 664 63.546 2.65232e-06 -3.54015 63.546000 Cu 0.446458 0.151315 5.79885e-17 630 63.546 1.76865e-05 -3.53992 63.546000 Cu 0.506789 0.144903 0.5 636 63.546 3.73187e-05 -3.53989 63.546000 Cu 0.472328 0.166336 0.5 666 63.546 1.85256e-05 -3.54014 63.546000 Cu 0.532637 0.159914 5.5113e-18 668 63.546 2.83755e-05 -3.54017 63.546000 Cu 0.55855 0.174917 0.5 671 63.546 2.63944e-05 -3.54012 63.546000 Cu 0.705162 0.177043 1.19811e-19 574 63.546 1.04159e-05 -3.53993 63.546000 Cu 0.618868 0.168487 1 669 63.546 2.18769e-05 -3.54002 63.546000 Cu 0.592958 0.153487 0.5 670 63.546 4.69716e-05 -3.54015 63.546000 Cu 0.653299 0.147059 6.5896e-18 672 63.546 7.28271e-05 -3.54002 63.546000 Cu 0.679194 0.162059 0.5 673 63.546 4.1909e-05 -3.53994 63.546000 Cu 0.739534 0.15562 1 541 63.546 5.91e-05 -3.53999 63.546000 Cu 0.799902 0.149167 0.5 546 63.546 6.48633e-05 -3.54008 63.546000 Cu 0.7655 0.170603 0.5 576 63.546 1.53891e-05 -3.54007 63.546000 Cu 0.825834 0.164159 1.68933e-17 578 63.546 5.78989e-05 -3.54016 63.546000 Cu 0.912035 0.172752 0 579 63.546 2.65232e-06 -3.54015 63.546000 Cu 0.886148 0.157728 0.5 580 63.546 5.16894e-05 -3.5401 63.546000 Cu 0.946458 0.151315 0 582 63.546 1.76865e-05 -3.53992 63.546000 Cu 0.972328 0.166336 0.5 585 63.546 1.85256e-05 -3.54014 63.546000 Cu 0.0845017 0.189901 2.56395e-17 618 63.546 2.10855e-05 -3.53992 63.546000 Cu 0.0241668 0.196331 0.5 620 63.546 3.70883e-05 -3.53993 63.546000 Cu 0.0501473 0.211291 0 652 63.546 2.40246e-06 -3.53975 63.546000 Cu 0.110489 0.204865 0.5 654 63.546 4.93977e-06 -3.53971 63.546000 Cu 0.144831 0.183473 0.5 624 63.546 1.59846e-05 -3.53989 63.546000 Cu 0.170822 0.198443 2.39622e-17 656 63.546 1.20186e-05 -3.53974 63.546000 Cu 0.257078 0.207003 1 657 63.546 2.55507e-05 -3.53988 63.546000 Cu 0.231145 0.19202 0.5 658 63.546 2.91813e-05 -3.5399 63.546000 Cu 0.196789 0.213413 0.5 659 63.546 4.97912e-05 -3.53978 63.546000 Cu 0.291457 0.185592 3.15103e-17 660 63.546 4.80718e-05 -3.54009 63.546000 Cu 0.377628 0.194182 2.81556e-17 661 63.546 1.96101e-05 -3.54004 63.546000 Cu 0.351749 0.179168 0.5 662 63.546 2.74124e-05 -3.54015 63.546000 Cu 0.317354 0.200593 0.5 663 63.546 7.35258e-06 -3.53999 63.546000 Cu 0.403525 0.209177 0.5 697 63.546 4.84975e-05 -3.53988 63.546000 Cu 0.498227 0.181347 1 665 63.546 5.39842e-05 -3.54013 63.546000 Cu 0.437918 0.187768 0.5 667 63.546 4.85143e-05 -3.54007 63.546000 Cu 0.463835 0.202758 1 699 63.546 5.91601e-05 -3.53989 63.546000 Cu 0.550147 0.211291 0 700 63.546 2.40246e-06 -3.53975 63.546000 Cu 0.524167 0.196331 0.5 701 63.546 3.70883e-05 -3.53993 63.546000 Cu 0.696789 0.213413 0.5 608 63.546 4.97912e-05 -3.53978 63.546000 Cu 0.584502 0.189901 9.40516e-17 703 63.546 2.10855e-05 -3.53992 63.546000 Cu 0.670822 0.198443 0 704 63.546 1.20186e-05 -3.53974 63.546000 Cu 0.644831 0.183473 0.5 705 63.546 1.59846e-05 -3.53989 63.546000 Cu 0.610489 0.204865 0.5 706 63.546 4.93977e-06 -3.53971 63.546000 Cu 0.791457 0.185592 5.13989e-17 575 63.546 4.80718e-05 -3.54009 63.546000 Cu 0.731145 0.19202 0.5 577 63.546 2.91813e-05 -3.5399 63.546000 Cu 0.851749 0.179168 0.5 581 63.546 2.74124e-05 -3.54015 63.546000 Cu 0.757078 0.207003 0 609 63.546 2.55507e-05 -3.53988 63.546000 Cu 0.817354 0.200593 0.5 611 63.546 7.35258e-06 -3.53999 63.546000 Cu 0.877628 0.194182 1.0783e-18 613 63.546 1.96101e-05 -3.54004 63.546000 Cu 0.963835 0.202758 5.15187e-18 614 63.546 5.91601e-05 -3.53989 63.546000 Cu 0.937918 0.187768 0.5 615 63.546 4.85143e-05 -3.54007 63.546000 Cu 0.903525 0.209177 0.5 616 63.546 4.84975e-05 -3.53988 63.546000 Cu 0.998227 0.181347 2.33631e-17 617 63.546 5.39842e-05 -3.54013 63.546000 Cu 0.0158005 0.232674 4.3731e-17 649 63.546 1.33212e-05 -3.53992 63.546000 Cu 0.136477 0.219826 6.19423e-17 653 63.546 5.91161e-05 -3.53978 63.546000 Cu 0.0761454 0.226246 0.5 655 63.546 4.29726e-05 -3.53985 63.546000 Cu 0.0417912 0.24764 0.5 685 63.546 5.94557e-05 -3.54002 63.546000 Cu 0.102109 0.241223 1 687 63.546 7.27968e-05 -3.54011 63.546000 Cu 0.162411 0.234812 0.5 689 63.546 5.89674e-05 -3.54014 63.546000 Cu 0.222696 0.228405 0 691 63.546 2.48726e-05 -3.5401 63.546000 Cu 0.282968 0.222 0.5 693 63.546 4.07449e-06 -3.54003 63.546000 Cu 0.248569 0.243419 0.5 694 63.546 2.20071e-05 -3.54028 63.546000 Cu 0.188292 0.249826 1.49764e-17 688 63.546 3.836e-06 -3.54023 63.546000 Cu 0.308854 0.237003 0 692 63.546 4.8153e-05 -3.54019 63.546000 Cu 0.343239 0.215591 4.70857e-17 695 63.546 1.85057e-05 -3.53995 63.546000 Cu 0.36915 0.230579 0.5 698 63.546 5.09829e-05 -3.54003 63.546000 Cu 0.395109 0.24555 8.13516e-17 730 63.546 3.01492e-05 -3.54001 63.546000 Cu 0.429467 0.22415 4.07357e-18 696 63.546 3.17374e-05 -3.53989 63.546000 Cu 0.489802 0.21772 0.5 702 63.546 1.02653e-05 -3.5398 63.546000 Cu 0.455452 0.23911 0.5 732 63.546 2.77019e-06 -3.53996 63.546000 Cu 0.515801 0.232674 1.35386e-17 734 63.546 1.33212e-05 -3.53992 63.546000 Cu 0.541791 0.24764 0.5 737 63.546 5.94557e-05 -3.54002 63.546000 Cu 0.602109 0.241223 3.55839e-17 735 63.546 7.27968e-05 -3.54011 63.546000 Cu 0.576145 0.226246 0.5 736 63.546 4.29726e-05 -3.53985 63.546000 Cu 0.636477 0.219826 7.90752e-17 738 63.546 5.91161e-05 -3.53978 63.546000 Cu 0.662411 0.234812 0.5 739 63.546 5.89674e-05 -3.54014 63.546000 Cu 0.688292 0.249826 1.19811e-19 640 63.546 3.836e-06 -3.54023 63.546000 Cu 0.722696 0.228405 3.59433e-19 607 63.546 2.48726e-05 -3.5401 63.546000 Cu 0.843239 0.215591 5.36753e-17 610 63.546 1.85057e-05 -3.53995 63.546000 Cu 0.782968 0.222 0.5 612 63.546 4.07449e-06 -3.54003 63.546000 Cu 0.748569 0.243419 0.5 642 63.546 2.20071e-05 -3.54028 63.546000 Cu 0.808854 0.237003 3.79801e-17 644 63.546 4.8153e-05 -3.54019 63.546000 Cu 0.895109 0.24555 0 645 63.546 3.01492e-05 -3.54001 63.546000 Cu 0.86915 0.230579 0.5 646 63.546 5.09829e-05 -3.54003 63.546000 Cu 0.929467 0.22415 1.24603e-17 648 63.546 3.17374e-05 -3.53989 63.546000 Cu 0.989802 0.21772 0.5 650 63.546 1.02653e-05 -3.5398 63.546000 Cu 0.955452 0.23911 0.5 651 63.546 2.77019e-06 -3.53996 63.546000 Cu 0.0677394 0.262624 2.57594e-17 684 63.546 6.3367e-05 -3.53983 63.546000 Cu 0.00744377 0.269028 0.5 686 63.546 8.42808e-05 -3.53974 63.546000 Cu 0.128018 0.256226 0.5 690 63.546 2.40922e-05 -3.54004 63.546000 Cu 0.0333824 0.284005 1.19811e-19 718 63.546 0.000116859 -3.53972 63.546000 Cu 0.0936437 0.277619 0.5 720 63.546 3.28974e-05 -3.53976 63.546000 Cu 0.153893 0.271236 1.19811e-19 722 63.546 1.00323e-05 -3.53989 63.546000 Cu 0.240066 0.279833 1 723 63.546 0.000129573 -3.54005 63.546000 Cu 0.214159 0.26484 0.5 724 63.546 7.49247e-05 -3.54004 63.546000 Cu 0.274454 0.258424 1.24843e-16 726 63.546 0.000119651 -3.54011 63.546000 Cu 0.360758 0.266949 3.33074e-17 727 63.546 1.6104e-05 -3.53996 63.546000 Cu 0.334774 0.251991 0.5 728 63.546 8.80452e-05 -3.54008 63.546000 Cu 0.3004 0.273397 0.5 729 63.546 7.77994e-05 -3.54002 63.546000 Cu 0.421114 0.260503 0.5 733 63.546 5.5158e-06 -3.5399 63.546000 Cu 0.386767 0.281893 0.5 763 63.546 1.3724e-05 -3.53998 63.546000 Cu 0.481459 0.254067 1.25802e-16 731 63.546 2.91876e-05 -3.53993 63.546000 Cu 0.447119 0.275451 0 765 63.546 5.9114e-05 -3.53981 63.546000 Cu 0.533382 0.284005 1.19811e-19 766 63.546 0.000116859 -3.53972 63.546000 Cu 0.507444 0.269028 0.5 767 63.546 8.42808e-05 -3.53974 63.546000 Cu 0.567739 0.262624 1.0148e-16 769 63.546 6.3367e-05 -3.53983 63.546000 Cu 0.714159 0.26484 0.5 643 63.546 7.49247e-05 -3.54004 63.546000 Cu 0.653893 0.271236 8.1112e-17 770 63.546 1.00323e-05 -3.53989 63.546000 Cu 0.628018 0.256226 0.5 771 63.546 2.40922e-05 -3.54004 63.546000 Cu 0.593644 0.277619 0.5 772 63.546 3.28974e-05 -3.53976 63.546000 Cu 0.774454 0.258424 9.08167e-17 641 63.546 0.000119651 -3.54011 63.546000 Cu 0.834774 0.251991 0.5 647 63.546 8.80452e-05 -3.54008 63.546000 Cu 0.740066 0.279833 0 675 63.546 0.000129573 -3.54005 63.546000 Cu 0.8004 0.273397 0.5 677 63.546 7.77994e-05 -3.54002 63.546000 Cu 0.860758 0.266949 0 679 63.546 1.6104e-05 -3.53996 63.546000 Cu 0.947119 0.275451 3.95376e-18 680 63.546 5.9114e-05 -3.53981 63.546000 Cu 0.921114 0.260503 0.5 681 63.546 5.5158e-06 -3.5399 63.546000 Cu 0.886767 0.281893 0.5 682 63.546 1.3724e-05 -3.53998 63.546000 Cu 0.981459 0.254067 4.67263e-17 683 63.546 2.91876e-05 -3.53993 63.546000 Cu 0.119525 0.292637 2.50405e-17 719 63.546 1.77274e-05 -3.54009 63.546000 Cu 0.059293 0.299013 0.5 721 63.546 5.31396e-05 -3.53998 63.546000 Cu 0.024985 0.320403 0.5 751 63.546 9.8918e-05 -3.53973 63.546000 Cu 0.0851821 0.314048 0 753 63.546 4.85598e-05 -3.54001 63.546000 Cu 0.179774 0.286246 0.5 725 63.546 9.37777e-05 -3.5401 63.546000 Cu 0.145413 0.307663 0.5 755 63.546 0.000167078 -3.54023 63.546000 Cu 0.205699 0.301245 0 757 63.546 0.000163963 -3.54022 63.546000 Cu 0.266034 0.294804 0.5 759 63.546 7.93008e-05 -3.54016 63.546000 Cu 0.231647 0.316218 0.5 760 63.546 0.000121923 -3.54027 63.546000 Cu 0.292007 0.309757 3.70216e-17 758 63.546 4.65241e-05 -3.54017 63.546000 Cu 0.326397 0.288349 1.3299e-17 761 63.546 1.32322e-05 -3.54011 63.546000 Cu 0.412754 0.296838 6.49375e-17 762 63.546 6.973e-05 -3.53996 63.546000 Cu 0.352386 0.303292 0.5 764 63.546 9.30231e-06 -3.54009 63.546000 Cu 0.378395 0.318224 0 795 63.546 9.62255e-05 -3.53996 63.546000 Cu 0.473092 0.290408 0.5 768 63.546 0.000145639 -3.53981 63.546000 Cu 0.438748 0.311791 0.5 797 63.546 0.000207224 -3.53986 63.546000 Cu 0.499044 0.305391 0 799 63.546 0.000192342 -3.53986 63.546000 Cu 0.559293 0.299013 0.5 801 63.546 5.31396e-05 -3.53998 63.546000 Cu 0.524985 0.320403 0.5 802 63.546 9.8918e-05 -3.53973 63.546000 Cu 0.705699 0.301245 0 674 63.546 0.000163963 -3.54022 63.546000 Cu 0.585182 0.314048 3.71414e-18 800 63.546 4.85598e-05 -3.54001 63.546000 Cu 0.619525 0.292637 3.71414e-18 803 63.546 1.77274e-05 -3.54009 63.546000 Cu 0.679774 0.286246 0.5 804 63.546 9.37777e-05 -3.5401 63.546000 Cu 0.645413 0.307663 0.5 805 63.546 0.000167078 -3.54023 63.546000 Cu 0.826397 0.288349 2.64782e-17 676 63.546 1.32322e-05 -3.54011 63.546000 Cu 0.766034 0.294804 0.5 678 63.546 7.93008e-05 -3.54016 63.546000 Cu 0.731647 0.316218 0.5 708 63.546 0.000121923 -3.54027 63.546000 Cu 0.792007 0.309757 1.19811e-19 710 63.546 4.65241e-05 -3.54017 63.546000 Cu 0.852386 0.303292 0.5 712 63.546 9.30231e-06 -3.54009 63.546000 Cu 0.878395 0.318224 1 711 63.546 9.62255e-05 -3.53996 63.546000 Cu 0.912754 0.296838 1.04116e-16 714 63.546 6.973e-05 -3.53996 63.546000 Cu 0.999044 0.305391 1 715 63.546 0.000192342 -3.53986 63.546000 Cu 0.973092 0.290408 0.5 716 63.546 0.000145639 -3.53981 63.546000 Cu 0.938748 0.311791 0.5 717 63.546 0.000207224 -3.53986 63.546000 Cu 0.050858 0.335436 1.19811e-19 750 63.546 8.73241e-05 -3.53971 63.546000 Cu 0.111056 0.329077 0.5 756 63.546 0.000237168 -3.54005 63.546000 Cu 0.0765952 0.350485 0.5 785 63.546 0.000373297 -3.53998 63.546000 Cu 0.136859 0.344092 1.25202e-16 787 63.546 0.000523275 -3.54039 63.546000 Cu 0.0163833 0.35681 1 783 63.546 0.00015997 -3.5396 63.546000 Cu 0.171315 0.322666 0 754 63.546 0.000234647 -3.54029 63.546000 Cu 0.223012 0.352584 0 788 63.546 0.000419764 -3.54033 63.546000 Cu 0.197189 0.337644 0.5 789 63.546 0.000346384 -3.54053 63.546000 Cu 0.25758 0.331169 7.88356e-17 791 63.546 0.000157783 -3.5404 63.546000 Cu 0.283527 0.34608 0.5 794 63.546 0.000119822 -3.54017 63.546000 Cu 0.344025 0.339594 0 792 63.546 0.000210139 -3.53997 63.546000 Cu 0.317991 0.324688 0.5 793 63.546 3.65768e-05 -3.54016 63.546000 Cu 0.404431 0.333155 0.5 798 63.546 0.000381811 -3.53976 63.546000 Cu 0.36999 0.354494 0.5 828 63.546 0.000773682 -3.53947 63.546000 Cu 0.464753 0.326761 0 796 63.546 0.000383639 -3.53971 63.546000 Cu 0.430386 0.348106 0 830 63.546 0.000792585 -3.53944 63.546000 Cu 0.490663 0.341765 0.5 832 63.546 0.000353187 -3.53957 63.546000 Cu 0.550858 0.335436 4.19338e-18 834 63.546 8.73241e-05 -3.53971 63.546000 Cu 0.516383 0.35681 7.18866e-17 831 63.546 0.00015997 -3.5396 63.546000 Cu 0.697189 0.337644 0.5 709 63.546 0.000346384 -3.54053 63.546000 Cu 0.636859 0.344092 4.91225e-18 835 63.546 0.000523275 -3.54039 63.546000 Cu 0.611056 0.329077 0.5 836 63.546 0.000237168 -3.54005 63.546000 Cu 0.576595 0.350485 0.5 837 63.546 0.000373297 -3.53998 63.546000 Cu 0.671315 0.322666 6.00253e-17 838 63.546 0.000234647 -3.54029 63.546000 Cu 0.75758 0.331169 0 707 63.546 0.000157783 -3.5404 63.546000 Cu 0.817991 0.324688 0.5 713 63.546 3.65768e-05 -3.54016 63.546000 Cu 0.723012 0.352584 0 741 63.546 0.000419764 -3.54033 63.546000 Cu 0.783527 0.34608 0.5 743 63.546 0.000119822 -3.54017 63.546000 Cu 0.844025 0.339594 6.91309e-17 745 63.546 0.000210139 -3.53997 63.546000 Cu 0.930386 0.348106 1.19811e-19 746 63.546 0.000792585 -3.53944 63.546000 Cu 0.904431 0.333155 0.5 747 63.546 0.000381811 -3.53976 63.546000 Cu 0.86999 0.354494 0.5 748 63.546 0.000773682 -3.53947 63.546000 Cu 0.964753 0.326761 1 749 63.546 0.000383639 -3.53971 63.546000 Cu 0.990663 0.341765 0.5 752 63.546 0.000353187 -3.53957 63.546000 Cu 0.102172 0.365529 1.53358e-17 784 63.546 0.00109267 -3.5404 63.546000 Cu 0.0419244 0.37189 0.5 786 63.546 0.000477349 -3.53997 63.546000 Cu 0.0673374 0.386976 0 818 63.546 0.0022795 -3.54068 63.546000 Cu 0.127711 0.38053 0.5 820 63.546 0.00216199 -3.54066 63.546000 Cu 0.162525 0.359081 0.5 790 63.546 0.000949171 -3.54048 63.546000 Cu 0.188224 0.373997 5.61913e-17 822 63.546 0.00080573 -3.54025 63.546000 Cu 0.274721 0.382277 0 823 63.546 0.000344295 -3.53976 63.546000 Cu 0.248832 0.367456 0.5 824 63.546 0.00014329 -3.53993 63.546000 Cu 0.214046 0.38883 0.5 825 63.546 0.000312645 -3.54003 63.546000 Cu 0.309448 0.360945 1.19811e-19 826 63.546 0.000266967 -3.53971 63.546000 Cu 0.395831 0.369413 4.79244e-19 827 63.546 0.00151685 -3.53895 63.546000 Cu 0.33533 0.375795 0.5 829 63.546 0.00127045 -3.53926 63.546000 Cu 0.361272 0.390672 0 861 63.546 0.00350186 -3.53828 63.546000 Cu 0.421553 0.384404 0.5 863 63.546 0.0015687 -3.53859 63.546000 Cu 0.456152 0.363107 0.5 833 63.546 0.000638054 -3.53921 63.546000 Cu 0.481746 0.378165 0 865 63.546 0.000324613 -3.53924 63.546000 Cu 0.567337 0.386976 1.44971e-17 866 63.546 0.0022795 -3.54068 63.546000 Cu 0.541924 0.37189 0.5 867 63.546 0.000477349 -3.53997 63.546000 Cu 0.688224 0.373997 2.25245e-17 740 63.546 0.00080573 -3.54025 63.546000 Cu 0.714046 0.38883 0.5 774 63.546 0.000312645 -3.54003 63.546000 Cu 0.602172 0.365529 2.53999e-17 869 63.546 0.00109267 -3.5404 63.546000 Cu 0.662525 0.359081 0.5 870 63.546 0.000949171 -3.54048 63.546000 Cu 0.627711 0.38053 0.5 871 63.546 0.00216199 -3.54066 63.546000 Cu 0.809448 0.360945 0 742 63.546 0.000266967 -3.53971 63.546000 Cu 0.748832 0.367456 0.5 744 63.546 0.00014329 -3.53993 63.546000 Cu 0.774721 0.382277 6.19423e-17 775 63.546 0.000344295 -3.53976 63.546000 Cu 0.83533 0.375795 0.5 777 63.546 0.00127045 -3.53926 63.546000 Cu 0.861272 0.390672 1.24603e-17 776 63.546 0.00350186 -3.53828 63.546000 Cu 0.895831 0.369413 5.69102e-17 779 63.546 0.00151685 -3.53895 63.546000 Cu 0.981746 0.378165 2.30037e-17 780 63.546 0.000324613 -3.53924 63.546000 Cu 0.956152 0.363107 0.5 781 63.546 0.000638054 -3.53921 63.546000 Cu 0.921553 0.384404 0.5 782 63.546 0.0015687 -3.53859 63.546000 Cu 0.0324408 0.408459 1.19811e-19 815 63.546 0.00502888 -3.54117 63.546000 Cu 0.0071595 0.393291 0.5 816 63.546 0.000772459 -3.53989 63.546000 Cu 0.0927532 0.402008 0.5 821 63.546 0.00492758 -3.54112 63.546000 Cu 0.0576389 0.423554 0.5 851 63.546 0.0126301 -3.54195 63.546000 Cu 0.118365 0.416891 3.75008e-17 853 63.546 0.00346808 -3.54037 63.546000 Cu 0.15333 0.395426 0 819 63.546 0.00168032 -3.54027 63.546000 Cu 0.205175 0.424931 2.7916e-17 854 63.546 0.00127047 -3.5409 63.546000 Cu 0.179158 0.410213 0.5 855 63.546 0.000702975 -3.5399 63.546000 Cu 0.23995 0.403597 6.13432e-17 857 63.546 0.000536155 -3.53979 63.546000 Cu 0.266069 0.418277 0.5 860 63.546 0.00490899 -3.53783 63.546000 Cu 0.326754 0.411855 1.13341e-16 858 63.546 0.00935486 -3.53651 63.546000 Cu 0.300702 0.39706 0.5 859 63.546 0.00232421 -3.53871 63.546000 Cu 0.387044 0.405654 0.5 864 63.546 0.00438674 -3.53786 63.546000 Cu 0.412509 0.420803 9.46507e-18 893 63.546 0.00324036 -3.53766 63.546000 Cu 0.352601 0.426854 0.5 891 63.546 0.0105633 -3.53613 63.546000 Cu 0.447139 0.399496 0 862 63.546 0.00112121 -3.53881 63.546000 Cu 0.507159 0.393291 0.5 868 63.546 0.000772459 -3.53989 63.546000 Cu 0.472414 0.414719 0.5 895 63.546 0.00178131 -3.53978 63.546000 Cu 0.532441 0.408459 8.15913e-17 897 63.546 0.00502888 -3.54117 63.546000 Cu 0.557639 0.423554 0.5 900 63.546 0.0126301 -3.54195 63.546000 Cu 0.705175 0.424931 0 806 63.546 0.00127047 -3.5409 63.546000 Cu 0.618365 0.416891 0 898 63.546 0.00346808 -3.54037 63.546000 Cu 0.592753 0.402008 0.5 899 63.546 0.00492758 -3.54112 63.546000 Cu 0.65333 0.395426 9.94431e-18 901 63.546 0.00168032 -3.54027 63.546000 Cu 0.679158 0.410213 0.5 902 63.546 0.000702975 -3.5399 63.546000 Cu 0.73995 0.403597 0 773 63.546 0.000536155 -3.53979 63.546000 Cu 0.800702 0.39706 0.5 778 63.546 0.00232421 -3.53871 63.546000 Cu 0.766069 0.418277 0.5 808 63.546 0.00490899 -3.53783 63.546000 Cu 0.826754 0.411855 0 810 63.546 0.00935486 -3.53651 63.546000 Cu 0.852601 0.426854 0.5 813 63.546 0.0105633 -3.53613 63.546000 Cu 0.912509 0.420803 1 811 63.546 0.00324036 -3.53766 63.546000 Cu 0.887044 0.405654 0.5 812 63.546 0.00438674 -3.53786 63.546000 Cu 0.947139 0.399496 1.19811e-19 814 63.546 0.00112121 -3.53881 63.546000 Cu 0.972414 0.414719 0.5 817 63.546 0.00178131 -3.53978 63.546000 Cu 0.0829616 0.438377 2.7916e-17 850 63.546 0.00742476 -3.53789 63.546000 Cu 0.0220748 0.445232 0.5 852 63.546 0.0426222 -3.54187 63.546000 Cu 0.047375 0.459955 6.00253e-17 881 63.546 0.0393386 -3.52129 63.546000 Cu 0.108974 0.452903 0.5 883 63.546 0.0195848 -3.52932 63.546000 Cu 0.144262 0.431605 0.5 856 63.546 0.00143532 -3.53974 63.546000 Cu 0.16996 0.446288 3.52244e-17 885 63.546 0.0130171 -3.54302 63.546000 Cu 0.258451 0.45378 0 886 63.546 0.127534 -3.52121 63.546000 Cu 0.231446 0.439469 0.5 887 63.546 0.0126137 -3.53799 63.546000 Cu 0.195367 0.460487 0.5 888 63.546 0.065314 -3.51364 63.546000 Cu 0.292504 0.432942 2.34829e-17 889 63.546 0.0295696 -3.53284 63.546000 Cu 0.378147 0.442079 1 890 63.546 0.0112569 -3.53295 63.546000 Cu 0.318549 0.448042 0.5 892 63.546 0.0260486 -3.53659 63.546000 Cu 0.403231 0.457779 0.5 913 63.546 0.0131713 -3.52389 63.546000 Cu 0.344353 0.463197 1.88103e-17 911 63.546 0.104039 -3.52388 63.546000 Cu 0.497321 0.430005 0 894 63.546 0.0115606 -3.54133 63.546000 Cu 0.437503 0.436184 0.5 896 63.546 0.00439037 -3.53733 63.546000 Cu 0.46223 0.451693 1.84509e-17 915 63.546 0.0294819 -3.53685 63.546000 Cu 0.547375 0.459955 0 916 63.546 0.0393386 -3.52129 63.546000 Cu 0.522075 0.445232 0.5 917 63.546 0.0426222 -3.54187 63.546000 Cu 0.695367 0.460487 0.5 840 63.546 0.065314 -3.51364 63.546000 Cu 0.582962 0.438377 0 919 63.546 0.00742476 -3.53789 63.546000 Cu 0.66996 0.446288 4.43301e-17 920 63.546 0.0130171 -3.54302 63.546000 Cu 0.644262 0.431605 0.5 921 63.546 0.00143532 -3.53974 63.546000 Cu 0.608974 0.452903 0.5 922 63.546 0.0195848 -3.52932 63.546000 Cu 0.792504 0.432942 0 807 63.546 0.0295696 -3.53284 63.546000 Cu 0.731446 0.439469 0.5 809 63.546 0.0126137 -3.53799 63.546000 Cu 0.758451 0.45378 1.19811e-18 841 63.546 0.127534 -3.52121 63.546000 Cu 0.818549 0.448042 0.5 843 63.546 0.0260486 -3.53659 63.546000 Cu 0.844353 0.463197 1 842 63.546 0.104039 -3.52388 63.546000 Cu 0.878147 0.442079 1.19811e-19 845 63.546 0.0112569 -3.53295 63.546000 Cu 0.96223 0.451693 0 846 63.546 0.0294819 -3.53685 63.546000 Cu 0.937503 0.436184 0.5 847 63.546 0.00439037 -3.53733 63.546000 Cu 0.903231 0.457779 0.5 848 63.546 0.0131713 -3.52389 63.546000 Cu 0.997321 0.430005 1 849 63.546 0.0115606 -3.54133 63.546000 Cu 0.0114877 0.481763 6.44583e-17 878 63.546 2.17925 -3.43965 63.546000 Cu 0.134474 0.468033 1.19811e-19 882 63.546 0.392592 -3.5108 63.546000 Cu 0.0759943 0.473964 0.5 884 63.546 1.03091 -3.41619 63.546000 Cu 0.0448077 0.493585 0.5 903 63.546 10.9953 -3.14905 63.546000 Cu 0.105503 0.493746 0 904 63.546 9.14694 -3.56799 63.546000 Cu 0.160322 0.481988 0.5 906 63.546 2.06879 -3.46273 63.546000 Cu 0.2236 0.473962 1.19811e-19 907 63.546 1.49301 -3.38266 63.546000 Cu 0.28259 0.469042 0.5 909 63.546 0.360447 -3.49768 63.546000 Cu 0.256386 0.49379 0.5 910 63.546 8.04725 -3.54424 63.546000 Cu 0.195855 0.493537 3.47452e-17 905 63.546 10.935 -3.15457 63.546000 Cu 0.305887 0.483092 0 908 63.546 9.2797 -3.32462 63.546000 Cu 0.36765 0.479455 0.5 914 63.546 2.04011 -3.47825 63.546000 Cu 0.39043 0.493542 3.13905e-17 923 63.546 10.7213 -3.31125 63.546000 Cu 0.428107 0.473478 1 912 63.546 0.630769 -3.45414 63.546000 Cu 0.487099 0.467384 0.5 918 63.546 0.449342 -3.50392 63.546000 Cu 0.454152 0.49382 0.5 924 63.546 9.98966 -3.5309 63.546000 Cu 0.511488 0.481763 4.64867e-17 925 63.546 2.17925 -3.43965 63.546000 Cu 0.544808 0.493585 0.5 928 63.546 10.9953 -3.14905 63.546000 Cu 0.605503 0.493746 8.06328e-17 926 63.546 9.14694 -3.56799 63.546000 Cu 0.575994 0.473964 0.5 927 63.546 1.03091 -3.41619 63.546000 Cu 0.634474 0.468033 1 929 63.546 0.392592 -3.5108 63.546000 Cu 0.660322 0.481988 0.5 930 63.546 2.06879 -3.46273 63.546000 Cu 0.695855 0.493537 0 872 63.546 10.935 -3.15457 63.546000 Cu 0.7236 0.473962 1.02438e-16 839 63.546 1.49301 -3.38266 63.546000 Cu 0.78259 0.469042 0.5 844 63.546 0.360447 -3.49768 63.546000 Cu 0.756386 0.49379 0.5 873 63.546 8.04725 -3.54424 63.546000 Cu 0.805887 0.483092 1 874 63.546 9.2797 -3.32462 63.546000 Cu 0.89043 0.493542 3.69018e-17 875 63.546 10.7213 -3.31125 63.546000 Cu 0.86765 0.479455 0.5 876 63.546 2.04011 -3.47825 63.546000 Cu 0.928107 0.473478 0 877 63.546 0.630769 -3.45414 63.546000 Cu 0.987099 0.467384 0.5 879 63.546 0.449342 -3.50392 63.546000 Cu 0.954152 0.49382 0.5 880 63.546 9.98966 -3.5309 63.546000 Cu 0.0132619 0.505572 0 7 63.546 1.88039 -3.43515 63.546000 Cu 0.0496148 0.527225 4.8164e-17 8 63.546 0.0297923 -3.52165 63.546000 Cu 0.0777405 0.513135 0.5 9 63.546 0.865715 -3.43108 63.546000 Cu 0.136403 0.519123 4.82838e-17 11 63.546 0.334565 -3.51388 63.546000 Cu 0.111195 0.534214 0.5 14 63.546 0.015742 -3.53011 63.546000 Cu 0.225401 0.512997 4.02565e-17 1 63.546 1.13878 -3.40161 63.546000 Cu 0.161982 0.505219 0.5 2 63.546 1.76899 -3.45754 63.546000 Cu 0.197457 0.526616 0.5 13 63.546 0.0537114 -3.51666 63.546000 Cu 0.260434 0.533299 0 15 63.546 0.102412 -3.52463 63.546000 Cu 0.284414 0.51815 0.5 3 63.546 0.295894 -3.50064 63.546000 Cu 0.307786 0.504105 0 43 63.546 9.30469 -3.32291 63.546000 Cu 0.346311 0.524006 0 44 63.546 0.110573 -3.52451 63.546000 Cu 0.369279 0.507801 0.5 45 63.546 1.82377 -3.47766 63.546000 Cu 0.405276 0.529368 0.5 49 63.546 0.0136155 -3.52415 63.546000 Cu 0.513262 0.505572 2.32433e-17 18 63.546 1.88039 -3.43515 63.546000 Cu 0.429703 0.513556 2.64782e-17 46 63.546 0.518959 -3.46857 63.546000 Cu 0.464423 0.535389 1 47 63.546 0.0374796 -3.53796 63.546000 Cu 0.488937 0.519838 0.5 48 63.546 0.383333 -3.5079 63.546000 Cu 0.549615 0.527225 1.19811e-19 50 63.546 0.0297923 -3.52165 63.546000 Cu 0.636403 0.519123 0 19 63.546 0.334565 -3.51388 63.546000 Cu 0.661982 0.505219 0.5 20 63.546 1.76899 -3.45754 63.546000 Cu 0.57774 0.513135 0.5 21 63.546 0.865715 -3.43108 63.546000 Cu 0.697457 0.526616 0.5 25 63.546 0.0537114 -3.51666 63.546000 Cu 0.611195 0.534214 0.5 52 63.546 0.015742 -3.53011 63.546000 Cu 0.807786 0.504105 0 4 63.546 9.30469 -3.32291 63.546000 Cu 0.725401 0.512997 2.33631e-17 22 63.546 1.13878 -3.40161 63.546000 Cu 0.760434 0.533299 9.06969e-17 23 63.546 0.102412 -3.52463 63.546000 Cu 0.784414 0.51815 0.5 24 63.546 0.295894 -3.50064 63.546000 Cu 0.846311 0.524006 1 26 63.546 0.110573 -3.52451 63.546000 Cu 0.929703 0.513556 4.08555e-17 5 63.546 0.518959 -3.46857 63.546000 Cu 0.869279 0.507801 0.5 6 63.546 1.82377 -3.47766 63.546000 Cu 0.988937 0.519838 0.5 10 63.546 0.383333 -3.5079 63.546000 Cu 0.905276 0.529368 0.5 28 63.546 0.0136155 -3.52415 63.546000 Cu 0.964423 0.535389 1 30 63.546 0.0374796 -3.53796 63.546000 Cu 0.0244687 0.541918 0.5 32 63.546 0.0371288 -3.54139 63.546000 Cu 0.0854817 0.548765 5.59517e-17 34 63.546 0.00551168 -3.53729 63.546000 Cu 0.1211 0.570236 7.6679e-18 35 63.546 0.00294633 -3.54018 63.546000 Cu 0.0603217 0.563576 0.5 37 63.546 0.0109348 -3.54172 63.546000 Cu 0.172236 0.540834 0 12 63.546 0.0117671 -3.54213 63.546000 Cu 0.233813 0.547633 0.5 17 63.546 0.0109915 -3.53769 63.546000 Cu 0.146799 0.555514 0.5 36 63.546 0.00135032 -3.53957 63.546000 Cu 0.20782 0.562176 0 38 63.546 0.00143838 -3.54081 63.546000 Cu 0.268732 0.568816 0.5 40 63.546 0.0039107 -3.53808 63.546000 Cu 0.294974 0.554142 1.64141e-17 16 63.546 0.0246098 -3.53354 63.546000 Cu 0.320711 0.53911 0.5 76 63.546 0.0263796 -3.53693 63.546000 Cu 0.380547 0.545062 3.9298e-17 77 63.546 0.0138918 -3.53276 63.546000 Cu 0.415168 0.56632 0 78 63.546 0.00395965 -3.53742 63.546000 Cu 0.355176 0.560273 0.5 80 63.546 0.0117611 -3.53638 63.546000 Cu 0.524469 0.541918 0.5 53 63.546 0.0371288 -3.54139 63.546000 Cu 0.439995 0.550928 0.5 79 63.546 0.00494258 -3.53732 63.546000 Cu 0.499859 0.557093 3.59433e-19 81 63.546 0.0143304 -3.54158 63.546000 Cu 0.560322 0.563576 0.5 83 63.546 0.0109348 -3.54172 63.546000 Cu 0.585482 0.548765 1 51 63.546 0.00551168 -3.53729 63.546000 Cu 0.672236 0.540834 0 54 63.546 0.0117671 -3.54213 63.546000 Cu 0.70782 0.562176 5.87074e-17 55 63.546 0.00143838 -3.54081 63.546000 Cu 0.646799 0.555514 0.5 57 63.546 0.00135032 -3.53957 63.546000 Cu 0.6211 0.570236 1.19811e-19 85 63.546 0.00294633 -3.54018 63.546000 Cu 0.820711 0.53911 0.5 29 63.546 0.0263796 -3.53693 63.546000 Cu 0.733813 0.547633 0.5 56 63.546 0.0109915 -3.53769 63.546000 Cu 0.794974 0.554142 1.15019e-17 58 63.546 0.0246098 -3.53354 63.546000 Cu 0.855176 0.560273 0.5 60 63.546 0.0117611 -3.53638 63.546000 Cu 0.768732 0.568816 0.5 61 63.546 0.0039107 -3.53808 63.546000 Cu 0.999859 0.557093 4.55282e-18 31 63.546 0.0143304 -3.54158 63.546000 Cu 0.880547 0.545062 8.26696e-18 27 63.546 0.0138918 -3.53276 63.546000 Cu 0.939995 0.550928 0.5 33 63.546 0.00494258 -3.53732 63.546000 Cu 0.915168 0.56632 4.30121e-17 62 63.546 0.00395965 -3.53742 63.546000 Cu 0.0352204 0.578642 0 66 63.546 0.00586651 -3.5413 63.546000 Cu 0.070152 0.60014 0 67 63.546 0.00255145 -3.54071 63.546000 Cu 0.0955707 0.585117 0.5 68 63.546 0.00420073 -3.541 63.546000 Cu 0.0100026 0.593805 0.5 69 63.546 0.00115337 -3.53999 63.546000 Cu 0.130578 0.606607 0.5 73 63.546 0.00167449 -3.5407 63.546000 Cu 0.242679 0.583518 4.99612e-17 39 63.546 0.000541616 -3.53991 63.546000 Cu 0.181941 0.576903 0.5 41 63.546 0.000585527 -3.54006 63.546000 Cu 0.156133 0.591703 0 70 63.546 0.00145301 -3.54037 63.546000 Cu 0.216863 0.598296 0.5 72 63.546 0.000310801 -3.54 63.546000 Cu 0.277609 0.604837 3.89386e-17 74 63.546 0.000354035 -3.53971 63.546000 Cu 0.303448 0.590046 0.5 42 63.546 0.00196139 -3.53894 63.546000 Cu 0.329419 0.575248 0 109 63.546 0.00825552 -3.53705 63.546000 Cu 0.36409 0.596431 0 110 63.546 0.00305043 -3.53837 63.546000 Cu 0.389793 0.581466 0.5 111 63.546 0.0051328 -3.53801 63.546000 Cu 0.424457 0.602709 0.5 115 63.546 0.00203584 -3.53859 63.546000 Cu 0.475095 0.572383 0.5 84 63.546 0.00230032 -3.5399 63.546000 Cu 0.53522 0.578642 1 82 63.546 0.00586651 -3.5413 63.546000 Cu 0.449954 0.587613 2.39622e-19 112 63.546 0.00130362 -3.53885 63.546000 Cu 0.510003 0.593805 0.5 114 63.546 0.00115337 -3.53999 63.546000 Cu 0.570152 0.60014 3.45056e-17 116 63.546 0.00255145 -3.54071 63.546000 Cu 0.656133 0.591703 1.24603e-17 86 63.546 0.00145301 -3.54037 63.546000 Cu 0.681941 0.576903 0.5 87 63.546 0.000585527 -3.54006 63.546000 Cu 0.595571 0.585117 0.5 88 63.546 0.00420073 -3.541 63.546000 Cu 0.630578 0.606607 0.5 118 63.546 0.00167449 -3.5407 63.546000 Cu 0.829419 0.575248 0 59 63.546 0.00825552 -3.53705 63.546000 Cu 0.742679 0.583518 1 89 63.546 0.000541616 -3.53991 63.546000 Cu 0.777609 0.604837 0 90 63.546 0.000354035 -3.53971 63.546000 Cu 0.803448 0.590046 0.5 91 63.546 0.00196139 -3.53894 63.546000 Cu 0.716863 0.598296 0.5 92 63.546 0.000310801 -3.54 63.546000 Cu 0.975095 0.572383 0.5 64 63.546 0.00230032 -3.5399 63.546000 Cu 0.949954 0.587613 1.00641e-16 63 63.546 0.00130362 -3.53885 63.546000 Cu 0.889793 0.581466 0.5 65 63.546 0.0051328 -3.53801 63.546000 Cu 0.86409 0.596431 6.40989e-17 93 63.546 0.00305043 -3.53837 63.546000 Cu 0.924457 0.602709 0.5 95 63.546 0.00203584 -3.53859 63.546000 Cu 0.0193588 0.630296 0 98 63.546 0.000200441 -3.53944 63.546000 Cu 0.0447948 0.615224 0.5 99 63.546 0.000574873 -3.53988 63.546000 Cu 0.105105 0.621585 9.22544e-18 101 63.546 0.00130501 -3.54041 63.546000 Cu 0.0795876 0.636621 0.5 104 63.546 0.00046691 -3.54002 63.546000 Cu 0.191201 0.613133 1 71 63.546 0.000540107 -3.54028 63.546000 Cu 0.251826 0.619667 0.5 75 63.546 0.000139833 -3.54005 63.546000 Cu 0.165548 0.628042 0.5 103 63.546 0.000803371 -3.54037 63.546000 Cu 0.226039 0.634546 3.66622e-17 105 63.546 0.000202142 -3.5402 63.546000 Cu 0.286587 0.641046 0.5 107 63.546 0.000115248 -3.54015 63.546000 Cu 0.312427 0.626168 3.71414e-17 142 63.546 0.000251686 -3.53981 63.546000 Cu 0.338259 0.611304 0.5 143 63.546 0.000975363 -3.53921 63.546000 Cu 0.398726 0.617687 2.83952e-17 144 63.546 0.00115068 -3.53885 63.546000 Cu 0.372971 0.632609 0.5 147 63.546 0.000562842 -3.53957 63.546000 Cu 0.484623 0.608952 1.19811e-19 113 63.546 0.000454453 -3.53914 63.546000 Cu 0.544795 0.615224 0.5 119 63.546 0.000574873 -3.53988 63.546000 Cu 0.433413 0.638993 0 145 63.546 0.000718906 -3.53958 63.546000 Cu 0.459085 0.624005 0.5 146 63.546 0.000680756 -3.53896 63.546000 Cu 0.519359 0.630296 0 148 63.546 0.000200441 -3.53944 63.546000 Cu 0.605105 0.621585 1.19811e-19 117 63.546 0.00130501 -3.54041 63.546000 Cu 0.691201 0.613133 0 120 63.546 0.000540107 -3.54028 63.546000 Cu 0.665548 0.628042 0.5 123 63.546 0.000803371 -3.54037 63.546000 Cu 0.579588 0.636621 0.5 150 63.546 0.00046691 -3.54002 63.546000 Cu 0.838259 0.611304 0.5 96 63.546 0.000975363 -3.53921 63.546000 Cu 0.726039 0.634546 1.55754e-18 121 63.546 0.000202142 -3.5402 63.546000 Cu 0.751826 0.619667 0.5 122 63.546 0.000139833 -3.54005 63.546000 Cu 0.812427 0.626168 1.82113e-17 124 63.546 0.000251686 -3.53981 63.546000 Cu 0.786587 0.641046 0.5 127 63.546 0.000115248 -3.54015 63.546000 Cu 0.898726 0.617687 0 94 63.546 0.00115068 -3.53885 63.546000 Cu 0.984623 0.608952 0 97 63.546 0.000454453 -3.53914 63.546000 Cu 0.959085 0.624005 0.5 100 63.546 0.000680756 -3.53896 63.546000 Cu 0.872971 0.632609 0.5 126 63.546 0.000562842 -3.53957 63.546000 Cu 0.933413 0.638993 1.0783e-17 128 63.546 0.000718906 -3.53958 63.546000 Cu 0.139854 0.64301 5.05602e-17 102 63.546 0.000755831 -3.54023 63.546000 Cu 0.0539013 0.651673 5.03206e-18 132 63.546 0.000109573 -3.53987 63.546000 Cu 0.0882381 0.673058 0 133 63.546 2.07089e-05 -3.53992 63.546000 Cu 0.114083 0.658024 0.5 134 63.546 0.000272939 -3.54014 63.546000 Cu 0.0280428 0.666705 0.5 135 63.546 0.000129416 -3.53978 63.546000 Cu 0.260638 0.655944 5.03206e-17 106 63.546 0.000113473 -3.54028 63.546000 Cu 0.200211 0.64946 0.5 108 63.546 0.000471249 -3.54029 63.546000 Cu 0.174324 0.664425 1.55754e-18 136 63.546 0.000422106 -3.54035 63.546000 Cu 0.23464 0.670871 0.5 138 63.546 0.000261761 -3.54032 63.546000 Cu 0.295025 0.677337 3.06716e-17 140 63.546 5.95678e-05 -3.54009 63.546000 Cu 0.3471 0.647517 0 176 63.546 0.000284301 -3.54009 63.546000 Cu 0.381468 0.66888 1.0783e-18 177 63.546 0.000106081 -3.53988 63.546000 Cu 0.40752 0.653954 0.5 178 63.546 0.000502967 -3.53998 63.546000 Cu 0.321071 0.662422 0.5 179 63.546 3.54243e-05 -3.5401 63.546000 Cu 0.553901 0.651673 8.18309e-17 149 63.546 0.000109573 -3.53987 63.546000 Cu 0.4937 0.645339 0.5 151 63.546 0.000384956 -3.53967 63.546000 Cu 0.467821 0.660346 0 180 63.546 0.000409885 -3.53979 63.546000 Cu 0.528043 0.666705 0.5 182 63.546 0.000129416 -3.53978 63.546000 Cu 0.441819 0.67531 0.5 183 63.546 0.000243831 -3.53976 63.546000 Cu 0.639854 0.64301 3.46254e-17 152 63.546 0.000755831 -3.54023 63.546000 Cu 0.674324 0.664425 0 153 63.546 0.000422106 -3.54035 63.546000 Cu 0.700211 0.64946 0.5 154 63.546 0.000471249 -3.54029 63.546000 Cu 0.614083 0.658024 0.5 155 63.546 0.000272939 -3.54014 63.546000 Cu 0.588238 0.673058 4.49291e-17 184 63.546 2.07089e-05 -3.53992 63.546000 Cu 0.8471 0.647517 7.06885e-18 125 63.546 0.000284301 -3.54009 63.546000 Cu 0.760638 0.655944 0 156 63.546 0.000113473 -3.54028 63.546000 Cu 0.795025 0.677337 0 157 63.546 5.95678e-05 -3.54009 63.546000 Cu 0.821071 0.662422 0.5 158 63.546 3.54243e-05 -3.5401 63.546000 Cu 0.73464 0.670871 0.5 159 63.546 0.000261761 -3.54032 63.546000 Cu 0.967821 0.660346 0 129 63.546 0.000409885 -3.53979 63.546000 Cu 0.9937 0.645339 0.5 130 63.546 0.000384956 -3.53967 63.546000 Cu 0.90752 0.653954 0.5 131 63.546 0.000502967 -3.53998 63.546000 Cu 0.881468 0.66888 0 160 63.546 0.000106081 -3.53988 63.546000 Cu 0.941819 0.67531 0.5 162 63.546 0.000243831 -3.53976 63.546000 Cu 0.00211263 0.681707 0 164 63.546 0.00022645 -3.53976 63.546000 Cu 0.0364244 0.703082 2.67178e-17 165 63.546 0.000147217 -3.53984 63.546000 Cu 0.0623505 0.688079 0.5 166 63.546 5.87309e-05 -3.53985 63.546000 Cu 0.122572 0.694452 1.19811e-19 168 63.546 1.33539e-05 -3.54005 63.546000 Cu 0.0966825 0.709467 0.5 171 63.546 4.52475e-05 -3.53984 63.546000 Cu 0.208707 0.68584 2.58792e-17 137 63.546 0.000227167 -3.5403 63.546000 Cu 0.148443 0.67943 0.5 139 63.546 0.000157819 -3.54016 63.546000 Cu 0.269034 0.692278 0.5 141 63.546 0.000141122 -3.54018 63.546000 Cu 0.182819 0.700841 0.5 170 63.546 6.82733e-05 -3.54018 63.546000 Cu 0.243101 0.70725 4.24131e-17 172 63.546 0.000111396 -3.54016 63.546000 Cu 0.303423 0.713679 0.5 174 63.546 8.8612e-05 -3.54009 63.546000 Cu 0.329397 0.698728 0 209 63.546 4.23232e-05 -3.54004 63.546000 Cu 0.355413 0.683798 0.5 210 63.546 1.1574e-05 -3.53992 63.546000 Cu 0.41579 0.690248 1 211 63.546 6.44517e-05 -3.53989 63.546000 Cu 0.389768 0.705182 0.5 214 63.546 4.58063e-06 -3.53996 63.546000 Cu 0.502113 0.681707 0 181 63.546 0.00022645 -3.53976 63.546000 Cu 0.562351 0.688079 0.5 187 63.546 5.87309e-05 -3.53985 63.546000 Cu 0.450127 0.711627 7.93149e-17 212 63.546 4.71851e-05 -3.53984 63.546000 Cu 0.476127 0.696677 0.5 213 63.546 0.000148663 -3.53985 63.546000 Cu 0.536424 0.703082 0 215 63.546 0.000147217 -3.53984 63.546000 Cu 0.622572 0.694452 1.18014e-16 185 63.546 1.33539e-05 -3.54005 63.546000 Cu 0.648443 0.67943 0.5 186 63.546 0.000157819 -3.54016 63.546000 Cu 0.708707 0.68584 2.43216e-17 188 63.546 0.000227167 -3.5403 63.546000 Cu 0.682819 0.700841 0.5 191 63.546 6.82733e-05 -3.54018 63.546000 Cu 0.596683 0.709467 0.5 217 63.546 4.52475e-05 -3.53984 63.546000 Cu 0.855413 0.683798 0.5 163 63.546 1.1574e-05 -3.53992 63.546000 Cu 0.743101 0.70725 2.61188e-17 189 63.546 0.000111396 -3.54016 63.546000 Cu 0.769034 0.692278 0.5 190 63.546 0.000141122 -3.54018 63.546000 Cu 0.829397 0.698728 0 192 63.546 4.23232e-05 -3.54004 63.546000 Cu 0.803423 0.713679 0.5 195 63.546 8.8612e-05 -3.54009 63.546000 Cu 0.91579 0.690248 9.94431e-18 161 63.546 6.44517e-05 -3.53989 63.546000 Cu 0.976127 0.696677 0.5 167 63.546 0.000148663 -3.53985 63.546000 Cu 0.889768 0.705182 0.5 194 63.546 4.58063e-06 -3.53996 63.546000 Cu 0.950127 0.711627 2.52801e-17 196 63.546 4.71851e-05 -3.53984 63.546000 Cu 0.010456 0.718053 0.5 198 63.546 9.19253e-05 -3.53969 63.546000 Cu 0.0707522 0.724457 1.19811e-19 200 63.546 6.80506e-05 -3.53968 63.546000 Cu 0.1051 0.745841 5.39149e-17 201 63.546 3.38755e-05 -3.53998 63.546000 Cu 0.13103 0.73085 0.5 202 63.546 2.191e-05 -3.53983 63.546000 Cu 0.044788 0.739428 0.5 203 63.546 3.85356e-05 -3.53984 63.546000 Cu 0.156931 0.715849 2.39622e-19 169 63.546 7.09229e-06 -3.53993 63.546000 Cu 0.277494 0.728655 1.19811e-19 173 63.546 6.81127e-05 -3.54012 63.546000 Cu 0.217198 0.722243 0.5 175 63.546 3.61801e-05 -3.54004 63.546000 Cu 0.191307 0.737245 0 204 63.546 9.034e-06 -3.54004 63.546000 Cu 0.251597 0.743652 0.5 206 63.546 1.87099e-05 -3.54018 63.546000 Cu 0.363769 0.720122 0 242 63.546 3.75265e-05 -3.53999 63.546000 Cu 0.398139 0.741522 1 243 63.546 3.56693e-05 -3.54008 63.546000 Cu 0.424123 0.726568 0.5 244 63.546 8.7767e-06 -3.53987 63.546000 Cu 0.337812 0.735084 0.5 245 63.546 6.37941e-05 -3.54013 63.546000 Cu 0.570752 0.724457 5.78687e-17 216 63.546 6.80506e-05 -3.53968 63.546000 Cu 0.510456 0.718053 0.5 218 63.546 9.19253e-05 -3.53969 63.546000 Cu 0.484463 0.733004 0 246 63.546 2.00696e-05 -3.53978 63.546000 Cu 0.544788 0.739428 0.5 248 63.546 3.85356e-05 -3.53984 63.546000 Cu 0.45847 0.747962 0.5 249 63.546 1.25577e-05 -3.54003 63.546000 Cu 0.656931 0.715849 0 219 63.546 7.09229e-06 -3.53993 63.546000 Cu 0.691307 0.737245 7.30847e-18 220 63.546 9.034e-06 -3.54004 63.546000 Cu 0.63103 0.73085 0.5 222 63.546 2.191e-05 -3.53983 63.546000 Cu 0.6051 0.745841 0 250 63.546 3.38755e-05 -3.53998 63.546000 Cu 0.717198 0.722243 0.5 221 63.546 3.61801e-05 -3.54004 63.546000 Cu 0.777494 0.728655 0 223 63.546 6.81127e-05 -3.54012 63.546000 Cu 0.837812 0.735084 0.5 225 63.546 6.37941e-05 -3.54013 63.546000 Cu 0.751597 0.743652 0.5 226 63.546 1.87099e-05 -3.54018 63.546000 Cu 0.863769 0.720122 5.0081e-17 193 63.546 3.75265e-05 -3.53999 63.546000 Cu 0.984463 0.733004 0 197 63.546 2.00696e-05 -3.53978 63.546000 Cu 0.924123 0.726568 0.5 199 63.546 8.7767e-06 -3.53987 63.546000 Cu 0.898139 0.741522 0 227 63.546 3.56693e-05 -3.54008 63.546000 Cu 0.95847 0.747962 0.5 229 63.546 1.25577e-05 -3.54003 63.546000 Cu 0.0188057 0.754397 0 231 63.546 7.76223e-06 -3.54004 63.546000 Cu 0.0531753 0.7758 0 232 63.546 4.49009e-06 -3.53995 63.546000 Cu 0.0791409 0.760825 0.5 233 63.546 1.8831e-05 -3.54004 63.546000 Cu 0.139467 0.767245 0 235 63.546 2.6422e-05 -3.53998 63.546000 Cu 0.113506 0.782224 0.5 238 63.546 7.19696e-06 -3.53982 63.546000 Cu 0.225702 0.758658 4.7565e-17 205 63.546 6.09005e-06 -3.54012 63.546000 Cu 0.165405 0.75225 0.5 207 63.546 1.51014e-05 -3.54011 63.546000 Cu 0.199777 0.773656 0.5 237 63.546 1.74596e-05 -3.5399 63.546000 Cu 0.260071 0.780063 2.30037e-17 239 63.546 4.52847e-06 -3.53988 63.546000 Cu 0.311897 0.750072 4.99612e-17 275 63.546 2.41521e-05 -3.54019 63.546000 Cu 0.285993 0.76507 0.5 208 63.546 8.061e-06 -3.54005 63.546000 Cu 0.346286 0.771488 4.52885e-17 276 63.546 8.04146e-06 -3.53998 63.546000 Cu 0.372201 0.7565 0.5 277 63.546 1.84773e-05 -3.54013 63.546000 Cu 0.406588 0.777914 0.5 281 63.546 5.14669e-06 -3.53996 63.546000 Cu 0.518806 0.754397 1.03996e-16 247 63.546 7.76223e-06 -3.54004 63.546000 Cu 0.432513 0.762934 0 278 63.546 1.00874e-05 -3.54007 63.546000 Cu 0.466907 0.784344 0 279 63.546 2.16786e-06 -3.53998 63.546000 Cu 0.492839 0.769368 0.5 280 63.546 4.90912e-06 -3.54003 63.546000 Cu 0.553175 0.7758 6.70941e-18 282 63.546 4.49009e-06 -3.53995 63.546000 Cu 0.639467 0.767245 3.31876e-17 251 63.546 2.6422e-05 -3.53998 63.546000 Cu 0.665405 0.75225 0.5 252 63.546 1.51014e-05 -3.54011 63.546000 Cu 0.579141 0.760825 0.5 253 63.546 1.8831e-05 -3.54004 63.546000 Cu 0.699777 0.773656 0.5 257 63.546 1.74596e-05 -3.5399 63.546000 Cu 0.613506 0.782224 0.5 284 63.546 7.19696e-06 -3.53982 63.546000 Cu 0.811897 0.750072 1.72528e-17 224 63.546 2.41521e-05 -3.54019 63.546000 Cu 0.725702 0.758658 1.16217e-17 254 63.546 6.09005e-06 -3.54012 63.546000 Cu 0.760071 0.780063 0 255 63.546 4.52847e-06 -3.53988 63.546000 Cu 0.785993 0.76507 0.5 256 63.546 8.061e-06 -3.54005 63.546000 Cu 0.846286 0.771488 1.19811e-18 258 63.546 8.04146e-06 -3.53998 63.546000 Cu 0.932513 0.762934 2.27641e-18 228 63.546 1.00874e-05 -3.54007 63.546000 Cu 0.872201 0.7565 0.5 230 63.546 1.84773e-05 -3.54013 63.546000 Cu 0.992839 0.769368 0.5 234 63.546 4.90912e-06 -3.54003 63.546000 Cu 0.906588 0.777914 0.5 260 63.546 5.14669e-06 -3.53996 63.546000 Cu 0.966907 0.784344 1.35386e-17 262 63.546 2.16786e-06 -3.53998 63.546000 Cu 0.00130306 0.805756 0 263 63.546 2.48773e-06 -3.54005 63.546000 Cu 0.0272325 0.790774 0.5 264 63.546 2.87083e-06 -3.53998 63.546000 Cu 0.0875552 0.797199 5.35555e-17 266 63.546 6.3e-06 -3.53989 63.546000 Cu 0.121929 0.818606 0 267 63.546 8.89338e-06 -3.53998 63.546000 Cu 0.0616242 0.812185 0.5 269 63.546 6.03969e-06 -3.54006 63.546000 Cu 0.173821 0.788637 0 236 63.546 2.48487e-06 -3.53974 63.546000 Cu 0.234125 0.795048 0.5 241 63.546 5.51473e-06 -3.53984 63.546000 Cu 0.147866 0.803616 0.5 268 63.546 6.33299e-06 -3.53981 63.546000 Cu 0.208175 0.810033 2.39622e-19 270 63.546 1.14408e-05 -3.53988 63.546000 Cu 0.268491 0.816457 0.5 272 63.546 1.43192e-05 -3.54006 63.546000 Cu 0.294427 0.801466 3.59433e-19 240 63.546 7.82513e-06 -3.54001 63.546000 Cu 0.320361 0.786476 0.5 308 63.546 4.93469e-06 -3.53993 63.546000 Cu 0.38066 0.792897 1.25322e-16 309 63.546 7.85316e-06 -3.53997 63.546000 Cu 0.415034 0.814315 2.81556e-17 310 63.546 1.26176e-05 -3.54002 63.546000 Cu 0.354728 0.80789 0.5 312 63.546 6.00299e-06 -3.54008 63.546000 Cu 0.527233 0.790774 0.5 285 63.546 2.87083e-06 -3.53998 63.546000 Cu 0.440976 0.799325 0.5 311 63.546 5.79239e-06 -3.54 63.546000 Cu 0.501303 0.805756 2.64782e-17 313 63.546 2.48773e-06 -3.54005 63.546000 Cu 0.561624 0.812185 0.5 315 63.546 6.03969e-06 -3.54006 63.546000 Cu 0.475354 0.820743 0.5 316 63.546 1.10422e-05 -3.53999 63.546000 Cu 0.587555 0.797199 0 283 63.546 6.3e-06 -3.53989 63.546000 Cu 0.673821 0.788637 1.19811e-19 286 63.546 2.48487e-06 -3.53974 63.546000 Cu 0.708175 0.810033 1.19811e-19 287 63.546 1.14408e-05 -3.53988 63.546000 Cu 0.647866 0.803616 0.5 289 63.546 6.33299e-06 -3.53981 63.546000 Cu 0.621929 0.818606 0 317 63.546 8.89338e-06 -3.53998 63.546000 Cu 0.820361 0.786476 0.5 261 63.546 4.93469e-06 -3.53993 63.546000 Cu 0.734125 0.795048 0.5 288 63.546 5.51473e-06 -3.53984 63.546000 Cu 0.794427 0.801466 0 290 63.546 7.82513e-06 -3.54001 63.546000 Cu 0.854728 0.80789 0.5 292 63.546 6.00299e-06 -3.54008 63.546000 Cu 0.768491 0.816457 0.5 293 63.546 1.43192e-05 -3.54006 63.546000 Cu 0.88066 0.792897 1.86905e-17 259 63.546 7.85316e-06 -3.53997 63.546000 Cu 0.940976 0.799325 0.5 265 63.546 5.79239e-06 -3.54 63.546000 Cu 0.915034 0.814315 5.23574e-17 294 63.546 1.26176e-05 -3.54002 63.546000 Cu 0.975354 0.820743 0.5 296 63.546 1.10422e-05 -3.53999 63.546000 Cu 0.0356837 0.827175 5.52329e-17 298 63.546 8.75763e-06 -3.54009 63.546000 Cu 0.0701561 0.848603 1.04954e-16 299 63.546 1.42366e-05 -3.54 63.546000 Cu 0.0960205 0.833607 0.5 300 63.546 2.78211e-05 -3.54013 63.546000 Cu 0.00976991 0.842165 0.5 301 63.546 6.64112e-05 -3.53984 63.546000 Cu 0.130535 0.855041 0.5 305 63.546 5.13899e-05 -3.54014 63.546000 Cu 0.24258 0.83145 2.39622e-19 271 63.546 2.25704e-05 -3.53998 63.546000 Cu 0.182244 0.825023 0.5 273 63.546 2.34298e-05 -3.53993 63.546000 Cu 0.156354 0.840027 0 302 63.546 2.36836e-05 -3.54004 63.546000 Cu 0.216708 0.846448 0.5 304 63.546 4.68674e-05 -3.53987 63.546000 Cu 0.277085 0.852885 0 306 63.546 3.56507e-05 -3.53994 63.546000 Cu 0.302926 0.837891 0.5 274 63.546 2.62855e-05 -3.54013 63.546000 Cu 0.328812 0.822891 1.19811e-19 341 63.546 1.31722e-05 -3.54015 63.546000 Cu 0.363271 0.844333 4.96017e-17 342 63.546 6.3099e-05 -3.54019 63.546000 Cu 0.389118 0.829321 0.5 343 63.546 2.25122e-05 -3.54005 63.546000 Cu 0.423613 0.85076 0.5 347 63.546 3.87659e-05 -3.53997 63.546000 Cu 0.535684 0.827175 1.56952e-17 314 63.546 8.75763e-06 -3.54009 63.546000 Cu 0.449425 0.83574 0 344 63.546 6.80525e-05 -3.53987 63.546000 Cu 0.50977 0.842165 0.5 346 63.546 6.64112e-05 -3.53984 63.546000 Cu 0.570156 0.848603 1.40179e-17 348 63.546 1.42366e-05 -3.54 63.546000 Cu 0.656354 0.840027 4.31319e-18 318 63.546 2.36836e-05 -3.54004 63.546000 Cu 0.682244 0.825023 0.5 319 63.546 2.34298e-05 -3.53993 63.546000 Cu 0.596021 0.833607 0.5 320 63.546 2.78211e-05 -3.54013 63.546000 Cu 0.630535 0.855041 0.5 350 63.546 5.13899e-05 -3.54014 63.546000 Cu 0.828812 0.822891 1 291 63.546 1.31722e-05 -3.54015 63.546000 Cu 0.74258 0.83145 0 321 63.546 2.25704e-05 -3.53998 63.546000 Cu 0.777085 0.852885 0 322 63.546 3.56507e-05 -3.53994 63.546000 Cu 0.802926 0.837891 0.5 323 63.546 2.62855e-05 -3.54013 63.546000 Cu 0.716708 0.846448 0.5 324 63.546 4.68674e-05 -3.53987 63.546000 Cu 0.949425 0.83574 0 295 63.546 6.80525e-05 -3.53987 63.546000 Cu 0.889118 0.829321 0.5 297 63.546 2.25122e-05 -3.54005 63.546000 Cu 0.863271 0.844333 2.09669e-17 325 63.546 6.3099e-05 -3.54019 63.546000 Cu 0.923613 0.85076 0.5 327 63.546 3.87659e-05 -3.53997 63.546000 Cu 0.0185087 0.878597 1.43773e-18 330 63.546 0.000318731 -3.53951 63.546000 Cu 0.044326 0.863591 0.5 331 63.546 9.3297e-05 -3.53975 63.546000 Cu 0.104734 0.870039 4.13348e-17 333 63.546 3.01356e-05 -3.54016 63.546000 Cu 0.139411 0.891475 4.79244e-19 334 63.546 0.000148948 -3.54052 63.546000 Cu 0.0789351 0.885012 0.5 336 63.546 0.000219988 -3.53973 63.546000 Cu 0.190896 0.861461 0 303 63.546 1.84314e-05 -3.53995 63.546000 Cu 0.251281 0.867877 0.5 307 63.546 0.000115317 -3.53966 63.546000 Cu 0.165163 0.876481 0.5 335 63.546 0.000123612 -3.54029 63.546000 Cu 0.225526 0.882893 0 337 63.546 2.75474e-05 -3.53979 63.546000 Cu 0.285851 0.8893 0.5 339 63.546 0.000484144 -3.53932 63.546000 Cu 0.31172 0.874323 0 374 63.546 6.32022e-05 -3.53985 63.546000 Cu 0.337507 0.859341 0.5 375 63.546 6.1756e-05 -3.5402 63.546000 Cu 0.397894 0.865791 0 376 63.546 0.000156346 -3.54029 63.546000 Cu 0.372139 0.880804 0.5 379 63.546 0.000255964 -3.54044 63.546000 Cu 0.483958 0.857168 1.56952e-17 345 63.546 0.000104354 -3.53968 63.546000 Cu 0.544326 0.863591 0.5 351 63.546 9.3297e-05 -3.53975 63.546000 Cu 0.432508 0.887263 3.31876e-17 377 63.546 0.000552959 -3.54055 63.546000 Cu 0.458212 0.872209 0.5 378 63.546 3.69028e-05 -3.53995 63.546000 Cu 0.518509 0.878597 0 380 63.546 0.000318731 -3.53951 63.546000 Cu 0.604734 0.870039 0 349 63.546 3.01356e-05 -3.54016 63.546000 Cu 0.690896 0.861461 0 352 63.546 1.84314e-05 -3.53995 63.546000 Cu 0.665163 0.876481 0.5 355 63.546 0.000123612 -3.54029 63.546000 Cu 0.578935 0.885012 0.5 382 63.546 0.000219988 -3.53973 63.546000 Cu 0.639411 0.891475 0 384 63.546 0.000148948 -3.54052 63.546000 Cu 0.837507 0.859341 0.5 328 63.546 6.1756e-05 -3.5402 63.546000 Cu 0.725526 0.882893 2.32433e-17 353 63.546 2.75474e-05 -3.53979 63.546000 Cu 0.751281 0.867877 0.5 354 63.546 0.000115317 -3.53966 63.546000 Cu 0.81172 0.874323 0 356 63.546 6.32022e-05 -3.53985 63.546000 Cu 0.785851 0.8893 0.5 359 63.546 0.000484144 -3.53932 63.546000 Cu 0.897894 0.865791 0 326 63.546 0.000156346 -3.54029 63.546000 Cu 0.983958 0.857168 1.85707e-17 329 63.546 0.000104354 -3.53968 63.546000 Cu 0.958212 0.872209 0.5 332 63.546 3.69028e-05 -3.53995 63.546000 Cu 0.872139 0.880804 0.5 358 63.546 0.000255964 -3.54044 63.546000 Cu 0.932508 0.887263 2.1566e-17 360 63.546 0.000552959 -3.54055 63.546000 Cu 0.0531371 0.899997 0 364 63.546 0.00118514 -3.53875 63.546000 Cu 0.0877223 0.92136 0 365 63.546 0.00581412 -3.53699 63.546000 Cu 0.113588 0.906421 0.5 366 63.546 0.000625027 -3.53951 63.546000 Cu 0.0274919 0.91508 0.5 367 63.546 0.000557025 -3.5391 63.546000 Cu 0.260095 0.904332 3.11509e-17 338 63.546 0.000195929 -3.53937 63.546000 Cu 0.199799 0.897934 0.5 340 63.546 0.000430144 -3.54051 63.546000 Cu 0.174116 0.912942 2.53999e-17 368 63.546 0.00116961 -3.5411 63.546000 Cu 0.234506 0.919404 0.5 370 63.546 0.00141299 -3.54088 63.546000 Cu 0.148339 0.927824 0.5 371 63.546 0.00221171 -3.53872 63.546000 Cu 0.294788 0.92575 0 372 63.546 0.000916371 -3.53871 63.546000 Cu 0.346311 0.895764 1 408 63.546 0.000167624 -3.53975 63.546000 Cu 0.381093 0.917185 1.19811e-19 409 63.546 0.000730643 -3.53962 63.546000 Cu 0.406848 0.902275 0.5 410 63.546 0.00102675 -3.54098 63.546000 Cu 0.320463 0.910699 0.5 411 63.546 0.00202728 -3.53826 63.546000 Cu 0.553137 0.899997 0 381 63.546 0.00118514 -3.53875 63.546000 Cu 0.492832 0.89365 0.5 383 63.546 0.000106529 -3.53968 63.546000 Cu 0.467278 0.908736 0 412 63.546 0.00159593 -3.54098 63.546000 Cu 0.527492 0.91508 0.5 414 63.546 0.000557025 -3.5391 63.546000 Cu 0.441773 0.923781 0.5 415 63.546 0.00536953 -3.54243 63.546000 Cu 0.674116 0.912942 2.58792e-17 385 63.546 0.00116961 -3.5411 63.546000 Cu 0.699799 0.897934 0.5 386 63.546 0.000430144 -3.54051 63.546000 Cu 0.613588 0.906421 0.5 387 63.546 0.000625027 -3.53951 63.546000 Cu 0.587722 0.92136 4.45697e-17 416 63.546 0.00581412 -3.53699 63.546000 Cu 0.648339 0.927824 0.5 418 63.546 0.00221171 -3.53872 63.546000 Cu 0.846311 0.895764 1.19811e-19 357 63.546 0.000167624 -3.53975 63.546000 Cu 0.760095 0.904332 6.5896e-18 388 63.546 0.000195929 -3.53937 63.546000 Cu 0.794788 0.92575 5.99055e-18 389 63.546 0.000916371 -3.53871 63.546000 Cu 0.820463 0.910699 0.5 390 63.546 0.00202728 -3.53826 63.546000 Cu 0.734506 0.919404 0.5 391 63.546 0.00141299 -3.54088 63.546000 Cu 0.967278 0.908736 6.23017e-17 361 63.546 0.00159593 -3.54098 63.546000 Cu 0.992832 0.89365 0.5 362 63.546 0.000106529 -3.53968 63.546000 Cu 0.906848 0.902275 0.5 363 63.546 0.00102675 -3.54098 63.546000 Cu 0.881093 0.917185 0 392 63.546 0.000730643 -3.53962 63.546000 Cu 0.941773 0.923781 0.5 394 63.546 0.00536953 -3.54243 63.546000 Cu 0.00212733 0.930255 1 396 63.546 0.00529008 -3.54186 63.546000 Cu 0.0369827 0.951838 0 397 63.546 0.0199367 -3.53755 63.546000 Cu 0.0621853 0.936514 0.5 398 63.546 0.00285728 -3.53694 63.546000 Cu 0.122097 0.942622 0 400 63.546 0.0345631 -3.52994 63.546000 Cu 0.0962793 0.957998 0.5 403 63.546 0.0191169 -3.52283 63.546000 Cu 0.208989 0.934469 4.73253e-17 369 63.546 0.00901164 -3.54342 63.546000 Cu 0.269263 0.940904 0.5 373 63.546 0.00548912 -3.54257 63.546000 Cu 0.183047 0.949233 0.5 402 63.546 0.0174139 -3.53882 63.546000 Cu 0.244201 0.95615 2.6598e-17 404 63.546 0.0934749 -3.54394 63.546000 Cu 0.155368 0.96359 1 401 63.546 0.28141 -3.50466 63.546000 Cu 0.304341 0.96232 0.5 406 63.546 0.0717299 -3.52145 63.546000 Cu 0.329502 0.947144 1.3311e-16 438 63.546 0.00567513 -3.53607 63.546000 Cu 0.355074 0.932023 0.5 439 63.546 0.0113666 -3.53595 63.546000 Cu 0.416067 0.938599 1 440 63.546 0.00485165 -3.53898 63.546000 Cu 0.38952 0.953157 0.5 443 63.546 0.0783549 -3.52458 63.546000 Cu 0.502127 0.930255 1 413 63.546 0.00529008 -3.54186 63.546000 Cu 0.562185 0.936514 0.5 419 63.546 0.00285728 -3.53694 63.546000 Cu 0.451537 0.960007 0 441 63.546 0.0508672 -3.52042 63.546000 Cu 0.47694 0.945398 0.5 442 63.546 0.0330912 -3.54471 63.546000 Cu 0.536983 0.951838 0 444 63.546 0.0199367 -3.53755 63.546000 Cu 0.622097 0.942622 0 417 63.546 0.0345631 -3.52994 63.546000 Cu 0.708989 0.934469 3.71414e-18 420 63.546 0.00901164 -3.54342 63.546000 Cu 0.683047 0.949233 0.5 423 63.546 0.0174139 -3.53882 63.546000 Cu 0.596279 0.957998 0.5 446 63.546 0.0191169 -3.52283 63.546000 Cu 0.655368 0.96359 1.19811e-19 448 63.546 0.28141 -3.50466 63.546000 Cu 0.855074 0.932023 0.5 395 63.546 0.0113666 -3.53595 63.546000 Cu 0.744201 0.95615 1.0172e-16 421 63.546 0.0934749 -3.54394 63.546000 Cu 0.769263 0.940904 0.5 422 63.546 0.00548912 -3.54257 63.546000 Cu 0.829502 0.947144 1 424 63.546 0.00567513 -3.53607 63.546000 Cu 0.804341 0.96232 0.5 427 63.546 0.0717299 -3.52145 63.546000 Cu 0.916067 0.938599 3.22292e-17 393 63.546 0.00485165 -3.53898 63.546000 Cu 0.97694 0.945398 0.5 399 63.546 0.0330912 -3.54471 63.546000 Cu 0.88952 0.953157 0.5 426 63.546 0.0783549 -3.52458 63.546000 Cu 0.951537 0.960007 4.79244e-17 428 63.546 0.0508672 -3.52042 63.546000 Cu 0.0118643 0.967471 0.5 430 63.546 0.47107 -3.50608 63.546000 Cu 0.070565 0.97347 3.94178e-17 432 63.546 0.664357 -3.45064 63.546000 Cu 0.106651 0.993499 0 433 63.546 11.2569 -3.30426 63.546000 Cu 0.130992 0.979623 0.5 434 63.546 2.09797 -3.47901 63.546000 Cu 0.0429313 0.99383 0.5 435 63.546 9.57641 -3.54262 63.546000 Cu 0.280272 0.97889 1.61984e-16 405 63.546 2.888 -3.47933 63.546000 Cu 0.219824 0.970418 0.5 407 63.546 0.302576 -3.47833 63.546000 Cu 0.192032 0.98326 1.01839e-17 436 63.546 8.45253 -3.25902 63.546000 Cu 0.247281 0.993608 0.5 437 63.546 8.42122 -3.51659 63.546000 Cu 0.364622 0.968602 0 457 63.546 0.365926 -3.48934 63.546000 Cu 0.389839 0.993975 1.54556e-17 458 63.546 7.9967 -3.52528 63.546000 Cu 0.422937 0.97381 0.5 459 63.546 1.41948 -3.38965 63.546000 Cu 0.339957 0.982964 0.5 460 63.546 9.26322 -3.31263 63.546000 Cu 0.570565 0.97347 1.19811e-19 445 63.546 0.664357 -3.45064 63.546000 Cu 0.511864 0.967471 0.5 447 63.546 0.47107 -3.50608 63.546000 Cu 0.486805 0.981814 6.88913e-17 461 63.546 2.25113 -3.44736 63.546000 Cu 0.542931 0.99383 0.5 462 63.546 9.57641 -3.54262 63.546000 Cu 0.451511 0.99345 0.5 463 63.546 10.4638 -3.16416 63.546000 Cu 0.692032 0.98326 2.39622e-19 449 63.546 8.45253 -3.25902 63.546000 Cu 0.630992 0.979623 0.5 451 63.546 2.09797 -3.47901 63.546000 Cu 0.606651 0.993499 3.59433e-19 464 63.546 11.2569 -3.30426 63.546000 Cu 0.719824 0.970418 0.5 450 63.546 0.302576 -3.47833 63.546000 Cu 0.780272 0.97889 2.39622e-19 452 63.546 2.888 -3.47933 63.546000 Cu 0.839957 0.982964 0.5 453 63.546 9.26322 -3.31263 63.546000 Cu 0.747281 0.993608 0.5 454 63.546 8.42122 -3.51659 63.546000 Cu 0.864622 0.968602 1 425 63.546 0.365926 -3.48934 63.546000 Cu 0.986805 0.981814 2.76763e-17 429 63.546 2.25113 -3.44736 63.546000 Cu 0.922937 0.97381 0.5 431 63.546 1.41948 -3.38965 63.546000 Cu 0.889839 0.993975 1 455 63.546 7.9967 -3.52528 63.546000 Cu 0.951511 0.99345 0.5 456 63.546 10.4638 -3.16416