Number of particles = 796 A = 1 Angstrom (basic length-scale) H0(1,1) = 25.5397 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 102.009 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61817 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 0.141278 0.0101159 2.00649e-16 406 63.546 6.21217 -3.22265 63.546000 Cu 0.0730826 0.0101081 0.5 407 63.546 0.475046 -3.51445 63.546000 Cu 0.0767944 0.0272115 0 418 63.546 0.365915 -3.49735 63.546000 Cu 0.153215 0.0250285 0.5 420 63.546 4.29998 -3.43793 63.546000 Cu 0.00321191 0.0100911 0 404 63.546 0.119647 -3.53915 63.546000 Cu 0.00582408 0.0277489 0.5 416 63.546 0.16963 -3.53167 63.546000 Cu 0.22411 0.0216961 9.37319e-17 422 63.546 9.10336 -3.28395 63.546000 Cu 0.305657 0.0328063 0 423 63.546 0.88152 -3.42032 63.546000 Cu 0.286063 0.010537 0.5 424 63.546 7.92422 -3.45592 63.546000 Cu 0.358711 0.0100543 1.19862e-19 426 63.546 1.69876 -3.50326 63.546000 Cu 0.435785 0.0282503 0 427 63.546 0.218257 -3.52958 63.546000 Cu 0.432159 0.0100886 0.5 428 63.546 0.252843 -3.52955 63.546000 Cu 0.368256 0.02917 0.5 429 63.546 0.392909 -3.47275 63.546000 Cu 0.503212 0.0100911 9.82867e-17 430 63.546 0.119647 -3.53915 63.546000 Cu 0.505824 0.0277489 0.5 433 63.546 0.16963 -3.53167 63.546000 Cu 0.576794 0.0272115 1.22139e-16 431 63.546 0.365915 -3.49735 63.546000 Cu 0.573083 0.0101081 0.5 432 63.546 0.475046 -3.51445 63.546000 Cu 0.641278 0.0101159 1.22259e-16 434 63.546 6.21217 -3.22265 63.546000 Cu 0.653215 0.0250285 0.5 437 63.546 4.29998 -3.43793 63.546000 Cu 0.786063 0.010537 0.5 403 63.546 7.92422 -3.45592 63.546000 Cu 0.805657 0.0328063 3.91948e-17 410 63.546 0.88152 -3.42032 63.546000 Cu 0.72411 0.0216961 6.08898e-17 435 63.546 9.10336 -3.28395 63.546000 Cu 0.858711 0.0100543 1.22619e-16 402 63.546 1.69876 -3.50326 63.546000 Cu 0.932159 0.0100886 0.5 405 63.546 0.252843 -3.52955 63.546000 Cu 0.868256 0.02917 0.5 412 63.546 0.392909 -3.47275 63.546000 Cu 0.935785 0.0282503 1.2106e-17 414 63.546 0.218257 -3.52958 63.546000 Cu 0.160921 0.0410708 1.0368e-16 419 63.546 0.0442276 -3.51276 63.546000 Cu 0.0872674 0.0434662 0.5 421 63.546 0.0668173 -3.53041 63.546000 Cu 0.0260443 0.0625862 0.5 444 63.546 0.043604 -3.53851 63.546000 Cu 0.0977058 0.0601586 6.3287e-17 446 63.546 0.0256569 -3.53706 63.546000 Cu 0.0141342 0.0453276 0 415 63.546 0.160068 -3.52581 63.546000 Cu 0.171208 0.0574009 0.5 448 63.546 0.0278551 -3.53648 63.546000 Cu 0.236136 0.037565 0.5 425 63.546 0.836897 -3.4469 63.546000 Cu 0.243895 0.0543712 3.41606e-17 450 63.546 0.0988467 -3.53594 63.546000 Cu 0.321236 0.0694928 1.19862e-19 451 63.546 0.0180919 -3.53483 63.546000 Cu 0.314022 0.0514302 0.5 452 63.546 0.159979 -3.51062 63.546000 Cu 0.251641 0.0718148 0.5 453 63.546 0.0233809 -3.54315 63.546000 Cu 0.379786 0.0488348 1.22499e-16 454 63.546 0.0521577 -3.50078 63.546000 Cu 0.456814 0.0649758 0 455 63.546 0.0409343 -3.52791 63.546000 Cu 0.445213 0.0467203 0.5 456 63.546 0.113237 -3.52422 63.546000 Cu 0.389316 0.0672584 0.5 457 63.546 0.0321064 -3.52541 63.546000 Cu 0.514134 0.0453276 7.22767e-17 458 63.546 0.160068 -3.52581 63.546000 Cu 0.597706 0.0601586 5.51364e-17 459 63.546 0.0256569 -3.53706 63.546000 Cu 0.587267 0.0434662 0.5 460 63.546 0.0668173 -3.53041 63.546000 Cu 0.526044 0.0625862 0.5 461 63.546 0.043604 -3.53851 63.546000 Cu 0.660921 0.0410708 1.23937e-16 462 63.546 0.0442276 -3.51276 63.546000 Cu 0.671208 0.0574009 0.5 465 63.546 0.0278551 -3.53648 63.546000 Cu 0.814022 0.0514302 0.5 413 63.546 0.159979 -3.51062 63.546000 Cu 0.821236 0.0694928 0 438 63.546 0.0180919 -3.53483 63.546000 Cu 0.743895 0.0543712 1.22619e-16 463 63.546 0.0988467 -3.53594 63.546000 Cu 0.736136 0.037565 0.5 464 63.546 0.836897 -3.4469 63.546000 Cu 0.751641 0.0718148 0.5 493 63.546 0.0233809 -3.54315 63.546000 Cu 0.879786 0.0488348 1.22379e-16 411 63.546 0.0521577 -3.50078 63.546000 Cu 0.945213 0.0467203 0.5 417 63.546 0.113237 -3.52422 63.546000 Cu 0.889316 0.0672584 0.5 440 63.546 0.0321064 -3.52541 63.546000 Cu 0.956814 0.0649758 0 442 63.546 0.0409343 -3.52791 63.546000 Cu 0.0379437 0.0799156 0 443 63.546 0.00525284 -3.53957 63.546000 Cu 0.108875 0.0771413 0.5 449 63.546 0.012351 -3.54342 63.546000 Cu 0.0490775 0.097259 0.5 473 63.546 0.00160822 -3.54067 63.546000 Cu 0.119435 0.0944888 1.19862e-19 475 63.546 0.00665499 -3.54309 63.546000 Cu 0.180481 0.0743961 1.19862e-19 447 63.546 0.024668 -3.54495 63.546000 Cu 0.18974 0.0918636 0.5 477 63.546 0.0097443 -3.54388 63.546000 Cu 0.199159 0.109525 4.79447e-19 476 63.546 0.00158977 -3.54117 63.546000 Cu 0.259776 0.0894881 3.59585e-19 479 63.546 0.00358959 -3.54211 63.546000 Cu 0.329435 0.0872856 0.5 481 63.546 0.00419797 -3.53855 63.546000 Cu 0.268812 0.10718 0.5 482 63.546 0.0011938 -3.54043 63.546000 Cu 0.338562 0.1049 1.22858e-16 480 63.546 0.00365014 -3.53946 63.546000 Cu 0.398759 0.0850576 1.22858e-16 483 63.546 0.0152709 -3.53493 63.546000 Cu 0.47879 0.0999895 3.59585e-19 484 63.546 0.0026618 -3.53863 63.546000 Cu 0.468098 0.0825976 0.5 485 63.546 0.0124774 -3.53537 63.546000 Cu 0.408596 0.10254 0.5 486 63.546 0.00450688 -3.53858 63.546000 Cu 0.537944 0.0799156 5.95713e-17 487 63.546 0.00525284 -3.53957 63.546000 Cu 0.619435 0.0944888 1.22619e-16 488 63.546 0.00665499 -3.54309 63.546000 Cu 0.608875 0.0771413 0.5 489 63.546 0.012351 -3.54342 63.546000 Cu 0.549078 0.097259 0.5 490 63.546 0.00160822 -3.54067 63.546000 Cu 0.680481 0.0743961 9.1934e-17 491 63.546 0.024668 -3.54495 63.546000 Cu 0.68974 0.0918636 0.5 494 63.546 0.0097443 -3.54388 63.546000 Cu 0.829435 0.0872856 0.5 441 63.546 0.00419797 -3.53855 63.546000 Cu 0.759776 0.0894881 1.22858e-16 492 63.546 0.00358959 -3.54211 63.546000 Cu 0.699159 0.109525 3.65579e-17 521 63.546 0.00158977 -3.54117 63.546000 Cu 0.768812 0.10718 0.5 522 63.546 0.0011938 -3.54043 63.546000 Cu 0.838562 0.1049 2.39724e-19 467 63.546 0.00365014 -3.53946 63.546000 Cu 0.898759 0.0850576 0 439 63.546 0.0152709 -3.53493 63.546000 Cu 0.968098 0.0825976 0.5 445 63.546 0.0124774 -3.53537 63.546000 Cu 0.908596 0.10254 0.5 469 63.546 0.00450688 -3.53858 63.546000 Cu 0.97879 0.0999895 5.10611e-17 471 63.546 0.0026618 -3.53863 63.546000 Cu 0.0593449 0.114679 2.39724e-19 472 63.546 0.00184514 -3.54111 63.546000 Cu 0.12941 0.112033 0.5 478 63.546 0.00295724 -3.5414 63.546000 Cu 0.0691848 0.132176 0.5 503 63.546 0.00120839 -3.54121 63.546000 Cu 0.139073 0.129643 3.59585e-19 505 63.546 0.000691327 -3.54062 63.546000 Cu 0.148737 0.147253 0.5 508 63.546 0.000123988 -3.54033 63.546000 Cu 0.218487 0.144806 7.55129e-18 506 63.546 0.000443668 -3.53993 63.546000 Cu 0.208736 0.127191 0.5 507 63.546 0.000253756 -3.54002 63.546000 Cu 0.27841 0.1248 1.22858e-16 509 63.546 0.00124051 -3.53997 63.546000 Cu 0.288335 0.142358 0.5 512 63.546 0.000753494 -3.54015 63.546000 Cu 0.358415 0.13988 0 510 63.546 0.000486347 -3.54063 63.546000 Cu 0.348369 0.122408 0.5 511 63.546 0.00167009 -3.54031 63.546000 Cu 0.418616 0.119934 1.19862e-19 513 63.546 0.000809601 -3.54047 63.546000 Cu 0.499013 0.134768 0 514 63.546 0.00050074 -3.54135 63.546000 Cu 0.489002 0.117344 0.5 515 63.546 0.000411542 -3.54065 63.546000 Cu 0.428688 0.137351 0.5 516 63.546 0.000136054 -3.54108 63.546000 Cu 0.559345 0.114679 4.80646e-17 517 63.546 0.00184514 -3.54111 63.546000 Cu 0.639073 0.129643 8.09067e-17 518 63.546 0.000691327 -3.54062 63.546000 Cu 0.62941 0.112033 0.5 519 63.546 0.00295724 -3.5414 63.546000 Cu 0.569185 0.132176 0.5 520 63.546 0.00120839 -3.54121 63.546000 Cu 0.648737 0.147253 0.5 548 63.546 0.000123988 -3.54033 63.546000 Cu 0.77841 0.1248 0 466 63.546 0.00124051 -3.53997 63.546000 Cu 0.788335 0.142358 0.5 496 63.546 0.000753494 -3.54015 63.546000 Cu 0.708736 0.127191 0.5 523 63.546 0.000253756 -3.54002 63.546000 Cu 0.718487 0.144806 0 550 63.546 0.000443668 -3.53993 63.546000 Cu 0.848369 0.122408 0.5 470 63.546 0.00167009 -3.54031 63.546000 Cu 0.858415 0.13988 0 497 63.546 0.000486347 -3.54063 63.546000 Cu 0.918616 0.119934 8.4982e-17 468 63.546 0.000809601 -3.54047 63.546000 Cu 0.989002 0.117344 0.5 474 63.546 0.000411542 -3.54065 63.546000 Cu 0.928688 0.137351 0.5 499 63.546 0.000136054 -3.54108 63.546000 Cu 0.999013 0.134768 1.23218e-16 501 63.546 0.00050074 -3.54135 63.546000 Cu 0.0788876 0.149728 1.22619e-16 502 63.546 0.000318248 -3.54081 63.546000 Cu 0.0985711 0.184841 1.22619e-16 531 63.546 2.74956e-05 -3.54076 63.546000 Cu 0.0886462 0.167287 0.5 532 63.546 7.46582e-05 -3.54055 63.546000 Cu 0.158536 0.164823 1.22619e-16 534 63.546 0.000117461 -3.54024 63.546000 Cu 0.0088718 0.152243 0.5 504 63.546 0.000479126 -3.54107 63.546000 Cu 0.0186967 0.16977 1.22499e-16 530 63.546 0.000205643 -3.54091 63.546000 Cu 0.168502 0.182369 0.5 537 63.546 6.02982e-05 -3.54064 63.546000 Cu 0.238475 0.179885 0 535 63.546 9.20045e-05 -3.54058 63.546000 Cu 0.228457 0.162356 0.5 536 63.546 0.000173529 -3.54018 63.546000 Cu 0.298427 0.159869 2.39724e-19 538 63.546 0.000183693 -3.5404 63.546000 Cu 0.3085 0.177375 0.5 541 63.546 6.64365e-05 -3.54079 63.546000 Cu 0.378617 0.174838 0 539 63.546 2.23451e-05 -3.54104 63.546000 Cu 0.368503 0.157347 0.5 540 63.546 9.87715e-05 -3.54082 63.546000 Cu 0.438689 0.154796 3.59585e-19 542 63.546 0.000180525 -3.54106 63.546000 Cu 0.448697 0.172292 0.5 545 63.546 0.000171015 -3.54102 63.546000 Cu 0.518697 0.16977 0 543 63.546 0.000205643 -3.54091 63.546000 Cu 0.508872 0.152243 0.5 544 63.546 0.000479126 -3.54107 63.546000 Cu 0.578888 0.149728 0 546 63.546 0.000318248 -3.54081 63.546000 Cu 0.658536 0.164823 9.50504e-17 547 63.546 0.000117461 -3.54024 63.546000 Cu 0.588646 0.167287 0.5 549 63.546 7.46582e-05 -3.54055 63.546000 Cu 0.598571 0.184841 1.22499e-16 574 63.546 2.74956e-05 -3.54076 63.546000 Cu 0.668502 0.182369 0.5 576 63.546 6.02982e-05 -3.54064 63.546000 Cu 0.798427 0.159869 1.94176e-17 495 63.546 0.000183693 -3.5404 63.546000 Cu 0.8085 0.177375 0.5 525 63.546 6.64365e-05 -3.54079 63.546000 Cu 0.728457 0.162356 0.5 551 63.546 0.000173529 -3.54018 63.546000 Cu 0.738475 0.179885 1.22619e-16 578 63.546 9.20045e-05 -3.54058 63.546000 Cu 0.938689 0.154796 1.22499e-16 498 63.546 0.000180525 -3.54106 63.546000 Cu 0.868503 0.157347 0.5 500 63.546 9.87715e-05 -3.54082 63.546000 Cu 0.878617 0.174838 3.59585e-17 526 63.546 2.23451e-05 -3.54104 63.546000 Cu 0.948697 0.172292 0.5 528 63.546 0.000171015 -3.54102 63.546000 Cu 0.0286466 0.187321 0.5 533 63.546 4.44011e-05 -3.54085 63.546000 Cu 0.0386723 0.204878 0 558 63.546 1.06167e-05 -3.54059 63.546000 Cu 0.118699 0.219933 0 559 63.546 1.91784e-05 -3.54043 63.546000 Cu 0.108597 0.202398 0.5 560 63.546 5.07144e-05 -3.5406 63.546000 Cu 0.178546 0.199911 1.29451e-17 562 63.546 8.38865e-05 -3.54056 63.546000 Cu 0.188662 0.217432 0.5 565 63.546 2.35805e-05 -3.54047 63.546000 Cu 0.258667 0.214917 0 563 63.546 1.01194e-05 -3.54066 63.546000 Cu 0.248533 0.197405 0.5 564 63.546 6.40385e-05 -3.54059 63.546000 Cu 0.318595 0.194878 1.19862e-19 566 63.546 1.13166e-05 -3.54087 63.546000 Cu 0.328687 0.212394 0.5 569 63.546 2.54827e-05 -3.5409 63.546000 Cu 0.398728 0.20987 4.89036e-17 567 63.546 4.14512e-05 -3.54095 63.546000 Cu 0.388683 0.192344 0.5 568 63.546 5.81888e-05 -3.54097 63.546000 Cu 0.4587 0.189819 0 570 63.546 9.76042e-05 -3.54084 63.546000 Cu 0.468723 0.207365 0.5 573 63.546 2.60565e-05 -3.54072 63.546000 Cu 0.538672 0.204878 1.22379e-16 571 63.546 1.06167e-05 -3.54059 63.546000 Cu 0.528647 0.187321 0.5 572 63.546 4.44011e-05 -3.54085 63.546000 Cu 0.608597 0.202398 0.5 577 63.546 5.07144e-05 -3.5406 63.546000 Cu 0.618699 0.219933 1.22379e-16 604 63.546 1.91784e-05 -3.54043 63.546000 Cu 0.678546 0.199911 0 575 63.546 8.38865e-05 -3.54056 63.546000 Cu 0.688662 0.217432 0.5 606 63.546 2.35805e-05 -3.54047 63.546000 Cu 0.818595 0.194878 1.22619e-16 524 63.546 1.13166e-05 -3.54087 63.546000 Cu 0.828687 0.212394 0.5 553 63.546 2.54827e-05 -3.5409 63.546000 Cu 0.748533 0.197405 0.5 579 63.546 6.40385e-05 -3.54059 63.546000 Cu 0.758667 0.214917 0 608 63.546 1.01194e-05 -3.54066 63.546000 Cu 0.9587 0.189819 1.43834e-17 527 63.546 9.76042e-05 -3.54084 63.546000 Cu 0.888683 0.192344 0.5 529 63.546 5.81888e-05 -3.54097 63.546000 Cu 0.898728 0.20987 5.34584e-17 554 63.546 4.14512e-05 -3.54095 63.546000 Cu 0.968723 0.207365 0.5 556 63.546 2.60565e-05 -3.54072 63.546000 Cu 0.0487292 0.222421 0.5 561 63.546 1.2411e-05 -3.54043 63.546000 Cu 0.058844 0.239966 9.92456e-17 588 63.546 1.16727e-05 -3.54079 63.546000 Cu 0.138948 0.255016 1.22259e-17 589 63.546 3.0006e-05 -3.54071 63.546000 Cu 0.128811 0.237469 0.5 590 63.546 2.12983e-05 -3.54083 63.546000 Cu 0.0690171 0.257519 0.5 591 63.546 3.35006e-05 -3.5406 63.546000 Cu 0.198824 0.234959 0 592 63.546 9.50385e-06 -3.54086 63.546000 Cu 0.278952 0.249972 1.19862e-19 593 63.546 3.13508e-06 -3.54078 63.546000 Cu 0.268818 0.232441 0.5 594 63.546 2.52156e-06 -3.54081 63.546000 Cu 0.208957 0.252495 0.5 595 63.546 6.05044e-06 -3.54089 63.546000 Cu 0.33882 0.229922 0 596 63.546 1.08511e-05 -3.54076 63.546000 Cu 0.348958 0.247452 0.5 599 63.546 2.14295e-05 -3.54072 63.546000 Cu 0.418921 0.24495 0 597 63.546 1.79808e-05 -3.54075 63.546000 Cu 0.40879 0.227409 0.5 598 63.546 2.61837e-05 -3.54078 63.546000 Cu 0.478781 0.224906 1.42995e-16 600 63.546 2.28209e-05 -3.54066 63.546000 Cu 0.488888 0.242458 0.5 603 63.546 7.16236e-06 -3.5409 63.546000 Cu 0.558844 0.239966 0 601 63.546 1.16727e-05 -3.54079 63.546000 Cu 0.548729 0.222421 0.5 602 63.546 1.2411e-05 -3.54043 63.546000 Cu 0.628811 0.237469 0.5 607 63.546 2.12983e-05 -3.54083 63.546000 Cu 0.569017 0.257519 0.5 632 63.546 3.35006e-05 -3.5406 63.546000 Cu 0.638948 0.255016 1.19862e-19 634 63.546 3.0006e-05 -3.54071 63.546000 Cu 0.778952 0.249972 5.10611e-17 580 63.546 3.13508e-06 -3.54078 63.546000 Cu 0.698824 0.234959 0 605 63.546 9.50385e-06 -3.54086 63.546000 Cu 0.768818 0.232441 0.5 609 63.546 2.52156e-06 -3.54081 63.546000 Cu 0.708957 0.252495 0.5 636 63.546 6.05044e-06 -3.54089 63.546000 Cu 0.83882 0.229922 0 552 63.546 1.08511e-05 -3.54076 63.546000 Cu 0.848958 0.247452 0.5 582 63.546 2.14295e-05 -3.54072 63.546000 Cu 0.978781 0.224906 2.63696e-17 555 63.546 2.28209e-05 -3.54066 63.546000 Cu 0.90879 0.227409 0.5 557 63.546 2.61837e-05 -3.54078 63.546000 Cu 0.918921 0.24495 0 584 63.546 1.79808e-05 -3.54075 63.546000 Cu 0.988888 0.242458 0.5 586 63.546 7.16236e-06 -3.5409 63.546000 Cu 0.0791176 0.275059 1.22619e-16 618 63.546 1.55021e-05 -3.54068 63.546000 Cu 0.1592 0.2901 6.02905e-17 619 63.546 4.87402e-05 -3.54078 63.546000 Cu 0.149081 0.272556 0.5 620 63.546 2.22612e-05 -3.54079 63.546000 Cu 0.0891743 0.292612 0.5 621 63.546 7.61941e-05 -3.54069 63.546000 Cu 0.019205 0.295097 1.84587e-16 615 63.546 8.72766e-06 -3.54062 63.546000 Cu 0.00915849 0.277548 0.5 616 63.546 1.439e-05 -3.54054 63.546000 Cu 0.219072 0.270032 2.39724e-19 622 63.546 1.23248e-05 -3.541 63.546000 Cu 0.29926 0.285038 0 623 63.546 2.58323e-05 -3.54074 63.546000 Cu 0.289113 0.2675 0.5 624 63.546 2.20314e-05 -3.54087 63.546000 Cu 0.229236 0.287572 0.5 625 63.546 2.04485e-05 -3.54082 63.546000 Cu 0.35911 0.264989 0 626 63.546 1.70353e-05 -3.54071 63.546000 Cu 0.439211 0.280031 1.19862e-19 627 63.546 2.76205e-05 -3.5404 63.546000 Cu 0.429098 0.262494 0.5 628 63.546 2.08671e-05 -3.54059 63.546000 Cu 0.369244 0.282521 0.5 629 63.546 4.68098e-05 -3.54048 63.546000 Cu 0.499041 0.26001 7.51534e-17 630 63.546 1.79921e-05 -3.54063 63.546000 Cu 0.509158 0.277548 0.5 633 63.546 1.439e-05 -3.54054 63.546000 Cu 0.519205 0.295097 1.19862e-19 658 63.546 8.72766e-06 -3.54062 63.546000 Cu 0.579118 0.275059 2.39724e-19 631 63.546 1.55021e-05 -3.54068 63.546000 Cu 0.649081 0.272556 0.5 637 63.546 2.22612e-05 -3.54079 63.546000 Cu 0.589174 0.292612 0.5 660 63.546 7.61941e-05 -3.54069 63.546000 Cu 0.6592 0.2901 3.59585e-19 662 63.546 4.87402e-05 -3.54078 63.546000 Cu 0.789113 0.2675 0.5 583 63.546 2.20314e-05 -3.54087 63.546000 Cu 0.79926 0.285038 9.22936e-18 610 63.546 2.58323e-05 -3.54074 63.546000 Cu 0.719072 0.270032 0 635 63.546 1.23248e-05 -3.541 63.546000 Cu 0.729236 0.287572 0.5 664 63.546 2.04485e-05 -3.54082 63.546000 Cu 0.85911 0.264989 9.1934e-17 581 63.546 1.70353e-05 -3.54071 63.546000 Cu 0.999041 0.26001 1.22619e-16 585 63.546 1.79921e-05 -3.54063 63.546000 Cu 0.929098 0.262494 0.5 587 63.546 2.08671e-05 -3.54059 63.546000 Cu 0.869244 0.282521 0.5 612 63.546 4.68098e-05 -3.54048 63.546000 Cu 0.939211 0.280031 4.05133e-17 614 63.546 2.76205e-05 -3.5404 63.546000 Cu 0.039363 0.330205 8.52218e-17 643 63.546 4.93925e-05 -3.54099 63.546000 Cu 0.0292622 0.312643 0.5 644 63.546 3.78145e-05 -3.54061 63.546000 Cu 0.0992506 0.310142 1.46471e-16 646 63.546 3.41766e-05 -3.54059 63.546000 Cu 0.109314 0.327682 0.5 649 63.546 8.61798e-05 -3.54092 63.546000 Cu 0.179367 0.325154 1.19023e-16 647 63.546 3.15863e-05 -3.54098 63.546000 Cu 0.169293 0.307623 0.5 648 63.546 7.02945e-06 -3.54085 63.546000 Cu 0.239347 0.305095 1.09554e-16 650 63.546 1.44325e-05 -3.54084 63.546000 Cu 0.319484 0.320118 2.28936e-17 651 63.546 4.31367e-05 -3.54078 63.546000 Cu 0.309368 0.302572 0.5 652 63.546 4.41752e-05 -3.54079 63.546000 Cu 0.24946 0.322628 0.5 653 63.546 2.49094e-05 -3.54089 63.546000 Cu 0.379335 0.300064 0 654 63.546 5.09562e-05 -3.54059 63.546000 Cu 0.459322 0.315136 1.22619e-16 655 63.546 2.08039e-05 -3.54056 63.546000 Cu 0.449245 0.297575 0.5 656 63.546 2.78349e-05 -3.54053 63.546000 Cu 0.389439 0.317625 0.5 657 63.546 2.28429e-05 -3.54054 63.546000 Cu 0.469442 0.332705 0.5 685 63.546 4.02534e-05 -3.54076 63.546000 Cu 0.599251 0.310142 6.77219e-17 659 63.546 3.41766e-05 -3.54059 63.546000 Cu 0.529262 0.312643 0.5 661 63.546 3.78145e-05 -3.54061 63.546000 Cu 0.539363 0.330205 6.90404e-17 687 63.546 4.93925e-05 -3.54099 63.546000 Cu 0.609314 0.327682 0.5 689 63.546 8.61798e-05 -3.54092 63.546000 Cu 0.669293 0.307623 0.5 665 63.546 7.02945e-06 -3.54085 63.546000 Cu 0.679367 0.325154 1.19862e-19 691 63.546 3.15863e-05 -3.54098 63.546000 Cu 0.809368 0.302572 0.5 613 63.546 4.41752e-05 -3.54079 63.546000 Cu 0.819484 0.320118 0 638 63.546 4.31367e-05 -3.54078 63.546000 Cu 0.739347 0.305095 1.04759e-16 663 63.546 1.44325e-05 -3.54084 63.546000 Cu 0.74946 0.322628 0.5 693 63.546 2.49094e-05 -3.54089 63.546000 Cu 0.879335 0.300064 1.19742e-16 611 63.546 5.09562e-05 -3.54059 63.546000 Cu 0.949245 0.297575 0.5 617 63.546 2.78349e-05 -3.54053 63.546000 Cu 0.889439 0.317625 0.5 640 63.546 2.28429e-05 -3.54054 63.546000 Cu 0.959322 0.315136 9.68483e-17 642 63.546 2.08039e-05 -3.54056 63.546000 Cu 0.969442 0.332705 0.5 645 63.546 4.02534e-05 -3.54076 63.546000 Cu 0.0595527 0.365303 6.70028e-17 672 63.546 0.000332638 -3.54125 63.546000 Cu 0.0494357 0.347774 0.5 673 63.546 0.000252462 -3.54125 63.546000 Cu 0.119452 0.345219 1.79793e-17 675 63.546 6.86753e-05 -3.54103 63.546000 Cu 0.129693 0.362739 0.5 678 63.546 8.88703e-05 -3.54084 63.546000 Cu 0.189521 0.342666 0.5 677 63.546 5.92737e-05 -3.54073 63.546000 Cu 0.199725 0.360191 9.34922e-18 676 63.546 0.000151721 -3.54033 63.546000 Cu 0.259577 0.340147 1.22738e-16 679 63.546 8.85998e-05 -3.54048 63.546000 Cu 0.329604 0.337656 0.5 681 63.546 0.000116783 -3.54047 63.546000 Cu 0.269672 0.357677 0.5 682 63.546 0.000293607 -3.54017 63.546000 Cu 0.339617 0.355205 2.39724e-19 680 63.546 0.000161157 -3.54038 63.546000 Cu 0.399555 0.335182 0 683 63.546 9.20315e-05 -3.54041 63.546000 Cu 0.47945 0.350284 7.38349e-17 684 63.546 0.00019434 -3.54099 63.546000 Cu 0.409539 0.352752 0.5 686 63.546 5.12439e-05 -3.54054 63.546000 Cu 0.419376 0.370327 1.22738e-16 713 63.546 0.000218676 -3.54079 63.546000 Cu 0.489392 0.367841 0.5 715 63.546 0.000532283 -3.54113 63.546000 Cu 0.619452 0.345219 4.24311e-17 688 63.546 6.86753e-05 -3.54103 63.546000 Cu 0.549436 0.347774 0.5 690 63.546 0.000252462 -3.54125 63.546000 Cu 0.559553 0.365303 5.99309e-19 717 63.546 0.000332638 -3.54125 63.546000 Cu 0.629693 0.362739 0.5 719 63.546 8.88703e-05 -3.54084 63.546000 Cu 0.689521 0.342666 0.5 694 63.546 5.92737e-05 -3.54073 63.546000 Cu 0.829604 0.337656 0.5 641 63.546 0.000116783 -3.54047 63.546000 Cu 0.759577 0.340147 0 692 63.546 8.85998e-05 -3.54048 63.546000 Cu 0.699725 0.360191 0 721 63.546 0.000151721 -3.54033 63.546000 Cu 0.769672 0.357677 0.5 722 63.546 0.000293607 -3.54017 63.546000 Cu 0.839617 0.355205 1.22619e-16 667 63.546 0.000161157 -3.54038 63.546000 Cu 0.899555 0.335182 7.67116e-18 639 63.546 9.20315e-05 -3.54041 63.546000 Cu 0.919376 0.370327 1.22619e-16 668 63.546 0.000218676 -3.54079 63.546000 Cu 0.909539 0.352752 0.5 669 63.546 5.12439e-05 -3.54054 63.546000 Cu 0.97945 0.350284 0 671 63.546 0.00019434 -3.54099 63.546000 Cu 0.989392 0.367841 0.5 674 63.546 0.000532283 -3.54113 63.546000 Cu 0.0799153 0.400196 1.22499e-16 702 63.546 0.000619363 -3.54053 63.546000 Cu 0.0696818 0.382773 0.5 703 63.546 0.000132614 -3.54119 63.546000 Cu 0.139982 0.380225 1.22738e-16 705 63.546 0.00054939 -3.54063 63.546000 Cu 0.150217 0.39771 0.5 708 63.546 0.00176942 -3.5403 63.546000 Cu 0.00952261 0.402781 0.5 704 63.546 0.000694451 -3.54067 63.546000 Cu 0.220144 0.395296 2.58902e-17 706 63.546 0.00125802 -3.53994 63.546000 Cu 0.209984 0.37772 0.5 707 63.546 0.000680799 -3.53997 63.546000 Cu 0.27977 0.375246 9.03758e-17 709 63.546 0.00042162 -3.54002 63.546000 Cu 0.289801 0.392888 0.5 712 63.546 0.000268797 -3.54016 63.546000 Cu 0.359414 0.390422 2.33731e-17 710 63.546 0.000441975 -3.54067 63.546000 Cu 0.349499 0.372791 0.5 711 63.546 0.000193585 -3.54041 63.546000 Cu 0.499363 0.385344 1.03081e-17 714 63.546 0.000722488 -3.54127 63.546000 Cu 0.429223 0.387903 0.5 716 63.546 0.00120005 -3.54122 63.546000 Cu 0.439262 0.405445 0 742 63.546 0.00226107 -3.54116 63.546000 Cu 0.509523 0.402781 0.5 744 63.546 0.000694451 -3.54067 63.546000 Cu 0.639982 0.380225 3.59585e-19 718 63.546 0.00054939 -3.54063 63.546000 Cu 0.569682 0.382773 0.5 720 63.546 0.000132614 -3.54119 63.546000 Cu 0.579915 0.400196 1.22259e-17 746 63.546 0.000619363 -3.54053 63.546000 Cu 0.650217 0.39771 0.5 748 63.546 0.00176942 -3.5403 63.546000 Cu 0.77977 0.375246 1.19862e-19 666 63.546 0.00042162 -3.54002 63.546000 Cu 0.789801 0.392888 0.5 696 63.546 0.000268797 -3.54016 63.546000 Cu 0.709984 0.37772 0.5 723 63.546 0.000680799 -3.53997 63.546000 Cu 0.720144 0.395296 1.30649e-17 750 63.546 0.00125802 -3.53994 63.546000 Cu 0.849499 0.372791 0.5 670 63.546 0.000193585 -3.54041 63.546000 Cu 0.859414 0.390422 3.95544e-17 697 63.546 0.000441975 -3.54067 63.546000 Cu 0.939262 0.405445 2.70888e-17 698 63.546 0.00226107 -3.54116 63.546000 Cu 0.929223 0.387903 0.5 699 63.546 0.00120005 -3.54122 63.546000 Cu 0.999363 0.385344 2.44878e-16 701 63.546 0.000722488 -3.54127 63.546000 Cu 0.100258 0.435099 5.26193e-17 731 63.546 0.0142806 -3.5352 63.546000 Cu 0.0901829 0.417598 0.5 732 63.546 0.00440048 -3.53888 63.546000 Cu 0.0309015 0.437574 0.5 733 63.546 0.0118596 -3.53565 63.546000 Cu 0.160216 0.415226 0 734 63.546 0.00347306 -3.53944 63.546000 Cu 0.0199902 0.42016 0 730 63.546 0.00250679 -3.53904 63.546000 Cu 0.169605 0.432843 0.5 737 63.546 0.00428975 -3.53845 63.546000 Cu 0.239218 0.430626 0 735 63.546 0.00297355 -3.54193 63.546000 Cu 0.229988 0.412933 0.5 736 63.546 0.00134893 -3.54035 63.546000 Cu 0.299623 0.410573 1.19862e-19 738 63.546 0.00128365 -3.54121 63.546000 Cu 0.309253 0.428256 0.5 741 63.546 0.00851528 -3.54381 63.546000 Cu 0.379498 0.42566 0 739 63.546 0.00667809 -3.54292 63.546000 Cu 0.369313 0.408074 0.5 740 63.546 0.00255897 -3.54139 63.546000 Cu 0.449751 0.422902 0.5 745 63.546 0.00164096 -3.54074 63.546000 Cu 0.390221 0.443051 0.5 768 63.546 0.0131023 -3.54359 63.546000 Cu 0.461062 0.440281 1.22259e-16 770 63.546 0.0046494 -3.53972 63.546000 Cu 0.51999 0.42016 2.33731e-17 743 63.546 0.00250679 -3.53904 63.546000 Cu 0.660216 0.415226 0 747 63.546 0.00347306 -3.53944 63.546000 Cu 0.590183 0.417598 0.5 749 63.546 0.00440048 -3.53888 63.546000 Cu 0.530902 0.437574 0.5 772 63.546 0.0118596 -3.53565 63.546000 Cu 0.600258 0.435099 5.15406e-18 774 63.546 0.0142806 -3.5352 63.546000 Cu 0.669605 0.432843 0.5 776 63.546 0.00428975 -3.53845 63.546000 Cu 0.799623 0.410573 8.19855e-17 695 63.546 0.00128365 -3.54121 63.546000 Cu 0.809253 0.428256 0.5 725 63.546 0.00851528 -3.54381 63.546000 Cu 0.729988 0.412933 0.5 751 63.546 0.00134893 -3.54035 63.546000 Cu 0.739218 0.430626 9.70881e-18 778 63.546 0.00297355 -3.54193 63.546000 Cu 0.869313 0.408074 0.5 700 63.546 0.00255897 -3.54139 63.546000 Cu 0.879498 0.42566 1.22619e-16 726 63.546 0.00667809 -3.54292 63.546000 Cu 0.961062 0.440281 1.96334e-16 727 63.546 0.0046494 -3.53972 63.546000 Cu 0.949751 0.422902 0.5 728 63.546 0.00164096 -3.54074 63.546000 Cu 0.890221 0.443051 0.5 729 63.546 0.0131023 -3.54359 63.546000 Cu 0.0424413 0.455205 1.22619e-16 758 63.546 0.0397555 -3.52756 63.546000 Cu 0.119812 0.471319 1.28971e-16 759 63.546 0.0555773 -3.50012 63.546000 Cu 0.109987 0.4529 0.5 760 63.546 0.0317753 -3.52577 63.546000 Cu 0.0543727 0.473455 0.5 761 63.546 0.116512 -3.52336 63.546000 Cu 0.178074 0.45064 1.19862e-19 762 63.546 0.0174527 -3.53515 63.546000 Cu 0.185592 0.468713 0.5 765 63.546 0.152484 -3.51032 63.546000 Cu 0.255609 0.465778 2.39724e-19 763 63.546 0.0881831 -3.53698 63.546000 Cu 0.247626 0.448307 0.5 764 63.546 0.0205798 -3.54334 63.546000 Cu 0.318716 0.445744 1.19862e-19 766 63.546 0.0216871 -3.54523 63.546000 Cu 0.328113 0.462797 0.5 769 63.546 0.0273286 -3.53801 63.546000 Cu 0.338364 0.479199 1.19862e-19 789 63.546 0.0393814 -3.51419 63.546000 Cu 0.401521 0.460074 2.39724e-19 767 63.546 0.0247222 -3.53761 63.546000 Cu 0.473204 0.457626 0.5 773 63.546 0.0428711 -3.53842 63.546000 Cu 0.412065 0.476766 0.5 791 63.546 0.0632026 -3.5295 63.546000 Cu 0.48538 0.474878 1.44194e-16 793 63.546 0.161351 -3.5242 63.546000 Cu 0.619812 0.471319 1.19862e-19 400 63.546 0.0555773 -3.50012 63.546000 Cu 0.542441 0.455205 3.97941e-17 771 63.546 0.0397555 -3.52756 63.546000 Cu 0.609987 0.4529 0.5 777 63.546 0.0317753 -3.52577 63.546000 Cu 0.554373 0.473455 0.5 795 63.546 0.116512 -3.52336 63.546000 Cu 0.685592 0.468713 0.5 11 63.546 0.152484 -3.51032 63.546000 Cu 0.678074 0.45064 0 775 63.546 0.0174527 -3.53515 63.546000 Cu 0.755609 0.465778 3.59585e-19 3 63.546 0.0881831 -3.53698 63.546000 Cu 0.818716 0.445744 6.07699e-17 724 63.546 0.0216871 -3.54523 63.546000 Cu 0.828113 0.462797 0.5 753 63.546 0.0273286 -3.53801 63.546000 Cu 0.747626 0.448307 0.5 779 63.546 0.0205798 -3.54334 63.546000 Cu 0.838364 0.479199 1 752 63.546 0.0393814 -3.51419 63.546000 Cu 0.901521 0.460074 1.22379e-16 754 63.546 0.0247222 -3.53761 63.546000 Cu 0.98538 0.474878 1.22259e-16 755 63.546 0.161351 -3.5242 63.546000 Cu 0.973204 0.457626 0.5 756 63.546 0.0428711 -3.53842 63.546000 Cu 0.912065 0.476766 0.5 757 63.546 0.0632026 -3.5295 63.546000 Cu 0.0678713 0.510093 0.5 7 63.546 0.252107 -3.52958 63.546000 Cu 0.0640642 0.491904 2.39724e-19 784 63.546 0.2176 -3.52907 63.546000 Cu 0.131691 0.491028 0.5 785 63.546 0.449511 -3.46643 63.546000 Cu 0.141304 0.510066 3.95544e-18 6 63.546 1.69107 -3.50327 63.546000 Cu 0.213972 0.510512 0.5 8 63.546 7.91781 -3.45606 63.546000 Cu 0.19407 0.487298 0 786 63.546 1.01362 -3.40647 63.546000 Cu 0.275143 0.49868 3.59585e-19 787 63.546 9.28744 -3.28925 63.546000 Cu 0.263445 0.48267 0.5 788 63.546 0.950972 -3.44496 63.546000 Cu 0.346236 0.495235 0.5 792 63.546 4.39498 -3.43677 63.546000 Cu 0.35879 0.510108 1.19143e-16 12 63.546 6.21097 -3.22306 63.546000 Cu 0.426979 0.510104 0.5 14 63.546 0.475281 -3.5144 63.546000 Cu 0.422909 0.492984 0 790 63.546 0.379609 -3.49502 63.546000 Cu 0.493947 0.492439 0.5 796 63.546 0.171672 -3.53084 63.546000 Cu 0.496826 0.510096 3.60784e-17 16 63.546 0.119221 -3.53913 63.546000 Cu 0.631691 0.491028 0.5 9 63.546 0.449511 -3.46643 63.546000 Cu 0.567871 0.510093 0.5 18 63.546 0.252107 -3.52958 63.546000 Cu 0.564064 0.491904 6.46055e-17 794 63.546 0.2176 -3.52907 63.546000 Cu 0.641304 0.510066 1.19862e-19 20 63.546 1.69107 -3.50327 63.546000 Cu 0.763445 0.48267 0.5 1 63.546 0.950972 -3.44496 63.546000 Cu 0.713972 0.510512 0.5 22 63.546 7.91781 -3.45606 63.546000 Cu 0.69407 0.487298 3.59585e-19 394 63.546 1.01362 -3.40647 63.546000 Cu 0.775143 0.49868 0 780 63.546 9.28744 -3.28925 63.546000 Cu 0.996826 0.510096 3.59585e-19 4 63.546 0.119221 -3.53913 63.546000 Cu 0.846236 0.495235 0.5 781 63.546 4.39498 -3.43677 63.546000 Cu 0.85879 0.510108 1 2 63.546 6.21097 -3.22306 63.546000 Cu 0.926979 0.510104 0.5 5 63.546 0.475281 -3.5144 63.546000 Cu 0.922909 0.492984 2.39724e-19 782 63.546 0.379609 -3.49502 63.546000 Cu 0.993947 0.492439 0.5 783 63.546 0.171672 -3.53084 63.546000 Cu 0.0642009 0.528262 0 32 63.546 0.216979 -3.52936 63.546000 Cu 0.120177 0.548843 1.22499e-16 33 63.546 0.0516674 -3.50088 63.546000 Cu 0.131705 0.529182 0.5 34 63.546 0.389082 -3.47251 63.546000 Cu 0.0547508 0.546738 0.5 35 63.546 0.113096 -3.5241 63.546000 Cu 0.275876 0.521694 0 10 63.546 9.11137 -3.2842 63.546000 Cu 0.194327 0.5328 0 36 63.546 0.884306 -3.42013 63.546000 Cu 0.185932 0.551433 0.5 37 63.546 0.159086 -3.51082 63.546000 Cu 0.256041 0.554367 0 38 63.546 0.0993361 -3.53624 63.546000 Cu 0.263822 0.537554 0.5 39 63.546 0.83978 -3.4467 63.546000 Cu 0.423238 0.527219 2.39724e-19 13 63.546 0.3696 -3.49736 63.546000 Cu 0.346781 0.525036 0.5 15 63.546 4.31576 -3.43854 63.546000 Cu 0.339044 0.541068 2.39724e-19 40 63.546 0.0446787 -3.51243 63.546000 Cu 0.412701 0.543466 0.5 42 63.546 0.0670358 -3.53014 63.546000 Cu 0.494187 0.527758 0.5 19 63.546 0.170691 -3.53164 63.546000 Cu 0.48583 0.545336 0 44 63.546 0.1603 -3.52555 63.546000 Cu 0.564201 0.528262 2.39724e-19 17 63.546 0.216979 -3.52936 63.546000 Cu 0.631705 0.529182 0.5 23 63.546 0.389082 -3.47251 63.546000 Cu 0.554751 0.546738 0.5 46 63.546 0.113096 -3.5241 63.546000 Cu 0.620177 0.548843 1.19862e-19 48 63.546 0.0516674 -3.50088 63.546000 Cu 0.694327 0.5328 0 21 63.546 0.884306 -3.42013 63.546000 Cu 0.775876 0.521694 2.39724e-19 24 63.546 9.11137 -3.2842 63.546000 Cu 0.763822 0.537554 0.5 27 63.546 0.83978 -3.4467 63.546000 Cu 0.685932 0.551433 0.5 50 63.546 0.159086 -3.51082 63.546000 Cu 0.756041 0.554367 4.09927e-17 52 63.546 0.0993361 -3.53624 63.546000 Cu 0.98583 0.545336 2.13354e-17 29 63.546 0.1603 -3.52555 63.546000 Cu 0.994187 0.527758 0.5 30 63.546 0.170691 -3.53164 63.546000 Cu 0.839044 0.541068 0 25 63.546 0.0446787 -3.51243 63.546000 Cu 0.846781 0.525036 0.5 26 63.546 4.31576 -3.43854 63.546000 Cu 0.923238 0.527219 4.79447e-19 28 63.546 0.3696 -3.49736 63.546000 Cu 0.912701 0.543466 0.5 31 63.546 0.0670358 -3.53014 63.546000 Cu 0.0431119 0.56499 3.57188e-17 60 63.546 0.041315 -3.52795 63.546000 Cu 0.101135 0.585068 6.11295e-18 61 63.546 0.015397 -3.53493 63.546000 Cu 0.110616 0.567271 0.5 62 63.546 0.0325193 -3.5254 63.546000 Cu 0.031778 0.582607 0.5 63 63.546 0.0124139 -3.53538 63.546000 Cu 0.178694 0.569499 0 64 63.546 0.0179978 -3.53486 63.546000 Cu 0.170463 0.587292 0.5 65 63.546 0.00411864 -3.53852 63.546000 Cu 0.240112 0.589496 0 66 63.546 0.00356582 -3.54212 63.546000 Cu 0.24828 0.571818 0.5 67 63.546 0.0231599 -3.54316 63.546000 Cu 0.328707 0.5574 0.5 43 63.546 0.0283931 -3.53666 63.546000 Cu 0.319419 0.574399 2.39724e-19 68 63.546 0.0249142 -3.54497 63.546000 Cu 0.310135 0.591874 0.5 71 63.546 0.00956565 -3.5439 63.546000 Cu 0.40222 0.560162 0 41 63.546 0.0257667 -3.53715 63.546000 Cu 0.473865 0.562595 0.5 47 63.546 0.0429206 -3.53849 63.546000 Cu 0.390999 0.577147 0.5 70 63.546 0.0124064 -3.54345 63.546000 Cu 0.461932 0.579925 2.39724e-19 72 63.546 0.00515708 -3.53954 63.546000 Cu 0.543112 0.56499 7.70711e-17 45 63.546 0.041315 -3.52795 63.546000 Cu 0.610616 0.567271 0.5 51 63.546 0.0325193 -3.5254 63.546000 Cu 0.531778 0.582607 0.5 74 63.546 0.0124139 -3.53538 63.546000 Cu 0.601135 0.585068 2.57703e-17 76 63.546 0.015397 -3.53493 63.546000 Cu 0.678694 0.569499 0 49 63.546 0.0179978 -3.53486 63.546000 Cu 0.74828 0.571818 0.5 55 63.546 0.0231599 -3.54316 63.546000 Cu 0.670463 0.587292 0.5 78 63.546 0.00411864 -3.53852 63.546000 Cu 0.740112 0.589496 8.1506e-17 80 63.546 0.00356582 -3.54212 63.546000 Cu 0.819419 0.574399 1.38081e-16 53 63.546 0.0249142 -3.54497 63.546000 Cu 0.828707 0.5574 0.5 54 63.546 0.0283931 -3.53666 63.546000 Cu 0.810135 0.591874 0.5 82 63.546 0.00956565 -3.5439 63.546000 Cu 0.90222 0.560162 1.19862e-19 56 63.546 0.0257667 -3.53715 63.546000 Cu 0.961932 0.579925 1.28612e-16 57 63.546 0.00515708 -3.53954 63.546000 Cu 0.973865 0.562595 0.5 58 63.546 0.0429206 -3.53849 63.546000 Cu 0.890999 0.577147 0.5 59 63.546 0.0124064 -3.54345 63.546000 Cu 0.0210773 0.599997 1.22619e-16 88 63.546 0.00259422 -3.53862 63.546000 Cu 0.0812399 0.619941 0 89 63.546 0.000772321 -3.54045 63.546000 Cu 0.0912778 0.602547 0.5 90 63.546 0.00444456 -3.53858 63.546000 Cu 0.0108681 0.617351 0.5 91 63.546 0.000391545 -3.54064 63.546000 Cu 0.161306 0.60491 0 92 63.546 0.00368165 -3.53945 63.546000 Cu 0.151475 0.622419 0.5 93 63.546 0.00161582 -3.54028 63.546000 Cu 0.221432 0.624814 5.34584e-17 94 63.546 0.00122463 -3.53997 63.546000 Cu 0.231042 0.607192 0.5 95 63.546 0.00112518 -3.54045 63.546000 Cu 0.300686 0.609539 1.22738e-16 96 63.546 0.00149758 -3.54119 63.546000 Cu 0.291115 0.627206 0.5 99 63.546 0.000241839 -3.53999 63.546000 Cu 0.380425 0.594499 0 69 63.546 0.00660218 -3.54314 63.546000 Cu 0.450783 0.597268 0.5 75 63.546 0.00169752 -3.54071 63.546000 Cu 0.370443 0.612046 0.5 98 63.546 0.00292506 -3.54144 63.546000 Cu 0.440524 0.614689 3.59585e-19 100 63.546 0.00179729 -3.54114 63.546000 Cu 0.521077 0.599997 2.39724e-19 73 63.546 0.00259422 -3.53862 63.546000 Cu 0.591278 0.602547 0.5 79 63.546 0.00444456 -3.53858 63.546000 Cu 0.510868 0.617351 0.5 102 63.546 0.000391545 -3.54064 63.546000 Cu 0.58124 0.619941 2.56504e-17 104 63.546 0.000772321 -3.54045 63.546000 Cu 0.661306 0.60491 1.2142e-16 77 63.546 0.00368165 -3.53945 63.546000 Cu 0.651475 0.622419 0.5 106 63.546 0.00161582 -3.54028 63.546000 Cu 0.800686 0.609539 3.59585e-19 81 63.546 0.00149758 -3.54119 63.546000 Cu 0.731042 0.607192 0.5 83 63.546 0.00112518 -3.54045 63.546000 Cu 0.721432 0.624814 0 108 63.546 0.00122463 -3.53997 63.546000 Cu 0.791115 0.627206 0.5 110 63.546 0.000241839 -3.53999 63.546000 Cu 0.880425 0.594499 2.90066e-17 84 63.546 0.00660218 -3.54314 63.546000 Cu 0.940524 0.614689 2.39724e-19 85 63.546 0.00179729 -3.54114 63.546000 Cu 0.950783 0.597268 0.5 86 63.546 0.00169752 -3.54071 63.546000 Cu 0.870443 0.612046 0.5 87 63.546 0.00292506 -3.54144 63.546000 Cu 0.000854427 0.634776 0 116 63.546 0.000473169 -3.54133 63.546000 Cu 0.0611714 0.654808 0 117 63.546 0.000136316 -3.54108 63.546000 Cu 0.0711642 0.637361 0.5 118 63.546 0.000138904 -3.54108 63.546000 Cu 0.131358 0.657357 0.5 123 63.546 8.75114e-05 -3.54085 63.546000 Cu 0.141421 0.639891 1.53423e-17 120 63.546 0.000423841 -3.54063 63.546000 Cu 0.201444 0.659876 0 121 63.546 0.000173607 -3.54041 63.546000 Cu 0.211508 0.642368 0.5 122 63.546 0.000688882 -3.54012 63.546000 Cu 0.281375 0.644814 0 124 63.546 0.000441918 -3.53988 63.546000 Cu 0.271414 0.66236 0.5 127 63.546 0.000139409 -3.5402 63.546000 Cu 0.360787 0.629653 1.19862e-19 97 63.546 0.000708804 -3.5406 63.546000 Cu 0.430692 0.632184 0.5 103 63.546 0.0011475 -3.54118 63.546000 Cu 0.341336 0.664829 1.22619e-16 125 63.546 0.000103859 -3.54025 63.546000 Cu 0.351134 0.647259 0.5 126 63.546 0.000113645 -3.54028 63.546000 Cu 0.42098 0.649734 1.19862e-19 128 63.546 0.000329262 -3.54081 63.546000 Cu 0.490993 0.652253 0.5 130 63.546 0.000455461 -3.54109 63.546000 Cu 0.500854 0.634776 5.17803e-17 101 63.546 0.000473169 -3.54133 63.546000 Cu 0.571164 0.637361 0.5 107 63.546 0.000138904 -3.54108 63.546000 Cu 0.561171 0.654808 6.95199e-18 132 63.546 0.000136316 -3.54108 63.546000 Cu 0.631358 0.657357 0.5 134 63.546 8.75114e-05 -3.54085 63.546000 Cu 0.641421 0.639891 6.25679e-17 105 63.546 0.000423841 -3.54063 63.546000 Cu 0.781375 0.644814 4.87838e-17 109 63.546 0.000441918 -3.53988 63.546000 Cu 0.711508 0.642368 0.5 111 63.546 0.000688882 -3.54012 63.546000 Cu 0.701444 0.659876 0 136 63.546 0.000173607 -3.54041 63.546000 Cu 0.771414 0.66236 0.5 138 63.546 0.000139409 -3.5402 63.546000 Cu 0.990993 0.652253 0.5 119 63.546 0.000455461 -3.54109 63.546000 Cu 0.860787 0.629653 2.72086e-17 112 63.546 0.000708804 -3.5406 63.546000 Cu 0.92098 0.649734 0 113 63.546 0.000329262 -3.54081 63.546000 Cu 0.930692 0.632184 0.5 114 63.546 0.0011475 -3.54118 63.546000 Cu 0.851134 0.647259 0.5 115 63.546 0.000113645 -3.54028 63.546000 Cu 0.841336 0.664829 9.84065e-17 140 63.546 0.000103859 -3.54025 63.546000 Cu 0.0412115 0.689822 0 145 63.546 0.000111286 -3.54082 63.546000 Cu 0.0511747 0.672301 0.5 146 63.546 0.000162884 -3.54102 63.546000 Cu 0.121287 0.674847 6.70028e-17 148 63.546 1.42156e-05 -3.54105 63.546000 Cu 0.111246 0.692348 0.5 151 63.546 6.33703e-05 -3.54094 63.546000 Cu 0.181334 0.694886 0 149 63.546 1.266e-05 -3.54086 63.546000 Cu 0.19141 0.677382 0.5 150 63.546 8.41089e-05 -3.54079 63.546000 Cu 0.261425 0.679892 1.22499e-16 152 63.546 9.88213e-05 -3.54061 63.546000 Cu 0.251389 0.697415 0.5 155 63.546 7.44822e-05 -3.54057 63.546000 Cu 0.321365 0.699919 1.22619e-16 153 63.546 8.11076e-05 -3.54054 63.546000 Cu 0.331375 0.682377 0.5 154 63.546 4.61453e-05 -3.54065 63.546000 Cu 0.411208 0.667294 0.5 131 63.546 6.2401e-05 -3.54058 63.546000 Cu 0.401298 0.68485 0 156 63.546 8.80194e-06 -3.54075 63.546000 Cu 0.471238 0.687327 0.5 158 63.546 3.91466e-05 -3.54084 63.546000 Cu 0.391333 0.702403 0.5 159 63.546 4.99307e-05 -3.54058 63.546000 Cu 0.481162 0.669779 1.22738e-16 129 63.546 0.000186868 -3.54095 63.546000 Cu 0.621287 0.674847 1.22858e-16 133 63.546 1.42156e-05 -3.54105 63.546000 Cu 0.551175 0.672301 0.5 135 63.546 0.000162884 -3.54102 63.546000 Cu 0.541211 0.689822 0 160 63.546 0.000111286 -3.54082 63.546000 Cu 0.611246 0.692348 0.5 162 63.546 6.33703e-05 -3.54094 63.546000 Cu 0.761425 0.679892 0 137 63.546 9.88213e-05 -3.54061 63.546000 Cu 0.69141 0.677382 0.5 139 63.546 8.41089e-05 -3.54079 63.546000 Cu 0.681334 0.694886 1 164 63.546 1.266e-05 -3.54086 63.546000 Cu 0.751389 0.697415 0.5 166 63.546 7.44822e-05 -3.54057 63.546000 Cu 0.831375 0.682377 0.5 143 63.546 4.61453e-05 -3.54065 63.546000 Cu 0.821365 0.699919 4.21914e-17 168 63.546 8.11076e-05 -3.54054 63.546000 Cu 0.981162 0.669779 1.19862e-19 144 63.546 0.000186868 -3.54095 63.546000 Cu 0.901298 0.68485 0 141 63.546 8.80194e-06 -3.54075 63.546000 Cu 0.911208 0.667294 0.5 142 63.546 6.2401e-05 -3.54058 63.546000 Cu 0.971238 0.687327 0.5 147 63.546 3.91466e-05 -3.54084 63.546000 Cu 0.891333 0.702403 0.5 170 63.546 4.99307e-05 -3.54058 63.546000 Cu 0.0211993 0.724907 0 173 63.546 2.32588e-05 -3.54069 63.546000 Cu 0.0312341 0.707364 0.5 174 63.546 3.65353e-05 -3.54075 63.546000 Cu 0.101224 0.709872 1.49588e-16 176 63.546 5.03768e-05 -3.54096 63.546000 Cu 0.0911842 0.727412 0.5 179 63.546 2.02857e-05 -3.54081 63.546000 Cu 0.161165 0.729925 0 177 63.546 1.27605e-05 -3.54077 63.546000 Cu 0.17126 0.712401 0.5 178 63.546 1.70059e-05 -3.54089 63.546000 Cu 0.241285 0.714924 1.30649e-17 180 63.546 6.1865e-06 -3.54064 63.546000 Cu 0.301203 0.73496 1.19862e-19 181 63.546 1.45404e-05 -3.54088 63.546000 Cu 0.231191 0.732444 0.5 183 63.546 3.99386e-06 -3.54085 63.546000 Cu 0.311315 0.717438 0.5 182 63.546 3.49703e-05 -3.54042 63.546000 Cu 0.461269 0.704879 1.76197e-17 157 63.546 8.99042e-06 -3.54059 63.546000 Cu 0.381285 0.719934 1.19862e-19 184 63.546 2.23113e-05 -3.54041 63.546000 Cu 0.441169 0.739966 2.39724e-19 185 63.546 9.89926e-06 -3.54078 63.546000 Cu 0.451265 0.72242 0.5 186 63.546 2.90058e-05 -3.54045 63.546000 Cu 0.371216 0.737469 0.5 187 63.546 3.52449e-05 -3.54087 63.546000 Cu 0.601224 0.709872 2.39724e-19 161 63.546 5.03768e-05 -3.54096 63.546000 Cu 0.531234 0.707364 0.5 163 63.546 3.65353e-05 -3.54075 63.546000 Cu 0.521199 0.724907 0 188 63.546 2.32588e-05 -3.54069 63.546000 Cu 0.591184 0.727412 0.5 190 63.546 2.02857e-05 -3.54081 63.546000 Cu 0.661165 0.729925 1.19862e-19 192 63.546 1.27605e-05 -3.54077 63.546000 Cu 0.741285 0.714924 2.39724e-19 165 63.546 6.1865e-06 -3.54064 63.546000 Cu 0.67126 0.712401 0.5 167 63.546 1.70059e-05 -3.54089 63.546000 Cu 0.731191 0.732444 0.5 194 63.546 3.99386e-06 -3.54085 63.546000 Cu 0.801203 0.73496 1.19862e-19 196 63.546 1.45404e-05 -3.54088 63.546000 Cu 0.811315 0.717438 0.5 171 63.546 3.49703e-05 -3.54042 63.546000 Cu 0.881285 0.719934 2.27737e-17 169 63.546 2.23113e-05 -3.54041 63.546000 Cu 0.961269 0.704879 0 172 63.546 8.99042e-06 -3.54059 63.546000 Cu 0.951265 0.72242 0.5 175 63.546 2.90058e-05 -3.54045 63.546000 Cu 0.871216 0.737469 0.5 198 63.546 3.52449e-05 -3.54087 63.546000 Cu 0.941169 0.739966 1.22499e-16 200 63.546 9.89926e-06 -3.54078 63.546000 Cu 0.00100655 0.760008 2.39724e-17 201 63.546 2.04409e-05 -3.54066 63.546000 Cu 0.0111104 0.742458 0.5 202 63.546 6.60712e-06 -3.54087 63.546000 Cu 0.0810957 0.74495 5.66946e-17 204 63.546 1.77224e-05 -3.54072 63.546000 Cu 0.0709563 0.762488 0.5 207 63.546 3.17643e-05 -3.5406 63.546000 Cu 0.140965 0.764984 3.71572e-17 205 63.546 2.22187e-05 -3.54073 63.546000 Cu 0.151067 0.747451 0.5 206 63.546 2.16789e-05 -3.54071 63.546000 Cu 0.210958 0.767499 0.5 208 63.546 2.3868e-05 -3.54084 63.546000 Cu 0.221092 0.749972 1.49947e-16 209 63.546 5.33404e-06 -3.5408 63.546000 Cu 0.28099 0.770031 1.22379e-16 210 63.546 6.83752e-06 -3.54094 63.546000 Cu 0.291087 0.752496 0.5 211 63.546 7.31185e-06 -3.54091 63.546000 Cu 0.361095 0.755019 4.4229e-17 212 63.546 4.72137e-05 -3.54072 63.546000 Cu 0.420962 0.775057 0 213 63.546 1.6899e-05 -3.54066 63.546000 Cu 0.431017 0.75752 0.5 214 63.546 5.52743e-05 -3.54063 63.546000 Cu 0.350979 0.772554 0.5 215 63.546 2.39067e-05 -3.5407 63.546000 Cu 0.490943 0.777545 0.5 219 63.546 7.2516e-06 -3.54056 63.546000 Cu 0.581096 0.74495 6.00508e-17 189 63.546 1.77224e-05 -3.54072 63.546000 Cu 0.51111 0.742458 0.5 191 63.546 6.60712e-06 -3.54087 63.546000 Cu 0.501007 0.760008 1.22858e-16 216 63.546 2.04409e-05 -3.54066 63.546000 Cu 0.570956 0.762488 0.5 218 63.546 3.17643e-05 -3.5406 63.546000 Cu 0.651067 0.747451 0.5 195 63.546 2.16789e-05 -3.54071 63.546000 Cu 0.640965 0.764984 2.39724e-19 220 63.546 2.22187e-05 -3.54073 63.546000 Cu 0.721092 0.749972 2.39724e-19 193 63.546 5.33404e-06 -3.5408 63.546000 Cu 0.791087 0.752496 0.5 199 63.546 7.31185e-06 -3.54091 63.546000 Cu 0.710958 0.767499 0.5 222 63.546 2.3868e-05 -3.54084 63.546000 Cu 0.78099 0.770031 3.59585e-19 224 63.546 6.83752e-06 -3.54094 63.546000 Cu 0.990943 0.777545 0.5 230 63.546 7.2516e-06 -3.54056 63.546000 Cu 0.861095 0.755019 2.28936e-17 197 63.546 4.72137e-05 -3.54072 63.546000 Cu 0.931017 0.75752 0.5 203 63.546 5.52743e-05 -3.54063 63.546000 Cu 0.850979 0.772554 0.5 226 63.546 2.39067e-05 -3.5407 63.546000 Cu 0.920962 0.775057 1.19862e-19 228 63.546 1.6899e-05 -3.54066 63.546000 Cu 0.0608978 0.780026 1.19862e-19 232 63.546 2.32496e-05 -3.54047 63.546000 Cu 0.120803 0.800062 0 233 63.546 3.72963e-05 -3.54055 63.546000 Cu 0.13087 0.782519 0.5 234 63.546 4.06775e-05 -3.54057 63.546000 Cu 0.0508958 0.797572 0.5 235 63.546 3.14209e-05 -3.5405 63.546000 Cu 0.200851 0.785037 2.39724e-19 236 63.546 2.22053e-05 -3.54078 63.546000 Cu 0.19077 0.802571 0.5 237 63.546 4.18331e-05 -3.5408 63.546000 Cu 0.260813 0.805094 2.39724e-19 238 63.546 7.65732e-06 -3.54087 63.546000 Cu 0.270877 0.787571 0.5 239 63.546 2.61555e-05 -3.54087 63.546000 Cu 0.330881 0.807618 0.5 243 63.546 1.07925e-05 -3.54085 63.546000 Cu 0.340915 0.790095 0 240 63.546 4.05426e-05 -3.54078 63.546000 Cu 0.400919 0.810133 2.39724e-19 241 63.546 3.95097e-05 -3.54065 63.546000 Cu 0.410949 0.792603 0.5 242 63.546 4.4548e-05 -3.54068 63.546000 Cu 0.470898 0.812633 0.5 247 63.546 3.81019e-05 -3.54061 63.546000 Cu 0.480931 0.795089 2.39724e-19 244 63.546 1.06843e-05 -3.54057 63.546000 Cu 0.560898 0.780026 2.39724e-19 217 63.546 2.32496e-05 -3.54047 63.546000 Cu 0.63087 0.782519 0.5 223 63.546 4.06775e-05 -3.54057 63.546000 Cu 0.550896 0.797572 0.5 246 63.546 3.14209e-05 -3.5405 63.546000 Cu 0.620803 0.800062 2.26539e-17 248 63.546 3.72963e-05 -3.54055 63.546000 Cu 0.700851 0.785037 1.09793e-16 221 63.546 2.22053e-05 -3.54078 63.546000 Cu 0.770877 0.787571 0.5 227 63.546 2.61555e-05 -3.54087 63.546000 Cu 0.69077 0.802571 0.5 250 63.546 4.18331e-05 -3.5408 63.546000 Cu 0.760813 0.805094 0 252 63.546 7.65732e-06 -3.54087 63.546000 Cu 0.830881 0.807618 0.5 254 63.546 1.07925e-05 -3.54085 63.546000 Cu 0.980931 0.795089 2.39724e-19 229 63.546 1.06843e-05 -3.54057 63.546000 Cu 0.840915 0.790095 4.44687e-17 225 63.546 4.05426e-05 -3.54078 63.546000 Cu 0.910949 0.792603 0.5 231 63.546 4.4548e-05 -3.54068 63.546000 Cu 0.900919 0.810133 0 256 63.546 3.95097e-05 -3.54065 63.546000 Cu 0.970898 0.812633 0.5 258 63.546 3.81019e-05 -3.54061 63.546000 Cu 0.0408202 0.815127 3.59585e-19 260 63.546 1.00029e-05 -3.54056 63.546000 Cu 0.100643 0.835172 9.68483e-17 261 63.546 9.50472e-05 -3.54044 63.546000 Cu 0.110719 0.817619 0.5 262 63.546 2.93104e-05 -3.54054 63.546000 Cu 0.0307426 0.832697 0.5 263 63.546 4.57449e-05 -3.54075 63.546000 Cu 0.0207731 0.850272 0 288 63.546 0.000175071 -3.54093 63.546000 Cu 0.180687 0.820112 0 264 63.546 4.94762e-05 -3.54077 63.546000 Cu 0.170628 0.837645 0.5 265 63.546 8.88077e-05 -3.54048 63.546000 Cu 0.240653 0.84014 2.27737e-18 266 63.546 8.3912e-05 -3.54049 63.546000 Cu 0.25074 0.822621 0.5 267 63.546 1.76344e-05 -3.54088 63.546000 Cu 0.320838 0.825148 0 268 63.546 4.31421e-05 -3.54093 63.546000 Cu 0.310702 0.84266 0.5 271 63.546 6.32798e-05 -3.54071 63.546000 Cu 0.380757 0.845213 2.45717e-17 269 63.546 6.06903e-05 -3.54096 63.546000 Cu 0.390882 0.827678 0.5 270 63.546 0.000103852 -3.5409 63.546000 Cu 0.460822 0.830197 0 272 63.546 4.74296e-05 -3.54101 63.546000 Cu 0.450777 0.847767 0.5 275 63.546 0.00028626 -3.54121 63.546000 Cu 0.54082 0.815127 0 245 63.546 1.00029e-05 -3.54056 63.546000 Cu 0.610719 0.817619 0.5 251 63.546 2.93104e-05 -3.54054 63.546000 Cu 0.520773 0.850272 2.39724e-19 273 63.546 0.000175071 -3.54093 63.546000 Cu 0.530743 0.832697 0.5 274 63.546 4.57449e-05 -3.54075 63.546000 Cu 0.600643 0.835172 4.91433e-17 276 63.546 9.50472e-05 -3.54044 63.546000 Cu 0.680687 0.820112 0 249 63.546 4.94762e-05 -3.54077 63.546000 Cu 0.75074 0.822621 0.5 255 63.546 1.76344e-05 -3.54088 63.546000 Cu 0.670628 0.837645 0.5 278 63.546 8.88077e-05 -3.54048 63.546000 Cu 0.740653 0.84014 1.06917e-16 280 63.546 8.3912e-05 -3.54049 63.546000 Cu 0.820838 0.825148 4.36297e-17 253 63.546 4.31421e-05 -3.54093 63.546000 Cu 0.810702 0.84266 0.5 282 63.546 6.32798e-05 -3.54071 63.546000 Cu 0.960822 0.830197 0 257 63.546 4.74296e-05 -3.54101 63.546000 Cu 0.890882 0.827678 0.5 259 63.546 0.000103852 -3.5409 63.546000 Cu 0.880757 0.845213 2.39724e-19 284 63.546 6.06903e-05 -3.54096 63.546000 Cu 0.950777 0.847767 0.5 286 63.546 0.00028626 -3.54121 63.546000 Cu 0.0808571 0.870313 5.202e-17 289 63.546 0.000207109 -3.54082 63.546000 Cu 0.0906987 0.852736 0.5 290 63.546 2.69828e-05 -3.54055 63.546000 Cu 0.010853 0.867826 0.5 291 63.546 0.000492358 -3.54111 63.546000 Cu 0.000884327 0.885333 2.39724e-19 316 63.546 0.000720925 -3.54128 63.546000 Cu 0.0710052 0.887891 0.5 318 63.546 0.00112569 -3.54124 63.546000 Cu 0.160629 0.855192 1.22499e-16 292 63.546 0.000165073 -3.54043 63.546000 Cu 0.150733 0.872779 0.5 293 63.546 0.000190697 -3.54046 63.546000 Cu 0.220467 0.87524 0 294 63.546 0.000381638 -3.54 63.546000 Cu 0.230566 0.857669 0.5 295 63.546 0.000281392 -3.54016 63.546000 Cu 0.300509 0.860186 1.16386e-16 296 63.546 0.000137382 -3.54034 63.546000 Cu 0.290246 0.877714 0.5 299 63.546 0.000689969 -3.53999 63.546000 Cu 0.360273 0.880219 0 297 63.546 0.000494065 -3.54066 63.546000 Cu 0.370533 0.862733 0.5 298 63.546 0.000100151 -3.54086 63.546000 Cu 0.440675 0.865292 2.39724e-19 300 63.546 0.000297391 -3.54126 63.546000 Cu 0.430581 0.882765 0.5 303 63.546 0.000134937 -3.54121 63.546000 Cu 0.590699 0.852736 0.5 279 63.546 2.69828e-05 -3.54055 63.546000 Cu 0.500884 0.885333 4.79447e-19 301 63.546 0.000720925 -3.54128 63.546000 Cu 0.510853 0.867826 0.5 302 63.546 0.000492358 -3.54111 63.546000 Cu 0.580857 0.870313 5.99309e-19 304 63.546 0.000207109 -3.54082 63.546000 Cu 0.571005 0.887891 0.5 307 63.546 0.00112569 -3.54124 63.546000 Cu 0.660629 0.855192 0 277 63.546 0.000165073 -3.54043 63.546000 Cu 0.650733 0.872779 0.5 306 63.546 0.000190697 -3.54046 63.546000 Cu 0.800509 0.860186 1.22858e-16 281 63.546 0.000137382 -3.54034 63.546000 Cu 0.730566 0.857669 0.5 283 63.546 0.000281392 -3.54016 63.546000 Cu 0.720467 0.87524 5.90919e-17 308 63.546 0.000381638 -3.54 63.546000 Cu 0.790246 0.877714 0.5 310 63.546 0.000689969 -3.53999 63.546000 Cu 0.940675 0.865292 1.41437e-17 285 63.546 0.000297391 -3.54126 63.546000 Cu 0.870533 0.862733 0.5 287 63.546 0.000100151 -3.54086 63.546000 Cu 0.860273 0.880219 2.39724e-19 312 63.546 0.000494065 -3.54066 63.546000 Cu 0.930581 0.882765 0.5 314 63.546 0.000134937 -3.54121 63.546000 Cu 0.0609555 0.905437 9.58895e-18 317 63.546 0.00214048 -3.54117 63.546000 Cu 0.130911 0.908065 0.5 323 63.546 0.00252648 -3.54141 63.546000 Cu 0.0504611 0.922897 0.5 346 63.546 0.0015705 -3.54073 63.546000 Cu 0.12071 0.925649 9.93654e-17 348 63.546 0.00637682 -3.54294 63.546000 Cu 0.140816 0.890413 7.49136e-17 320 63.546 0.000433312 -3.54067 63.546000 Cu 0.200614 0.910565 3.59585e-19 321 63.546 0.001295 -3.54122 63.546000 Cu 0.21042 0.892878 0.5 322 63.546 0.000314145 -3.54013 63.546000 Cu 0.280108 0.895288 3.59585e-19 324 63.546 0.00119604 -3.53997 63.546000 Cu 0.270253 0.91292 0.5 327 63.546 0.00128885 -3.54036 63.546000 Cu 0.34003 0.915218 2.39724e-19 325 63.546 0.00345263 -3.5395 63.546000 Cu 0.350053 0.897701 0.5 326 63.546 0.00163407 -3.54031 63.546000 Cu 0.420342 0.90019 3.59585e-19 328 63.546 0.000577375 -3.54052 63.546000 Cu 0.410063 0.917598 0.5 331 63.546 0.00414764 -3.53894 63.546000 Cu 0.480236 0.920161 4.79447e-19 329 63.546 0.00233519 -3.53905 63.546000 Cu 0.490712 0.902778 0.5 330 63.546 0.000668195 -3.54066 63.546000 Cu 0.560955 0.905437 4.79447e-19 332 63.546 0.00214048 -3.54117 63.546000 Cu 0.62071 0.925649 0 333 63.546 0.00637682 -3.54294 63.546000 Cu 0.630911 0.908065 0.5 334 63.546 0.00252648 -3.54141 63.546000 Cu 0.550461 0.922897 0.5 335 63.546 0.0015705 -3.54073 63.546000 Cu 0.640816 0.890413 0 305 63.546 0.000433312 -3.54067 63.546000 Cu 0.780108 0.895288 2.39724e-19 309 63.546 0.00119604 -3.53997 63.546000 Cu 0.71042 0.892878 0.5 311 63.546 0.000314145 -3.54013 63.546000 Cu 0.700614 0.910565 1.22619e-16 336 63.546 0.001295 -3.54122 63.546000 Cu 0.770253 0.91292 0.5 338 63.546 0.00128885 -3.54036 63.546000 Cu 0.990712 0.902778 0.5 319 63.546 0.000668195 -3.54066 63.546000 Cu 0.980236 0.920161 3.59585e-19 344 63.546 0.00233519 -3.53905 63.546000 Cu 0.920342 0.90019 3.59585e-19 313 63.546 0.000577375 -3.54052 63.546000 Cu 0.850053 0.897701 0.5 315 63.546 0.00163407 -3.54031 63.546000 Cu 0.84003 0.915218 1.19862e-19 340 63.546 0.00345263 -3.5395 63.546000 Cu 0.910063 0.917598 0.5 342 63.546 0.00414764 -3.53894 63.546000 Cu 0.0391597 0.940281 1.19862e-19 345 63.546 0.00457405 -3.53965 63.546000 Cu 0.109988 0.943042 0.5 351 63.546 0.012762 -3.54357 63.546000 Cu 0.0269944 0.957624 0.5 374 63.546 0.0420077 -3.5384 63.546000 Cu 0.0986738 0.960072 8.39033e-19 376 63.546 0.024177 -3.53777 63.546000 Cu 0.181475 0.945735 5.59755e-17 349 63.546 0.0212284 -3.54526 63.546000 Cu 0.190972 0.928245 0.5 350 63.546 0.0083034 -3.54383 63.546000 Cu 0.261002 0.930618 2.39724e-19 352 63.546 0.00287281 -3.54192 63.546000 Cu 0.25254 0.9483 0.5 355 63.546 0.0203321 -3.54336 63.546000 Cu 0.172042 0.962795 0.5 378 63.546 0.0271257 -3.53829 63.546000 Cu 0.322088 0.950634 1.57019e-17 353 63.546 0.0171833 -3.53519 63.546000 Cu 0.330603 0.932837 0.5 354 63.546 0.00424738 -3.5385 63.546000 Cu 0.39995 0.935099 1.19862e-19 356 63.546 0.0139222 -3.53519 63.546000 Cu 0.457739 0.955199 2.39724e-19 357 63.546 0.0399585 -3.52753 63.546000 Cu 0.469321 0.937576 0.5 358 63.546 0.0114087 -3.53558 63.546000 Cu 0.390187 0.952895 0.5 359 63.546 0.0319319 -3.52579 63.546000 Cu 0.53916 0.940281 5.99309e-19 360 63.546 0.00457405 -3.53965 63.546000 Cu 0.598674 0.960072 0 361 63.546 0.024177 -3.53777 63.546000 Cu 0.609988 0.943042 0.5 362 63.546 0.012762 -3.54357 63.546000 Cu 0.526994 0.957624 0.5 363 63.546 0.0420077 -3.5384 63.546000 Cu 0.761002 0.930618 9.22936e-18 337 63.546 0.00287281 -3.54192 63.546000 Cu 0.690972 0.928245 0.5 339 63.546 0.0083034 -3.54383 63.546000 Cu 0.681475 0.945735 3.17634e-17 364 63.546 0.0212284 -3.54526 63.546000 Cu 0.75254 0.9483 0.5 366 63.546 0.0203321 -3.54336 63.546000 Cu 0.672042 0.962795 0.5 367 63.546 0.0271257 -3.53829 63.546000 Cu 0.830603 0.932837 0.5 343 63.546 0.00424738 -3.5385 63.546000 Cu 0.822088 0.950634 3.59585e-19 368 63.546 0.0171833 -3.53519 63.546000 Cu 0.89995 0.935099 3.59585e-19 341 63.546 0.0139222 -3.53519 63.546000 Cu 0.969321 0.937576 0.5 347 63.546 0.0114087 -3.53558 63.546000 Cu 0.890187 0.952895 0.5 370 63.546 0.0319319 -3.52579 63.546000 Cu 0.957739 0.955199 3.59585e-19 372 63.546 0.0399585 -3.52753 63.546000 Cu 0.15391 0.995238 0.5 409 63.546 4.40772 -3.43721 63.546000 Cu 0.0147696 0.974878 2.39724e-19 373 63.546 0.160366 -3.52381 63.546000 Cu 0.0880746 0.976772 0.5 379 63.546 0.0633203 -3.52932 63.546000 Cu 0.00613557 0.992436 0.5 398 63.546 0.172534 -3.53064 63.546000 Cu 0.0771622 0.992978 2.39724e-19 399 63.546 0.384651 -3.49492 63.546000 Cu 0.161771 0.979205 6.11295e-17 377 63.546 0.0391547 -3.51423 63.546000 Cu 0.225001 0.998689 4.09927e-17 408 63.546 9.29409 -3.28966 63.546000 Cu 0.244531 0.965772 1.22499e-16 380 63.546 0.087082 -3.53714 63.546000 Cu 0.306042 0.987286 6.30473e-17 381 63.546 1.02117 -3.40612 63.546000 Cu 0.236664 0.982667 0.5 383 63.546 0.954407 -3.44518 63.546000 Cu 0.314548 0.968706 0.5 382 63.546 0.152467 -3.51047 63.546000 Cu 0.380323 0.97131 0 384 63.546 0.0559398 -3.50009 63.546000 Cu 0.436021 0.991895 1.79793e-18 385 63.546 0.217382 -3.52891 63.546000 Cu 0.44577 0.973451 0.5 386 63.546 0.116245 -3.5233 63.546000 Cu 0.368407 0.991021 0.5 387 63.546 0.451424 -3.46603 63.546000 Cu 0.65391 0.995238 0.5 436 63.546 4.40772 -3.43721 63.546000 Cu 0.51477 0.974878 0 388 63.546 0.160366 -3.52381 63.546000 Cu 0.577162 0.992978 1.22619e-16 389 63.546 0.384651 -3.49492 63.546000 Cu 0.588075 0.976772 0.5 390 63.546 0.0633203 -3.52932 63.546000 Cu 0.506136 0.992436 0.5 391 63.546 0.172534 -3.53064 63.546000 Cu 0.661771 0.979205 0 392 63.546 0.0391547 -3.51423 63.546000 Cu 0.725001 0.998689 1.22619e-16 401 63.546 9.29409 -3.28966 63.546000 Cu 0.744531 0.965772 8.03074e-18 365 63.546 0.087082 -3.53714 63.546000 Cu 0.736664 0.982667 0.5 393 63.546 0.954407 -3.44518 63.546000 Cu 0.806042 0.987286 5.40577e-17 395 63.546 1.02117 -3.40612 63.546000 Cu 0.814548 0.968706 0.5 371 63.546 0.152467 -3.51047 63.546000 Cu 0.880323 0.97131 4.60269e-17 369 63.546 0.0559398 -3.50009 63.546000 Cu 0.94577 0.973451 0.5 375 63.546 0.116245 -3.5233 63.546000 Cu 0.868407 0.991021 0.5 396 63.546 0.451424 -3.46603 63.546000 Cu 0.936021 0.991895 2.39724e-19 397 63.546 0.217382 -3.52891