Number of particles = 848 A = 1 Angstrom (basic length-scale) H0(1,1) = 26.2921 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 105.87 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.6144 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 0.0723312 0.0164569 9.90944e-17 426 63.546 7.89936 -3.23089 63.546000 Cu 0.00260845 0.0164571 0.5 427 63.546 3.78468 -3.52091 63.546000 Cu 0.0885173 0.00220797 0.5 429 63.546 2.88897 -3.46683 63.546000 Cu 0.0152122 0.0340434 6.81827e-17 430 63.546 0.794082 -3.47934 63.546000 Cu 0.0876934 0.0307455 0.5 432 63.546 2.80311 -3.46453 63.546000 Cu 0.155722 0.0274055 1.33291e-16 434 63.546 9.1699 -3.28544 63.546000 Cu 0.156359 0.00556654 1.25492e-16 428 63.546 9.2142 -3.28745 63.546000 Cu 0.239149 0.0368172 6.64429e-17 435 63.546 0.498613 -3.45721 63.546000 Cu 0.213913 0.016529 0.5 436 63.546 9.06175 -3.55969 63.546000 Cu 0.282576 0.0165072 3.7496e-19 438 63.546 9.76366 -3.30852 63.546000 Cu 0.30355 0.0313124 0.5 441 63.546 2.35662 -3.46665 63.546000 Cu 0.304651 0.00176168 0.5 440 63.546 2.484 -3.46858 63.546000 Cu 0.369474 0.0275765 7.06874e-17 439 63.546 8.8869 -3.29876 63.546000 Cu 0.370732 0.00555241 1.74281e-17 442 63.546 8.95333 -3.30049 63.546000 Cu 0.4316 0.0166872 0.5 445 63.546 8.41341 -3.49368 63.546000 Cu 0.502608 0.0164571 4.34953e-19 443 63.546 3.78468 -3.52091 63.546000 Cu 0.588517 0.00220797 5.99936e-19 446 63.546 2.88897 -3.46683 63.546000 Cu 0.572331 0.0164569 0.5 447 63.546 7.89936 -3.23089 63.546000 Cu 0.515212 0.0340434 0.5 465 63.546 0.794082 -3.47934 63.546000 Cu 0.587693 0.0307455 1 467 63.546 2.80311 -3.46453 63.546000 Cu 0.655722 0.0274055 0.5 469 63.546 9.1699 -3.28544 63.546000 Cu 0.656359 0.00556654 0.5 448 63.546 9.2142 -3.28745 63.546000 Cu 0.713913 0.016529 1.44434e-17 471 63.546 9.06175 -3.55969 63.546000 Cu 0.80355 0.0313124 9.74895e-17 472 63.546 2.35662 -3.46665 63.546000 Cu 0.782576 0.0165072 0.5 473 63.546 9.76366 -3.30852 63.546000 Cu 0.739149 0.0368172 0.5 474 63.546 0.498613 -3.45721 63.546000 Cu 0.804651 0.00176168 3.44963e-19 475 63.546 2.484 -3.46858 63.546000 Cu 0.9316 0.0166872 7.49919e-20 476 63.546 8.41341 -3.49368 63.546000 Cu 0.870732 0.00555241 0.5 477 63.546 8.95333 -3.30049 63.546000 Cu 0.869474 0.0275765 0.5 478 63.546 8.8869 -3.29876 63.546000 Cu 0.102368 0.0466872 1.04449e-16 431 63.546 0.158231 -3.5315 63.546000 Cu 0.0360214 0.0506847 0.5 433 63.546 0.089975 -3.53447 63.546000 Cu 0.055899 0.0673399 4.70499e-17 451 63.546 0.0151421 -3.53389 63.546000 Cu 0.122389 0.0625518 0.5 453 63.546 0.0252838 -3.54509 63.546000 Cu 0.173576 0.0420866 0.5 437 63.546 0.460208 -3.46774 63.546000 Cu 0.189815 0.0578714 0 455 63.546 0.0158833 -3.54326 63.546000 Cu 0.275104 0.0693493 1.98129e-17 456 63.546 0.00268918 -3.53903 63.546000 Cu 0.257715 0.0530986 0.5 457 63.546 0.0299767 -3.5234 63.546000 Cu 0.208282 0.0740346 0.5 458 63.546 0.00510347 -3.54313 63.546000 Cu 0.323026 0.0482014 0 459 63.546 0.0210604 -3.52701 63.546000 Cu 0.407549 0.0595004 4.36753e-17 460 63.546 0.035584 -3.54053 63.546000 Cu 0.389782 0.0428818 0.5 461 63.546 0.344429 -3.48714 63.546000 Cu 0.342087 0.0644567 0.5 462 63.546 0.0138332 -3.53861 63.546000 Cu 0.453273 0.037373 4.14405e-17 463 63.546 0.475684 -3.45277 63.546000 Cu 0.471773 0.0551686 0.5 466 63.546 0.0362421 -3.51622 63.546000 Cu 0.490622 0.0718819 3.6896e-17 494 63.546 0.00982521 -3.53368 63.546000 Cu 0.536021 0.0506847 8.16812e-17 464 63.546 0.089975 -3.53447 63.546000 Cu 0.602368 0.0466872 0.5 470 63.546 0.158231 -3.5315 63.546000 Cu 0.555899 0.0673399 0.5 496 63.546 0.0151421 -3.53389 63.546000 Cu 0.622389 0.0625518 5.69939e-19 498 63.546 0.0252838 -3.54509 63.546000 Cu 0.673576 0.0420866 0 468 63.546 0.460208 -3.46774 63.546000 Cu 0.708282 0.0740346 0 499 63.546 0.00510347 -3.54313 63.546000 Cu 0.689815 0.0578714 0.5 500 63.546 0.0158833 -3.54326 63.546000 Cu 0.757715 0.0530986 2.71621e-17 502 63.546 0.0299767 -3.5234 63.546000 Cu 0.823026 0.0482014 0.5 504 63.546 0.0210604 -3.52701 63.546000 Cu 0.775104 0.0693493 0.5 505 63.546 0.00268918 -3.53903 63.546000 Cu 0.990622 0.0718819 0.5 450 63.546 0.00982521 -3.53368 63.546000 Cu 0.842087 0.0644567 1.33441e-16 503 63.546 0.0138332 -3.53861 63.546000 Cu 0.889782 0.0428818 1.45934e-16 506 63.546 0.344429 -3.48714 63.546000 Cu 0.971773 0.0551686 1.11138e-17 507 63.546 0.0362421 -3.51622 63.546000 Cu 0.953273 0.037373 0.5 508 63.546 0.475684 -3.45277 63.546000 Cu 0.907549 0.0595004 0.5 509 63.546 0.035584 -3.54053 63.546000 Cu 0.0095479 0.0883781 5.72638e-17 449 63.546 0.00434599 -3.5373 63.546000 Cu 0.141691 0.0788244 2.84969e-19 452 63.546 0.00202349 -3.54172 63.546000 Cu 0.075569 0.0836412 0.5 454 63.546 0.00139285 -3.53858 63.546000 Cu 0.0283886 0.104721 0.5 480 63.546 0.000549442 -3.53931 63.546000 Cu 0.0946361 0.0999744 8.45459e-17 482 63.546 0.000384503 -3.5397 63.546000 Cu 0.160813 0.0951773 0.5 484 63.546 0.000505022 -3.54009 63.546000 Cu 0.226971 0.0904056 4.25054e-17 486 63.546 0.00111615 -3.54084 63.546000 Cu 0.311727 0.102115 6.14934e-19 487 63.546 0.000898231 -3.54148 63.546000 Cu 0.293388 0.0856433 0.5 488 63.546 0.0025328 -3.54208 63.546000 Cu 0.245679 0.106839 0.5 489 63.546 0.000312552 -3.5406 63.546000 Cu 0.359725 0.080925 4.85348e-17 490 63.546 0.00488535 -3.54191 63.546000 Cu 0.443627 0.0929507 5.25993e-17 491 63.546 0.0019579 -3.53801 63.546000 Cu 0.42541 0.0763804 0.5 492 63.546 0.00459985 -3.53733 63.546000 Cu 0.377685 0.0974904 0.5 493 63.546 0.000734648 -3.54018 63.546000 Cu 0.462157 0.109387 0.5 524 63.546 0.00108755 -3.53908 63.546000 Cu 0.575569 0.0836412 2.99968e-19 495 63.546 0.00139285 -3.53858 63.546000 Cu 0.509548 0.0883781 0.5 497 63.546 0.00434599 -3.5373 63.546000 Cu 0.641691 0.0788244 0.5 501 63.546 0.00202349 -3.54172 63.546000 Cu 0.528389 0.104721 1.93629e-16 526 63.546 0.000549442 -3.53931 63.546000 Cu 0.594636 0.0999744 0.5 528 63.546 0.000384503 -3.5397 63.546000 Cu 0.660813 0.0951773 9.61397e-18 530 63.546 0.000505022 -3.54009 63.546000 Cu 0.745679 0.106839 2.39974e-19 531 63.546 0.000312552 -3.5406 63.546000 Cu 0.726971 0.0904056 0.5 532 63.546 0.00111615 -3.54084 63.546000 Cu 0.793388 0.0856433 1.93329e-17 534 63.546 0.0025328 -3.54208 63.546000 Cu 0.811727 0.102115 0.5 537 63.546 0.000898231 -3.54148 63.546000 Cu 0.877685 0.0974904 5.24944e-19 535 63.546 0.000734648 -3.54018 63.546000 Cu 0.859725 0.080925 0.5 536 63.546 0.00488535 -3.54191 63.546000 Cu 0.92541 0.0763804 3.05217e-17 538 63.546 0.00459985 -3.53733 63.546000 Cu 0.943627 0.0929507 0.5 539 63.546 0.0019579 -3.53801 63.546000 Cu 0.962157 0.109387 4.46502e-17 569 63.546 0.00108755 -3.53908 63.546000 Cu 0.0471558 0.121064 3.7496e-19 479 63.546 7.26099e-05 -3.54004 63.546000 Cu 0.11339 0.116324 0.5 485 63.546 0.000203026 -3.53997 63.546000 Cu 0.0659232 0.137444 0.5 512 63.546 7.98538e-05 -3.54018 63.546000 Cu 0.132042 0.132725 5.84937e-19 514 63.546 9.90603e-05 -3.54024 63.546000 Cu 0.179599 0.111581 3.46913e-17 483 63.546 0.00035888 -3.53991 63.546000 Cu 0.216818 0.144449 1.03354e-16 515 63.546 6.74294e-05 -3.54022 63.546000 Cu 0.198156 0.128013 0.5 516 63.546 6.68544e-05 -3.54013 63.546000 Cu 0.264254 0.123301 0 518 63.546 0.000114318 -3.54017 63.546000 Cu 0.330253 0.118623 0.5 520 63.546 0.000150958 -3.53994 63.546000 Cu 0.282884 0.139752 0.5 521 63.546 8.24545e-05 -3.53998 63.546000 Cu 0.348894 0.135089 4.94947e-19 519 63.546 6.80111e-05 -3.53951 63.546000 Cu 0.396169 0.113997 5.51341e-17 522 63.546 0.000420394 -3.53928 63.546000 Cu 0.480963 0.125778 4.93747e-17 523 63.546 0.000266125 -3.53972 63.546000 Cu 0.414905 0.130446 0.5 525 63.546 0.000244994 -3.5393 63.546000 Cu 0.433699 0.146854 7.36121e-17 553 63.546 6.52806e-05 -3.53958 63.546000 Cu 0.499811 0.142161 0.5 555 63.546 3.61116e-05 -3.53981 63.546000 Cu 0.61339 0.116324 7.52019e-17 527 63.546 0.000203026 -3.53997 63.546000 Cu 0.547156 0.121064 0.5 529 63.546 7.26099e-05 -3.54004 63.546000 Cu 0.565923 0.137444 4.60451e-17 557 63.546 7.98538e-05 -3.54018 63.546000 Cu 0.632042 0.132725 0.5 559 63.546 9.90603e-05 -3.54024 63.546000 Cu 0.679599 0.111581 0.5 533 63.546 0.00035888 -3.53991 63.546000 Cu 0.698156 0.128013 1.44689e-16 561 63.546 6.68544e-05 -3.54013 63.546000 Cu 0.782884 0.139752 7.26822e-17 562 63.546 8.24545e-05 -3.53998 63.546000 Cu 0.764254 0.123301 0.5 563 63.546 0.000114318 -3.54017 63.546000 Cu 0.716818 0.144449 0.5 564 63.546 6.74294e-05 -3.54022 63.546000 Cu 0.830253 0.118623 1.17392e-16 565 63.546 0.000150958 -3.53994 63.546000 Cu 0.999811 0.142161 2.84969e-19 510 63.546 3.61116e-05 -3.53981 63.546000 Cu 0.980963 0.125778 0.5 481 63.546 0.000266125 -3.53972 63.546000 Cu 0.914905 0.130446 4.19955e-19 566 63.546 0.000244994 -3.5393 63.546000 Cu 0.896169 0.113997 0.5 567 63.546 0.000420394 -3.53928 63.546000 Cu 0.848894 0.135089 0.5 568 63.546 6.80111e-05 -3.53951 63.546000 Cu 0.933699 0.146854 0.5 598 63.546 6.52806e-05 -3.53958 63.546000 Cu 0.0846602 0.153861 3.44963e-19 511 63.546 4.5195e-05 -3.54022 63.546000 Cu 0.0185892 0.158563 0.5 513 63.546 4.75476e-05 -3.5401 63.546000 Cu 0.150751 0.149156 0.5 517 63.546 3.71465e-05 -3.54026 63.546000 Cu 0.0374455 0.174991 9.15652e-17 541 63.546 2.54292e-05 -3.54017 63.546000 Cu 0.103492 0.170288 0.5 543 63.546 3.55603e-05 -3.54015 63.546000 Cu 0.169563 0.165588 0 545 63.546 1.99374e-05 -3.54012 63.546000 Cu 0.254456 0.177323 0 546 63.546 2.40744e-05 -3.53987 63.546000 Cu 0.235624 0.160888 0.5 547 63.546 2.12121e-05 -3.54009 63.546000 Cu 0.188444 0.182014 0.5 548 63.546 1.62161e-05 -3.53991 63.546000 Cu 0.301642 0.156204 4.15455e-17 549 63.546 2.34682e-05 -3.53989 63.546000 Cu 0.320486 0.172641 0.5 552 63.546 5.41396e-06 -3.53983 63.546000 Cu 0.386508 0.167958 8.76656e-17 550 63.546 1.5564e-05 -3.53988 63.546000 Cu 0.367648 0.151534 0.5 551 63.546 7.68098e-05 -3.53961 63.546000 Cu 0.452537 0.163266 0.5 556 63.546 3.10298e-05 -3.54005 63.546000 Cu 0.405383 0.184396 0.5 582 63.546 2.06225e-05 -3.5402 63.546000 Cu 0.471419 0.179696 6.85426e-18 584 63.546 1.14648e-05 -3.54025 63.546000 Cu 0.518589 0.158563 1.19987e-19 554 63.546 4.75476e-05 -3.5401 63.546000 Cu 0.650751 0.149156 5.26443e-17 558 63.546 3.71465e-05 -3.54026 63.546000 Cu 0.58466 0.153861 0.5 560 63.546 4.5195e-05 -3.54022 63.546000 Cu 0.537446 0.174991 0.5 586 63.546 2.54292e-05 -3.54017 63.546000 Cu 0.603492 0.170288 5.99936e-20 588 63.546 3.55603e-05 -3.54015 63.546000 Cu 0.688444 0.182014 1.27816e-16 589 63.546 1.62161e-05 -3.53991 63.546000 Cu 0.669563 0.165588 0.5 590 63.546 1.99374e-05 -3.54012 63.546000 Cu 0.735624 0.160888 4.52951e-17 592 63.546 2.12121e-05 -3.54009 63.546000 Cu 0.820486 0.172641 2.24976e-19 593 63.546 5.41396e-06 -3.53983 63.546000 Cu 0.801642 0.156204 0.5 594 63.546 2.34682e-05 -3.53989 63.546000 Cu 0.754456 0.177323 0.5 595 63.546 2.40744e-05 -3.53987 63.546000 Cu 0.867648 0.151534 1.79081e-17 596 63.546 7.68098e-05 -3.53961 63.546000 Cu 0.952537 0.163266 7.18273e-17 597 63.546 3.10298e-05 -3.54005 63.546000 Cu 0.886508 0.167958 0.5 599 63.546 1.5564e-05 -3.53988 63.546000 Cu 0.905383 0.184396 4.49952e-19 628 63.546 2.06225e-05 -3.5402 63.546000 Cu 0.971419 0.179696 0.5 629 63.546 1.14648e-05 -3.54025 63.546000 Cu 0.122426 0.186715 1.74656e-16 542 63.546 2.76218e-06 -3.53997 63.546000 Cu 0.0563937 0.191416 0.5 544 63.546 1.32044e-06 -3.53999 63.546000 Cu 0.00929133 0.212543 0.5 571 63.546 8.07602e-06 -3.53993 63.546000 Cu 0.0753256 0.207841 0 572 63.546 5.71278e-06 -3.53999 63.546000 Cu 0.160272 0.219576 2.15527e-17 573 63.546 1.28801e-05 -3.54013 63.546000 Cu 0.141364 0.20314 0.5 574 63.546 1.39332e-05 -3.53999 63.546000 Cu 0.207366 0.198444 1.19987e-19 576 63.546 1.46695e-05 -3.53993 63.546000 Cu 0.292272 0.210204 4.38853e-17 577 63.546 2.71828e-06 -3.54005 63.546000 Cu 0.27337 0.193757 0.5 578 63.546 1.39969e-05 -3.53997 63.546000 Cu 0.226285 0.214884 0.5 579 63.546 1.89465e-05 -3.54006 63.546000 Cu 0.339369 0.18908 7.01925e-17 580 63.546 4.43273e-06 -3.54003 63.546000 Cu 0.424293 0.200828 0 581 63.546 2.70161e-05 -3.5401 63.546000 Cu 0.358269 0.205521 0.5 583 63.546 2.34704e-05 -3.54006 63.546000 Cu 0.490347 0.196122 0.5 587 63.546 2.42856e-06 -3.54008 63.546000 Cu 0.377184 0.221953 3.89958e-19 612 63.546 2.51889e-05 -3.53996 63.546000 Cu 0.443233 0.217249 0.5 614 63.546 1.19368e-06 -3.53995 63.546000 Cu 0.556394 0.191416 5.14745e-17 585 63.546 1.32044e-06 -3.53999 63.546000 Cu 0.622426 0.186715 0.5 591 63.546 2.76218e-06 -3.53997 63.546000 Cu 0.509291 0.212543 6.08635e-17 616 63.546 8.07602e-06 -3.53993 63.546000 Cu 0.575326 0.207841 0.5 618 63.546 5.71278e-06 -3.53999 63.546000 Cu 0.641364 0.20314 2.39974e-19 620 63.546 1.39332e-05 -3.53999 63.546000 Cu 0.660272 0.219576 0.5 623 63.546 1.28801e-05 -3.54013 63.546000 Cu 0.726285 0.214884 0 621 63.546 1.89465e-05 -3.54006 63.546000 Cu 0.707366 0.198444 0.5 622 63.546 1.46695e-05 -3.53993 63.546000 Cu 0.77337 0.193757 2.29025e-17 624 63.546 1.39969e-05 -3.53997 63.546000 Cu 0.792272 0.210204 0.5 627 63.546 2.71828e-06 -3.54005 63.546000 Cu 0.990347 0.196122 4.24904e-17 540 63.546 2.42856e-06 -3.54008 63.546000 Cu 0.858269 0.205521 5.24944e-19 625 63.546 2.34704e-05 -3.54006 63.546000 Cu 0.839369 0.18908 0.5 626 63.546 4.43273e-06 -3.54003 63.546000 Cu 0.924293 0.200828 0.5 630 63.546 2.70161e-05 -3.5401 63.546000 Cu 0.877184 0.221953 0.5 657 63.546 2.51889e-05 -3.53996 63.546000 Cu 0.943233 0.217249 6.22133e-17 659 63.546 1.19368e-06 -3.53995 63.546000 Cu 0.028197 0.228967 0 570 63.546 8.32725e-06 -3.53995 63.546000 Cu 0.0942326 0.224272 0.5 575 63.546 4.72664e-06 -3.54006 63.546000 Cu 0.0471209 0.245399 0.5 602 63.546 5.89756e-06 -3.54 63.546000 Cu 0.113144 0.240706 2.38924e-17 604 63.546 7.13565e-06 -3.54007 63.546000 Cu 0.13203 0.257146 0.5 607 63.546 5.9897e-06 -3.54007 63.546000 Cu 0.19803 0.252458 8.61657e-17 605 63.546 1.28417e-05 -3.54001 63.546000 Cu 0.179148 0.236018 0.5 606 63.546 1.55604e-06 -3.54012 63.546000 Cu 0.245159 0.231333 0 608 63.546 9.6533e-06 -3.54005 63.546000 Cu 0.33009 0.243074 4.47402e-17 609 63.546 7.31539e-06 -3.53991 63.546000 Cu 0.311151 0.226648 0.5 610 63.546 4.56159e-05 -3.53995 63.546000 Cu 0.264046 0.247768 0.5 611 63.546 1.95552e-05 -3.53991 63.546000 Cu 0.462167 0.233668 1.01389e-17 613 63.546 5.31477e-06 -3.54001 63.546000 Cu 0.396128 0.238373 0.5 615 63.546 1.22057e-06 -3.54 63.546000 Cu 0.415056 0.254795 1.81181e-17 643 63.546 5.39235e-06 -3.54008 63.546000 Cu 0.481113 0.250094 0.5 645 63.546 2.12901e-05 -3.54007 63.546000 Cu 0.594233 0.224272 0 617 63.546 4.72664e-06 -3.54006 63.546000 Cu 0.528197 0.228967 0.5 619 63.546 8.32725e-06 -3.53995 63.546000 Cu 0.547121 0.245399 0 647 63.546 5.89756e-06 -3.54 63.546000 Cu 0.63203 0.257146 0 648 63.546 5.9897e-06 -3.54007 63.546000 Cu 0.613144 0.240706 0.5 649 63.546 7.13565e-06 -3.54007 63.546000 Cu 0.679148 0.236018 4.38853e-17 651 63.546 1.55604e-06 -3.54012 63.546000 Cu 0.764046 0.247768 1.19987e-19 652 63.546 1.95552e-05 -3.53991 63.546000 Cu 0.745159 0.231333 0.5 653 63.546 9.6533e-06 -3.54005 63.546000 Cu 0.69803 0.252458 0.5 654 63.546 1.28417e-05 -3.54001 63.546000 Cu 0.811151 0.226648 6.14934e-19 655 63.546 4.56159e-05 -3.53995 63.546000 Cu 0.83009 0.243074 0.5 658 63.546 7.31539e-06 -3.53991 63.546000 Cu 0.981113 0.250094 4.46352e-17 600 63.546 2.12901e-05 -3.54007 63.546000 Cu 0.896128 0.238373 3.44963e-19 656 63.546 1.22057e-06 -3.54 63.546000 Cu 0.962167 0.233668 0.5 660 63.546 5.31477e-06 -3.54001 63.546000 Cu 0.915056 0.254795 0.5 689 63.546 5.39235e-06 -3.54008 63.546000 Cu 0.0660316 0.261834 3.79309e-17 601 63.546 2.65546e-05 -3.54002 63.546000 Cu 0.0188112 0.282961 5.39942e-19 631 63.546 1.86934e-06 -3.54014 63.546000 Cu 0.10368 0.294701 2.54973e-19 632 63.546 1.94107e-05 -3.54007 63.546000 Cu 0.0848479 0.278272 0.5 633 63.546 1.01341e-05 -3.54008 63.546000 Cu 0.150883 0.273581 5.09945e-19 635 63.546 2.60591e-05 -3.53999 63.546000 Cu 0.235817 0.285302 0 636 63.546 8.25022e-06 -3.53999 63.546000 Cu 0.216943 0.268884 0.5 637 63.546 1.26283e-05 -3.53994 63.546000 Cu 0.169745 0.289997 0.5 638 63.546 1.55349e-06 -3.54 63.546000 Cu 0.282973 0.264188 8.99903e-20 639 63.546 2.50462e-06 -3.53989 63.546000 Cu 0.301872 0.28061 0.5 642 63.546 1.10108e-05 -3.53997 63.546000 Cu 0.367904 0.275916 3.08217e-17 640 63.546 2.77448e-06 -3.53995 63.546000 Cu 0.349016 0.259494 0.5 641 63.546 4.44105e-06 -3.53994 63.546000 Cu 0.433943 0.27122 0.5 646 63.546 6.85253e-06 -3.54 63.546000 Cu 0.386772 0.29234 0.5 673 63.546 2.86147e-05 -3.54003 63.546000 Cu 0.452807 0.287649 6.59929e-19 675 63.546 2.14573e-05 -3.5401 63.546000 Cu 0.499997 0.266523 5.84937e-19 644 63.546 2.40483e-05 -3.54004 63.546000 Cu 0.566032 0.261834 0.5 650 63.546 2.65546e-05 -3.54002 63.546000 Cu 0.518811 0.282961 0.5 677 63.546 1.86934e-06 -3.54014 63.546000 Cu 0.584848 0.278272 1.42845e-16 679 63.546 1.01341e-05 -3.54008 63.546000 Cu 0.650883 0.273581 0.5 681 63.546 2.60591e-05 -3.53999 63.546000 Cu 0.60368 0.294701 0.5 682 63.546 1.94107e-05 -3.54007 63.546000 Cu 0.669745 0.289997 5.24944e-19 680 63.546 1.55349e-06 -3.54 63.546000 Cu 0.716943 0.268884 4.04956e-19 683 63.546 1.26283e-05 -3.53994 63.546000 Cu 0.801872 0.28061 5.97536e-17 684 63.546 1.10108e-05 -3.53997 63.546000 Cu 0.782973 0.264188 0.5 685 63.546 2.50462e-06 -3.53989 63.546000 Cu 0.735817 0.285302 0.5 686 63.546 8.25022e-06 -3.53999 63.546000 Cu 0.999997 0.266523 0.5 603 63.546 2.40483e-05 -3.54004 63.546000 Cu 0.849016 0.259494 1.94979e-19 687 63.546 4.44105e-06 -3.53994 63.546000 Cu 0.933943 0.27122 0 688 63.546 6.85253e-06 -3.54 63.546000 Cu 0.867904 0.275916 0.5 690 63.546 2.77448e-06 -3.53995 63.546000 Cu 0.886772 0.29234 0 718 63.546 2.86147e-05 -3.54003 63.546000 Cu 0.952807 0.287649 0.5 720 63.546 2.14573e-05 -3.5401 63.546000 Cu 0.0376375 0.299399 0.5 634 63.546 4.32407e-05 -3.5401 63.546000 Cu 0.0564446 0.315813 2.62472e-18 663 63.546 2.74253e-05 -3.53993 63.546000 Cu 0.141298 0.327514 8.99903e-20 664 63.546 8.2522e-06 -3.53978 63.546000 Cu 0.122545 0.311112 0.5 665 63.546 4.30884e-05 -3.53994 63.546000 Cu 0.0751891 0.332215 0.5 666 63.546 2.95137e-06 -3.5399 63.546000 Cu 0.188596 0.306415 4.71399e-17 667 63.546 1.52489e-05 -3.53993 63.546000 Cu 0.27345 0.318141 1.30816e-16 668 63.546 2.76967e-05 -3.53978 63.546000 Cu 0.254645 0.301721 0.5 669 63.546 4.64721e-06 -3.53999 63.546000 Cu 0.207402 0.322824 0.5 670 63.546 4.09711e-05 -3.53965 63.546000 Cu 0.320717 0.297031 3.05517e-17 671 63.546 1.44749e-05 -3.53997 63.546000 Cu 0.405546 0.308773 1 672 63.546 1.21505e-05 -3.54001 63.546000 Cu 0.339506 0.313453 0.5 674 63.546 3.26185e-05 -3.53996 63.546000 Cu 0.4716 0.304088 0.5 678 63.546 3.13194e-05 -3.5401 63.546000 Cu 0.358208 0.329892 7.77666e-17 702 63.546 1.17023e-05 -3.54 63.546000 Cu 0.424256 0.325203 0.5 704 63.546 1.91981e-05 -3.54003 63.546000 Cu 0.490327 0.320513 5.99936e-19 706 63.546 3.47723e-05 -3.53991 63.546000 Cu 0.537637 0.299399 0 676 63.546 4.32407e-05 -3.5401 63.546000 Cu 0.575189 0.332215 4.04956e-19 707 63.546 2.95137e-06 -3.5399 63.546000 Cu 0.556445 0.315813 0.5 708 63.546 2.74253e-05 -3.53993 63.546000 Cu 0.622545 0.311112 9.40999e-17 710 63.546 4.30884e-05 -3.53994 63.546000 Cu 0.641298 0.327514 0.5 713 63.546 8.2522e-06 -3.53978 63.546000 Cu 0.707402 0.322824 2.36375e-17 711 63.546 4.09711e-05 -3.53965 63.546000 Cu 0.688596 0.306415 0.5 712 63.546 1.52489e-05 -3.53993 63.546000 Cu 0.754645 0.301721 4.37053e-17 714 63.546 4.64721e-06 -3.53999 63.546000 Cu 0.820717 0.297031 0.5 716 63.546 1.44749e-05 -3.53997 63.546000 Cu 0.77345 0.318141 0.5 717 63.546 2.76967e-05 -3.53978 63.546000 Cu 0.990327 0.320513 0.5 662 63.546 3.47723e-05 -3.53991 63.546000 Cu 0.839506 0.313453 5.09195e-17 715 63.546 3.26185e-05 -3.53996 63.546000 Cu 0.9716 0.304088 0 719 63.546 3.13194e-05 -3.5401 63.546000 Cu 0.905546 0.308773 0.5 721 63.546 1.21505e-05 -3.54001 63.546000 Cu 0.858208 0.329892 0.5 748 63.546 1.17023e-05 -3.54 63.546000 Cu 0.924256 0.325203 1.28986e-17 750 63.546 1.91981e-05 -3.54003 63.546000 Cu 0.00908261 0.336919 6.12384e-17 661 63.546 1.21132e-05 -3.54003 63.546000 Cu 0.0466266 0.369712 2.24976e-19 691 63.546 4.46687e-05 -3.53982 63.546000 Cu 0.0278495 0.353326 0.5 692 63.546 1.36363e-05 -3.54002 63.546000 Cu 0.0939609 0.348611 0 694 63.546 1.62181e-05 -3.53995 63.546000 Cu 0.160048 0.343914 0.5 696 63.546 6.67414e-05 -3.53979 63.546000 Cu 0.11273 0.365011 0.5 697 63.546 0.000116046 -3.53978 63.546000 Cu 0.178818 0.36033 2.24976e-19 695 63.546 0.000188432 -3.5398 63.546000 Cu 0.226117 0.339235 2.69971e-19 698 63.546 6.23495e-05 -3.53983 63.546000 Cu 0.310843 0.351008 1.19987e-19 699 63.546 1.29709e-05 -3.54019 63.546000 Cu 0.292181 0.334564 0.5 700 63.546 3.01794e-05 -3.53991 63.546000 Cu 0.244798 0.355676 0.5 701 63.546 1.5198e-05 -3.53999 63.546000 Cu 0.329504 0.367452 0.5 732 63.546 9.54362e-05 -3.54003 63.546000 Cu 0.442985 0.34163 7.49919e-20 703 63.546 4.23404e-05 -3.54013 63.546000 Cu 0.376889 0.346327 0.5 705 63.546 5.32327e-05 -3.5401 63.546000 Cu 0.395604 0.362754 1.18982e-16 734 63.546 9.02618e-05 -3.54026 63.546000 Cu 0.461718 0.358038 0.5 736 63.546 3.31942e-05 -3.54018 63.546000 Cu 0.509083 0.336919 0.5 709 63.546 1.21132e-05 -3.54003 63.546000 Cu 0.52785 0.353326 9.11152e-17 738 63.546 1.36363e-05 -3.54002 63.546000 Cu 0.61273 0.365011 0 739 63.546 0.000116046 -3.53978 63.546000 Cu 0.593961 0.348611 0.5 740 63.546 1.62181e-05 -3.53995 63.546000 Cu 0.546627 0.369712 0.5 741 63.546 4.46687e-05 -3.53982 63.546000 Cu 0.660048 0.343914 3.29965e-19 742 63.546 6.67414e-05 -3.53979 63.546000 Cu 0.744798 0.355676 7.02075e-17 743 63.546 1.5198e-05 -3.53999 63.546000 Cu 0.726117 0.339235 0.5 744 63.546 6.23495e-05 -3.53983 63.546000 Cu 0.678818 0.36033 0.5 745 63.546 0.000188432 -3.5398 63.546000 Cu 0.792181 0.334564 8.99903e-20 746 63.546 3.01794e-05 -3.53991 63.546000 Cu 0.810843 0.351008 0.5 749 63.546 1.29709e-05 -3.54019 63.546000 Cu 0.829504 0.367452 1.08288e-17 777 63.546 9.54362e-05 -3.54003 63.546000 Cu 0.876889 0.346327 0 747 63.546 5.32327e-05 -3.5401 63.546000 Cu 0.942985 0.34163 0.5 751 63.546 4.23404e-05 -3.54013 63.546000 Cu 0.895604 0.362754 0.5 779 63.546 9.02618e-05 -3.54026 63.546000 Cu 0.961718 0.358038 0 781 63.546 3.31942e-05 -3.54018 63.546000 Cu 0.0840925 0.402503 1.26946e-16 723 63.546 0.000549097 -3.53947 63.546000 Cu 0.0653742 0.386102 0.5 724 63.546 0.000191411 -3.53965 63.546000 Cu 0.131443 0.381423 1.4229e-16 726 63.546 0.000260646 -3.53944 63.546000 Cu 0.150102 0.397874 0.5 729 63.546 0.000246434 -3.53953 63.546000 Cu 0.0179934 0.407161 0.5 725 63.546 0.000504567 -3.53959 63.546000 Cu 0.216004 0.393243 1.19987e-19 727 63.546 7.82553e-05 -3.53982 63.546000 Cu 0.197418 0.376778 0.5 728 63.546 4.18899e-05 -3.53964 63.546000 Cu 0.263465 0.372119 9.95293e-17 730 63.546 4.80911e-05 -3.53995 63.546000 Cu 0.281998 0.388578 0.5 733 63.546 0.000135362 -3.54026 63.546000 Cu 0.300533 0.405029 2.30075e-17 761 63.546 0.000554572 -3.54023 63.546000 Cu 0.348084 0.383881 9.25251e-17 731 63.546 0.000194171 -3.54017 63.546000 Cu 0.480449 0.374434 0 735 63.546 3.05069e-05 -3.54017 63.546000 Cu 0.41424 0.379167 0.5 737 63.546 0.000165244 -3.54018 63.546000 Cu 0.366696 0.400296 0.5 763 63.546 0.000426344 -3.54032 63.546000 Cu 0.432945 0.395534 3.59961e-19 765 63.546 8.81622e-05 -3.54024 63.546000 Cu 0.499209 0.390807 0.5 767 63.546 7.6828e-05 -3.53983 63.546000 Cu 0.565374 0.386102 1.14528e-16 769 63.546 0.000191411 -3.53965 63.546000 Cu 0.650102 0.397874 2.09977e-19 770 63.546 0.000246434 -3.53953 63.546000 Cu 0.631443 0.381423 0.5 771 63.546 0.000260646 -3.53944 63.546000 Cu 0.584092 0.402503 0.5 772 63.546 0.000549097 -3.53947 63.546000 Cu 0.517993 0.407161 6.98925e-17 766 63.546 0.000504567 -3.53959 63.546000 Cu 0.697418 0.376778 7.74367e-17 773 63.546 4.18899e-05 -3.53964 63.546000 Cu 0.781998 0.388578 6.16584e-17 774 63.546 0.000135362 -3.54026 63.546000 Cu 0.763465 0.372119 0.5 775 63.546 4.80911e-05 -3.53995 63.546000 Cu 0.716004 0.393243 0.5 776 63.546 7.82553e-05 -3.53982 63.546000 Cu 0.800533 0.405029 0.5 806 63.546 0.000554572 -3.54023 63.546000 Cu 0.999209 0.390807 4.40803e-17 722 63.546 7.6828e-05 -3.53983 63.546000 Cu 0.980449 0.374434 0.5 693 63.546 3.05069e-05 -3.54017 63.546000 Cu 0.91424 0.379167 0 778 63.546 0.000165244 -3.54018 63.546000 Cu 0.848084 0.383881 0.5 780 63.546 0.000194171 -3.54017 63.546000 Cu 0.866696 0.400296 0 808 63.546 0.000426344 -3.54032 63.546000 Cu 0.932945 0.395534 0.5 810 63.546 8.81622e-05 -3.54024 63.546000 Cu 0.0367283 0.423543 1.00744e-16 753 63.546 0.00141353 -3.53898 63.546000 Cu 0.121129 0.435483 2.35325e-17 754 63.546 0.000508406 -3.54001 63.546000 Cu 0.102745 0.418953 0.5 755 63.546 0.000746142 -3.53941 63.546000 Cu 0.0553117 0.439983 0.5 756 63.546 0.00279417 -3.53776 63.546000 Cu 0.168639 0.414377 7.49919e-20 757 63.546 0.000201793 -3.53999 63.546000 Cu 0.253069 0.426206 1.49984e-19 758 63.546 0.00115917 -3.54046 63.546000 Cu 0.234543 0.409735 0.5 759 63.546 0.000437921 -3.54026 63.546000 Cu 0.187038 0.430908 0.5 760 63.546 0.00149204 -3.54118 63.546000 Cu 0.319234 0.421438 0.5 764 63.546 0.000493061 -3.53995 63.546000 Cu 0.271806 0.442604 0.5 790 63.546 0.00113191 -3.54084 63.546000 Cu 0.385457 0.416653 1.07253e-16 762 63.546 0.000147519 -3.54007 63.546000 Cu 0.451763 0.411884 0.5 768 63.546 0.000136994 -3.54008 63.546000 Cu 0.338068 0.437806 1.32841e-16 792 63.546 0.000509622 -3.54001 63.546000 Cu 0.404332 0.432979 0.5 794 63.546 0.000251458 -3.53971 63.546000 Cu 0.470552 0.428208 6.42381e-17 796 63.546 0.000970945 -3.53915 63.546000 Cu 0.555312 0.439983 5.5494e-19 797 63.546 0.00279417 -3.53776 63.546000 Cu 0.536728 0.423543 0.5 798 63.546 0.00141353 -3.53898 63.546000 Cu 0.602745 0.418953 1.49984e-19 800 63.546 0.000746142 -3.53941 63.546000 Cu 0.621129 0.435483 0.5 803 63.546 0.000508406 -3.54001 63.546000 Cu 0.687038 0.430908 0 801 63.546 0.00149204 -3.54118 63.546000 Cu 0.668639 0.414377 0.5 802 63.546 0.000201793 -3.53999 63.546000 Cu 0.734543 0.409735 4.74549e-17 804 63.546 0.000437921 -3.54026 63.546000 Cu 0.819234 0.421438 6.95925e-18 805 63.546 0.000493061 -3.53995 63.546000 Cu 0.753069 0.426206 0.5 807 63.546 0.00115917 -3.54046 63.546000 Cu 0.771806 0.442604 7.19773e-17 832 63.546 0.00113191 -3.54084 63.546000 Cu 0.951763 0.411884 4.34953e-19 809 63.546 0.000136994 -3.54008 63.546000 Cu 0.885457 0.416653 0.5 811 63.546 0.000147519 -3.54007 63.546000 Cu 0.838068 0.437806 0.5 834 63.546 0.000509622 -3.54001 63.546000 Cu 0.904332 0.432979 3.44963e-19 836 63.546 0.000251458 -3.53971 63.546000 Cu 0.970552 0.428208 0.5 837 63.546 0.000970945 -3.53915 63.546000 Cu 0.0273021 0.477745 6.11184e-17 782 63.546 0.0390886 -3.51547 63.546000 Cu 0.00840708 0.461037 0.5 783 63.546 0.0112175 -3.53363 63.546000 Cu 0.0735566 0.456579 1.78481e-17 784 63.546 0.00459903 -3.53689 63.546000 Cu 0.156814 0.468586 2.45974e-17 785 63.546 0.0162658 -3.539 63.546000 Cu 0.139119 0.452085 0.5 786 63.546 0.00593512 -3.54189 63.546000 Cu 0.0914593 0.473505 0.5 787 63.546 0.0370005 -3.54027 63.546000 Cu 0.205339 0.447386 4.88498e-17 788 63.546 0.00350065 -3.54218 63.546000 Cu 0.290595 0.458949 2.99968e-20 789 63.546 0.00450781 -3.54313 63.546000 Cu 0.223778 0.463682 0.5 791 63.546 0.00289643 -3.53935 63.546000 Cu 0.241315 0.479915 0 816 63.546 0.0304341 -3.52331 63.546000 Cu 0.309248 0.47509 0.5 818 63.546 0.0146371 -3.54307 63.546000 Cu 0.423416 0.449278 0 793 63.546 0.00195118 -3.53854 63.546000 Cu 0.357226 0.454116 0.5 795 63.546 0.00148164 -3.54156 63.546000 Cu 0.489484 0.444545 0.5 799 63.546 0.00510626 -3.53719 63.546000 Cu 0.376656 0.470369 3.38664e-17 820 63.546 0.0232495 -3.54516 63.546000 Cu 0.443142 0.465565 0.5 822 63.546 0.0162167 -3.53408 63.546000 Cu 0.508407 0.461037 4.79948e-19 824 63.546 0.0112175 -3.53363 63.546000 Cu 0.591459 0.473505 0 825 63.546 0.0370005 -3.54027 63.546000 Cu 0.573557 0.456579 0.5 826 63.546 0.00459903 -3.53689 63.546000 Cu 0.527302 0.477745 0.5 827 63.546 0.0390886 -3.51547 63.546000 Cu 0.639119 0.452085 8.84905e-19 828 63.546 0.00593512 -3.54189 63.546000 Cu 0.656814 0.468586 0.5 831 63.546 0.0162658 -3.539 63.546000 Cu 0.723778 0.463682 5.24944e-19 829 63.546 0.00289643 -3.53935 63.546000 Cu 0.705339 0.447386 0.5 830 63.546 0.00350065 -3.54218 63.546000 Cu 0.790595 0.458949 0.5 835 63.546 0.00450781 -3.54313 63.546000 Cu 0.741315 0.479915 0.5 844 63.546 0.0304341 -3.52331 63.546000 Cu 0.809248 0.47509 3.29965e-19 845 63.546 0.0146371 -3.54307 63.546000 Cu 0.943142 0.465565 1.55533e-17 24 63.546 0.0162167 -3.53408 63.546000 Cu 0.989484 0.444545 2.87219e-17 752 63.546 0.00510626 -3.53719 63.546000 Cu 0.857226 0.454116 0 833 63.546 0.00148164 -3.54156 63.546000 Cu 0.923416 0.449278 0.5 838 63.546 0.00195118 -3.53854 63.546000 Cu 0.876656 0.470369 0.5 847 63.546 0.0232495 -3.54516 63.546000 Cu 0.129566 0.505499 0.5 26 63.546 8.91327 -3.29973 63.546000 Cu 0.0459196 0.495554 0.5 813 63.546 0.49257 -3.44706 63.546000 Cu 0.109246 0.490162 0 814 63.546 0.371091 -3.48654 63.546000 Cu 0.0681549 0.516522 8.99903e-20 25 63.546 8.39541 -3.49399 63.546000 Cu 0.195576 0.501734 0 27 63.546 2.42397 -3.4682 63.546000 Cu 0.21723 0.516502 0.5 29 63.546 9.76413 -3.30862 63.546000 Cu 0.175988 0.484856 0.5 815 63.546 0.0188691 -3.52757 63.546000 Cu 0.325691 0.490882 4.6495e-19 817 63.546 0.465744 -3.46795 63.546000 Cu 0.260182 0.496152 0.5 819 63.546 0.520673 -3.45574 63.546000 Cu 0.285862 0.516515 0 31 63.546 9.09231 -3.55839 63.546000 Cu 0.343677 0.505564 0.5 6 63.546 9.20502 -3.28745 63.546000 Cu 0.411641 0.502218 3.29965e-19 5 63.546 2.84958 -3.4658 63.546000 Cu 0.497187 0.516478 8.52358e-17 7 63.546 3.78792 -3.52059 63.546000 Cu 0.427473 0.516495 0.5 9 63.546 7.89966 -3.23181 63.546000 Cu 0.463049 0.482219 2.24976e-19 821 63.546 0.0861647 -3.53466 63.546000 Cu 0.396777 0.486247 0.5 823 63.546 0.154813 -3.53195 63.546000 Cu 0.484106 0.498864 0.5 839 63.546 0.819277 -3.47532 63.546000 Cu 0.629566 0.505499 7.79916e-19 10 63.546 8.91327 -3.29973 63.546000 Cu 0.54592 0.495554 0 840 63.546 0.49257 -3.44706 63.546000 Cu 0.609246 0.490162 0.5 841 63.546 0.371091 -3.48654 63.546000 Cu 0.568155 0.516522 0.5 13 63.546 8.39541 -3.49399 63.546000 Cu 0.695576 0.501734 0.5 12 63.546 2.42397 -3.4682 63.546000 Cu 0.71723 0.516502 0 14 63.546 9.76413 -3.30862 63.546000 Cu 0.675988 0.484856 0 842 63.546 0.0188691 -3.52757 63.546000 Cu 0.760182 0.496152 2.60972e-18 843 63.546 0.520673 -3.45574 63.546000 Cu 0.825691 0.490882 0.5 848 63.546 0.465744 -3.46795 63.546000 Cu 0.785862 0.516515 0.5 16 63.546 9.09231 -3.55839 63.546000 Cu 0.843677 0.505564 6.5123e-17 1 63.546 9.20502 -3.28745 63.546000 Cu 0.927473 0.516495 2.04563e-16 2 63.546 7.89966 -3.23181 63.546000 Cu 0.911641 0.502218 0.5 3 63.546 2.84958 -3.4658 63.546000 Cu 0.997187 0.516478 0.5 4 63.546 3.78792 -3.52059 63.546000 Cu 0.963049 0.482219 0.5 8 63.546 0.0861647 -3.53466 63.546000 Cu 0.984106 0.498864 1.38435e-16 812 63.546 0.819277 -3.47532 63.546000 Cu 0.896777 0.486247 3.59961e-19 846 63.546 0.154813 -3.53195 63.546000 Cu 0.129739 0.527507 0.5 30 63.546 8.91173 -3.29895 63.546000 Cu 0.0273852 0.55523 1.09758e-16 55 63.546 0.0376777 -3.51526 63.546000 Cu 0.0460471 0.537409 0.5 56 63.546 0.48962 -3.44828 63.546000 Cu 0.109389 0.542847 0 57 63.546 0.364579 -3.48703 63.546000 Cu 0.195656 0.531251 3.29965e-19 28 63.546 2.41438 -3.46762 63.546000 Cu 0.325828 0.542115 7.04924e-19 32 63.546 0.458382 -3.46806 63.546000 Cu 0.260312 0.536847 0.5 34 63.546 0.512239 -3.45666 63.546000 Cu 0.176122 0.548135 0.5 59 63.546 0.0188061 -3.52738 63.546000 Cu 0.241422 0.553075 4.07806e-17 61 63.546 0.0296796 -3.52341 63.546000 Cu 0.343798 0.527432 0.5 33 63.546 9.1887 -3.28712 63.546000 Cu 0.411788 0.530785 8.31961e-17 35 63.546 2.83306 -3.46544 63.546000 Cu 0.463195 0.550767 2.99968e-19 36 63.546 0.0891352 -3.53443 63.546000 Cu 0.484247 0.534105 0.5 37 63.546 0.81798 -3.47578 63.546000 Cu 0.396877 0.546745 0.5 38 63.546 0.154658 -3.53172 63.546000 Cu 0.629739 0.527507 2.84969e-19 11 63.546 8.91173 -3.29895 63.546000 Cu 0.546047 0.537409 1.73021e-16 39 63.546 0.48962 -3.44828 63.546000 Cu 0.609389 0.542847 0.5 41 63.546 0.364579 -3.48703 63.546000 Cu 0.527385 0.55523 0.5 42 63.546 0.0376777 -3.51526 63.546000 Cu 0.760312 0.536847 1.54093e-16 15 63.546 0.512239 -3.45666 63.546000 Cu 0.695656 0.531251 0.5 17 63.546 2.41438 -3.46762 63.546000 Cu 0.825828 0.542115 0.5 21 63.546 0.458382 -3.46806 63.546000 Cu 0.676122 0.548135 0 43 63.546 0.0188061 -3.52738 63.546000 Cu 0.741422 0.553075 0.5 45 63.546 0.0296796 -3.52341 63.546000 Cu 0.843798 0.527432 2.39974e-19 18 63.546 9.1887 -3.28712 63.546000 Cu 0.896877 0.546745 1.68762e-16 19 63.546 0.154658 -3.53172 63.546000 Cu 0.911788 0.530785 0.5 20 63.546 2.83306 -3.46544 63.546000 Cu 0.984247 0.534105 2.03078e-17 22 63.546 0.81798 -3.47578 63.546000 Cu 0.963195 0.550767 0.5 23 63.546 0.0891352 -3.53443 63.546000 Cu 0.00843789 0.571963 0.5 53 63.546 0.0115235 -3.53358 63.546000 Cu 0.156921 0.564407 0 58 63.546 0.0146255 -3.53901 63.546000 Cu 0.0915275 0.559492 0.5 60 63.546 0.0368182 -3.54047 63.546000 Cu 0.0735652 0.576409 1.30936e-17 85 63.546 0.00417926 -3.53694 63.546000 Cu 0.139095 0.58091 0.5 87 63.546 0.00614408 -3.54196 63.546000 Cu 0.290619 0.574052 8.75156e-17 62 63.546 0.00460923 -3.54319 63.546000 Cu 0.309341 0.557909 0.5 63 63.546 0.0147096 -3.54316 63.546000 Cu 0.223798 0.569313 0.5 64 63.546 0.00281893 -3.53948 63.546000 Cu 0.205318 0.585627 0 89 63.546 0.00304023 -3.54214 63.546000 Cu 0.271728 0.590399 0.5 91 63.546 0.00131114 -3.54094 63.546000 Cu 0.376727 0.562625 3.32814e-17 65 63.546 0.0236465 -3.54504 63.546000 Cu 0.423392 0.583725 5.23294e-17 66 63.546 0.00171716 -3.53852 63.546000 Cu 0.443173 0.567427 0.5 67 63.546 0.0162667 -3.53404 63.546000 Cu 0.357231 0.578882 0.5 68 63.546 0.0016849 -3.54147 63.546000 Cu 0.489404 0.588466 0.5 72 63.546 0.00532015 -3.53728 63.546000 Cu 0.591528 0.559492 1.94979e-19 40 63.546 0.0368182 -3.54047 63.546000 Cu 0.656921 0.564407 0.5 46 63.546 0.0146255 -3.53901 63.546000 Cu 0.508438 0.571963 6.61429e-17 69 63.546 0.0115235 -3.53358 63.546000 Cu 0.573565 0.576409 0.5 71 63.546 0.00417926 -3.53694 63.546000 Cu 0.639095 0.58091 6.59629e-17 73 63.546 0.00614408 -3.54196 63.546000 Cu 0.723798 0.569313 3.44963e-19 44 63.546 0.00281893 -3.53948 63.546000 Cu 0.809341 0.557909 5.99936e-19 47 63.546 0.0147096 -3.54316 63.546000 Cu 0.790619 0.574052 0.5 50 63.546 0.00460923 -3.54319 63.546000 Cu 0.705318 0.585627 0.5 75 63.546 0.00304023 -3.54214 63.546000 Cu 0.771728 0.590399 8.46359e-17 77 63.546 0.00131114 -3.54094 63.546000 Cu 0.857231 0.578882 1.04989e-19 48 63.546 0.0016849 -3.54147 63.546000 Cu 0.876727 0.562625 0.5 49 63.546 0.0236465 -3.54504 63.546000 Cu 0.943173 0.567427 4.85948e-17 51 63.546 0.0162667 -3.53404 63.546000 Cu 0.989404 0.588466 9.36949e-17 52 63.546 0.00532015 -3.53728 63.546000 Cu 0.923392 0.583725 0.5 54 63.546 0.00171716 -3.53852 63.546000 Cu 0.0552181 0.593023 0.5 88 63.546 0.00275304 -3.53795 63.546000 Cu 0.121002 0.597527 7.55919e-17 86 63.546 0.000542728 -3.54004 63.546000 Cu 0.0365072 0.609488 1.69482e-17 115 63.546 0.00168563 -3.53907 63.546000 Cu 0.102495 0.614072 0.5 117 63.546 0.000828344 -3.53935 63.546000 Cu 0.0176194 0.625872 0.5 118 63.546 0.000441198 -3.53971 63.546000 Cu 0.252883 0.606819 2.99968e-20 90 63.546 0.000980821 -3.54069 63.546000 Cu 0.186864 0.6021 0.5 92 63.546 0.00181407 -3.54126 63.546000 Cu 0.318963 0.611595 0.5 96 63.546 0.00048196 -3.54012 63.546000 Cu 0.168317 0.618656 1.19987e-19 119 63.546 0.000194431 -3.53995 63.546000 Cu 0.234168 0.6233 0.5 121 63.546 0.000505577 -3.54027 63.546000 Cu 0.300166 0.628016 0 123 63.546 0.00042307 -3.54028 63.546000 Cu 0.337971 0.595206 2.39974e-19 93 63.546 0.000512033 -3.54015 63.546000 Cu 0.385137 0.616378 1.63212e-16 94 63.546 0.00025751 -3.54013 63.546000 Cu 0.404149 0.600042 0.5 95 63.546 0.00028855 -3.53974 63.546000 Cu 0.470356 0.604812 0 97 63.546 0.000929522 -3.53937 63.546000 Cu 0.45139 0.621154 0.5 100 63.546 0.000124665 -3.54003 63.546000 Cu 0.555218 0.593023 8.21912e-18 70 63.546 0.00275304 -3.53795 63.546000 Cu 0.621002 0.597527 0.5 76 63.546 0.000542728 -3.54004 63.546000 Cu 0.517619 0.625872 3.59961e-19 98 63.546 0.000441198 -3.53971 63.546000 Cu 0.536507 0.609488 0.5 99 63.546 0.00168563 -3.53907 63.546000 Cu 0.602495 0.614072 2.70271e-17 101 63.546 0.000828344 -3.53935 63.546000 Cu 0.686864 0.6021 1.79981e-19 74 63.546 0.00181407 -3.54126 63.546000 Cu 0.818963 0.611595 0 78 63.546 0.00048196 -3.54012 63.546000 Cu 0.752883 0.606819 0.5 80 63.546 0.000980821 -3.54069 63.546000 Cu 0.668317 0.618656 0.5 103 63.546 0.000194431 -3.53995 63.546000 Cu 0.734168 0.6233 3.89958e-19 105 63.546 0.000505577 -3.54027 63.546000 Cu 0.800166 0.628016 0.5 107 63.546 0.00042307 -3.54028 63.546000 Cu 0.837971 0.595206 0.5 79 63.546 0.000512033 -3.54015 63.546000 Cu 0.904149 0.600042 4.49952e-20 81 63.546 0.00028855 -3.53974 63.546000 Cu 0.95139 0.621154 4.31504e-17 82 63.546 0.000124665 -3.54003 63.546000 Cu 0.970356 0.604812 0.5 83 63.546 0.000929522 -3.53937 63.546000 Cu 0.885137 0.616378 0.5 84 63.546 0.00025751 -3.54013 63.546000 Cu 0.0836924 0.630542 1.20287e-16 116 63.546 0.000638767 -3.53935 63.546000 Cu 0.149631 0.635168 0.5 122 63.546 0.000209945 -3.53937 63.546000 Cu 0.0459417 0.66336 0 146 63.546 3.9951e-05 -3.54001 63.546000 Cu 0.0648078 0.646954 0.5 147 63.546 0.000177408 -3.53972 63.546000 Cu 0.130848 0.651631 4.91797e-17 148 63.546 0.000208402 -3.53962 63.546000 Cu 0.215511 0.639799 0 120 63.546 9.10032e-05 -3.53996 63.546000 Cu 0.281496 0.644473 0.5 126 63.546 0.000183779 -3.54023 63.546000 Cu 0.196838 0.656288 0.5 150 63.546 8.34945e-05 -3.5398 63.546000 Cu 0.2628 0.66094 5.11745e-17 152 63.546 4.13437e-05 -3.54005 63.546000 Cu 0.328824 0.665621 0.5 154 63.546 8.98284e-05 -3.54012 63.546000 Cu 0.347524 0.649179 6.59929e-18 124 63.546 0.000196475 -3.54022 63.546000 Cu 0.366306 0.632766 0.5 125 63.546 0.000179764 -3.54029 63.546000 Cu 0.432481 0.63751 4.79948e-19 127 63.546 9.45395e-05 -3.5403 63.546000 Cu 0.479807 0.658639 6.84226e-17 128 63.546 1.45534e-05 -3.54009 63.546000 Cu 0.498669 0.64225 0.5 129 63.546 7.08168e-05 -3.54011 63.546000 Cu 0.413661 0.653912 0.5 130 63.546 5.44254e-05 -3.54026 63.546000 Cu 0.649631 0.635168 4.19955e-19 102 63.546 0.000209945 -3.53937 63.546000 Cu 0.583692 0.630542 0.5 104 63.546 0.000638767 -3.53935 63.546000 Cu 0.564808 0.646954 5.18194e-17 131 63.546 0.000177408 -3.53972 63.546000 Cu 0.630848 0.651631 0.5 133 63.546 0.000208402 -3.53962 63.546000 Cu 0.545942 0.66336 0.5 134 63.546 3.9951e-05 -3.54001 63.546000 Cu 0.781496 0.644473 0 106 63.546 0.000183779 -3.54023 63.546000 Cu 0.715511 0.639799 0.5 108 63.546 9.10032e-05 -3.53996 63.546000 Cu 0.696838 0.656288 1.73261e-16 135 63.546 8.34945e-05 -3.5398 63.546000 Cu 0.7628 0.66094 0.5 137 63.546 4.13437e-05 -3.54005 63.546000 Cu 0.828824 0.665621 0 139 63.546 8.98284e-05 -3.54012 63.546000 Cu 0.866306 0.632766 5.30943e-18 109 63.546 0.000179764 -3.54029 63.546000 Cu 0.913661 0.653912 0 110 63.546 5.44254e-05 -3.54026 63.546000 Cu 0.932481 0.63751 0.5 111 63.546 9.45395e-05 -3.5403 63.546000 Cu 0.847524 0.649179 0.5 112 63.546 0.000196475 -3.54022 63.546000 Cu 0.998669 0.64225 0 113 63.546 7.08168e-05 -3.54011 63.546000 Cu 0.979807 0.658639 0.5 114 63.546 1.45534e-05 -3.54009 63.546000 Cu 0.00835112 0.696166 7.49919e-20 144 63.546 4.31479e-05 -3.54008 63.546000 Cu 0.112042 0.668062 0.5 151 63.546 0.000107814 -3.53979 63.546000 Cu 0.0271176 0.679762 0.5 176 63.546 1.17679e-05 -3.53998 63.546000 Cu 0.0932471 0.684471 2.53623e-17 177 63.546 3.03243e-05 -3.53994 63.546000 Cu 0.159346 0.689166 0.5 179 63.546 4.28557e-05 -3.53989 63.546000 Cu 0.0744853 0.700881 0.5 180 63.546 1.49993e-05 -3.54006 63.546000 Cu 0.178092 0.672736 0 149 63.546 6.4534e-05 -3.53973 63.546000 Cu 0.310139 0.682073 3.16016e-17 153 63.546 9.65998e-06 -3.53996 63.546000 Cu 0.244134 0.677404 0.5 155 63.546 3.26992e-05 -3.53986 63.546000 Cu 0.225408 0.693842 1.26631e-16 181 63.546 1.80389e-05 -3.53986 63.546000 Cu 0.291435 0.69852 0.5 183 63.546 2.29594e-05 -3.53992 63.546000 Cu 0.394889 0.670322 3.7106e-17 156 63.546 0.000100185 -3.54008 63.546000 Cu 0.442227 0.691457 3.54412e-17 157 63.546 8.7524e-05 -3.54015 63.546000 Cu 0.461004 0.67504 0.5 158 63.546 2.73075e-05 -3.54003 63.546000 Cu 0.376152 0.686758 0.5 159 63.546 6.0637e-05 -3.54014 63.546000 Cu 0.357487 0.703205 9.58397e-17 185 63.546 2.39985e-05 -3.54011 63.546000 Cu 0.612042 0.668062 2.04278e-17 132 63.546 0.000107814 -3.53979 63.546000 Cu 0.527118 0.679762 5.29443e-17 160 63.546 1.17679e-05 -3.53998 63.546000 Cu 0.574485 0.700881 9.94243e-17 161 63.546 1.49993e-05 -3.54006 63.546000 Cu 0.593247 0.684471 0.5 162 63.546 3.03243e-05 -3.53994 63.546000 Cu 0.508351 0.696166 0.5 163 63.546 4.31479e-05 -3.54008 63.546000 Cu 0.659346 0.689166 1.31191e-16 164 63.546 4.28557e-05 -3.53989 63.546000 Cu 0.744134 0.677404 8.82955e-17 136 63.546 3.26992e-05 -3.53986 63.546000 Cu 0.678092 0.672736 0.5 138 63.546 6.4534e-05 -3.53973 63.546000 Cu 0.810139 0.682073 0.5 142 63.546 9.65998e-06 -3.53996 63.546000 Cu 0.725408 0.693842 0.5 166 63.546 1.80389e-05 -3.53986 63.546000 Cu 0.791435 0.69852 1.19987e-19 168 63.546 2.29594e-05 -3.53992 63.546000 Cu 0.876152 0.686758 2.24976e-19 140 63.546 6.0637e-05 -3.54014 63.546000 Cu 0.894889 0.670322 0.5 141 63.546 0.000100185 -3.54008 63.546000 Cu 0.961004 0.67504 3.56812e-17 143 63.546 2.73075e-05 -3.54003 63.546000 Cu 0.942227 0.691457 0.5 145 63.546 8.7524e-05 -3.54015 63.546000 Cu 0.857487 0.703205 0.5 170 63.546 2.39985e-05 -3.54011 63.546000 Cu 0.140599 0.705584 3.63261e-17 178 63.546 3.57938e-05 -3.53999 63.546000 Cu 0.0557852 0.717291 2.69971e-19 206 63.546 3.5572e-05 -3.53998 63.546000 Cu 0.103307 0.738402 5.36792e-17 207 63.546 8.8769e-06 -3.53995 63.546000 Cu 0.121929 0.721997 0.5 208 63.546 1.48051e-05 -3.53991 63.546000 Cu 0.037181 0.733708 0.5 209 63.546 1.4996e-05 -3.53999 63.546000 Cu 0.27278 0.714957 2.84969e-19 182 63.546 2.39226e-05 -3.53993 63.546000 Cu 0.206686 0.710275 0.5 184 63.546 4.85318e-05 -3.53993 63.546000 Cu 0.18807 0.726694 5.5659e-17 210 63.546 2.18799e-05 -3.53979 63.546000 Cu 0.25418 0.731382 0.5 212 63.546 1.25971e-05 -3.53984 63.546000 Cu 0.32029 0.736072 1.35285e-17 214 63.546 8.20263e-06 -3.53992 63.546000 Cu 0.40499 0.724334 0 186 63.546 1.12771e-05 -3.54004 63.546000 Cu 0.423569 0.707892 0.5 187 63.546 3.2302e-05 -3.54016 63.546000 Cu 0.338876 0.719644 0.5 188 63.546 1.12651e-05 -3.54004 63.546000 Cu 0.489669 0.712587 6.61279e-17 189 63.546 5.0578e-05 -3.54007 63.546000 Cu 0.471079 0.729019 0.5 192 63.546 6.77585e-06 -3.53994 63.546000 Cu 0.640599 0.705584 0.5 167 63.546 3.57938e-05 -3.53999 63.546000 Cu 0.537181 0.733708 8.25661e-17 190 63.546 1.4996e-05 -3.53999 63.546000 Cu 0.555785 0.717291 0.5 191 63.546 3.5572e-05 -3.53998 63.546000 Cu 0.621929 0.721997 4.92697e-17 193 63.546 1.48051e-05 -3.53991 63.546000 Cu 0.603307 0.738402 0.5 196 63.546 8.8769e-06 -3.53995 63.546000 Cu 0.706686 0.710275 5.15645e-17 165 63.546 4.85318e-05 -3.53993 63.546000 Cu 0.77278 0.714957 0.5 171 63.546 2.39226e-05 -3.53993 63.546000 Cu 0.68807 0.726694 0.5 195 63.546 2.18799e-05 -3.53979 63.546000 Cu 0.75418 0.731382 5.69939e-19 197 63.546 1.25971e-05 -3.53984 63.546000 Cu 0.82029 0.736072 0.5 199 63.546 8.20263e-06 -3.53992 63.546000 Cu 0.838876 0.719644 2.09977e-19 169 63.546 1.12651e-05 -3.54004 63.546000 Cu 0.923569 0.707892 7.4572e-17 172 63.546 3.2302e-05 -3.54016 63.546000 Cu 0.971079 0.729019 0 173 63.546 6.77585e-06 -3.53994 63.546000 Cu 0.989669 0.712587 0.5 174 63.546 5.0578e-05 -3.54007 63.546000 Cu 0.90499 0.724334 0.5 175 63.546 1.12771e-05 -3.54004 63.546000 Cu 0.018576 0.750129 4.04956e-19 236 63.546 4.87471e-06 -3.53994 63.546000 Cu 0.0660656 0.771226 0 237 63.546 9.32817e-06 -3.53973 63.546000 Cu 0.0846864 0.754814 0.5 238 63.546 6.88156e-06 -3.53997 63.546000 Cu 0.150792 0.7595 2.24976e-19 239 63.546 1.18285e-05 -3.53989 63.546000 Cu 0.132174 0.775903 0.5 242 63.546 1.27644e-05 -3.53972 63.546000 Cu 0.235571 0.747793 7.11824e-17 211 63.546 8.46223e-06 -3.53991 63.546000 Cu 0.169442 0.743097 0.5 213 63.546 1.46328e-06 -3.53986 63.546000 Cu 0.301691 0.752488 0.5 217 63.546 1.12716e-05 -3.53997 63.546000 Cu 0.216933 0.764193 0.5 241 63.546 5.43492e-06 -3.5399 63.546000 Cu 0.283083 0.768894 7.17223e-17 243 63.546 1.39663e-05 -3.53997 63.546000 Cu 0.386389 0.740761 0.5 216 63.546 7.75405e-06 -3.53987 63.546000 Cu 0.367792 0.757179 3.33414e-17 215 63.546 7.22358e-06 -3.53991 63.546000 Cu 0.45249 0.745446 7.64168e-17 218 63.546 5.63913e-06 -3.53982 63.546000 Cu 0.499967 0.766546 4.87448e-18 219 63.546 1.00136e-05 -3.53979 63.546000 Cu 0.433879 0.761864 0.5 221 63.546 8.02398e-06 -3.53982 63.546000 Cu 0.34923 0.773598 0.5 245 63.546 3.94971e-05 -3.54 63.546000 Cu 0.518576 0.750129 0.5 220 63.546 4.87471e-06 -3.53994 63.546000 Cu 0.584686 0.754814 1.73081e-17 222 63.546 6.88156e-06 -3.53997 63.546000 Cu 0.632174 0.775903 2.39974e-19 223 63.546 1.27644e-05 -3.53972 63.546000 Cu 0.650792 0.7595 0.5 224 63.546 1.18285e-05 -3.53989 63.546000 Cu 0.566066 0.771226 0.5 225 63.546 9.32817e-06 -3.53973 63.546000 Cu 0.669442 0.743097 0 194 63.546 1.46328e-06 -3.53986 63.546000 Cu 0.801691 0.752488 4.35253e-17 198 63.546 1.12716e-05 -3.53997 63.546000 Cu 0.735571 0.747793 0.5 200 63.546 8.46223e-06 -3.53991 63.546000 Cu 0.716933 0.764193 4.84148e-17 226 63.546 5.43492e-06 -3.5399 63.546000 Cu 0.783083 0.768894 0.5 228 63.546 1.39663e-05 -3.53997 63.546000 Cu 0.886389 0.740761 0 201 63.546 7.75405e-06 -3.53987 63.546000 Cu 0.933879 0.761864 7.34921e-19 202 63.546 8.02398e-06 -3.53982 63.546000 Cu 0.95249 0.745446 0.5 203 63.546 5.63913e-06 -3.53982 63.546000 Cu 0.867792 0.757179 0.5 204 63.546 7.22358e-06 -3.53991 63.546000 Cu 0.999967 0.766546 0.5 205 63.546 1.00136e-05 -3.53979 63.546000 Cu 0.84923 0.773598 0 230 63.546 3.94971e-05 -3.54 63.546000 Cu 0.0289611 0.804083 6.14934e-19 267 63.546 1.69585e-05 -3.54006 63.546000 Cu 0.0474686 0.78764 0.5 268 63.546 5.80265e-05 -3.5398 63.546000 Cu 0.113564 0.792311 3.29965e-19 269 63.546 5.89843e-05 -3.53979 63.546000 Cu 0.161068 0.813405 3.58162e-17 270 63.546 0.000169862 -3.53988 63.546000 Cu 0.094987 0.808742 0.5 272 63.546 0.000102476 -3.53993 63.546000 Cu 0.198311 0.780588 0 240 63.546 2.08592e-05 -3.53988 63.546000 Cu 0.330652 0.790004 5.44891e-17 244 63.546 3.00565e-05 -3.54006 63.546000 Cu 0.264482 0.78529 0.5 246 63.546 9.40119e-06 -3.54 63.546000 Cu 0.179681 0.796991 0.5 271 63.546 4.886e-05 -3.53996 63.546000 Cu 0.245847 0.801688 4.30304e-17 273 63.546 1.71671e-05 -3.54003 63.546000 Cu 0.312024 0.806398 0.5 275 63.546 9.45425e-06 -3.53997 63.546000 Cu 0.415322 0.778289 0 247 63.546 1.97111e-05 -3.54003 63.546000 Cu 0.462912 0.799411 1.79981e-19 248 63.546 8.08767e-05 -3.54021 63.546000 Cu 0.481403 0.78297 0.5 249 63.546 2.08469e-05 -3.53997 63.546000 Cu 0.396807 0.794716 0.5 250 63.546 0.000101211 -3.54018 63.546000 Cu 0.378229 0.811117 2.62472e-18 277 63.546 6.43668e-05 -3.54002 63.546000 Cu 0.547469 0.78764 3.67311e-17 251 63.546 5.80265e-05 -3.5398 63.546000 Cu 0.594987 0.808742 0 252 63.546 0.000102476 -3.53993 63.546000 Cu 0.613564 0.792311 0.5 253 63.546 5.89843e-05 -3.53979 63.546000 Cu 0.528961 0.804083 0.5 254 63.546 1.69585e-05 -3.54006 63.546000 Cu 0.661068 0.813405 0.5 258 63.546 0.000169862 -3.53988 63.546000 Cu 0.764482 0.78529 5.79388e-17 227 63.546 9.40119e-06 -3.54 63.546000 Cu 0.698311 0.780588 0.5 229 63.546 2.08592e-05 -3.53988 63.546000 Cu 0.830652 0.790004 0.5 233 63.546 3.00565e-05 -3.54006 63.546000 Cu 0.679681 0.796991 2.24976e-19 255 63.546 4.886e-05 -3.53996 63.546000 Cu 0.745847 0.801688 0.5 257 63.546 1.71671e-05 -3.54003 63.546000 Cu 0.812024 0.806398 4.79948e-19 259 63.546 9.45425e-06 -3.53997 63.546000 Cu 0.896807 0.794716 9.11752e-17 231 63.546 0.000101211 -3.54018 63.546000 Cu 0.915322 0.778289 0.5 232 63.546 1.97111e-05 -3.54003 63.546000 Cu 0.981403 0.78297 0 234 63.546 2.08469e-05 -3.53997 63.546000 Cu 0.962912 0.799411 0.5 235 63.546 8.08767e-05 -3.54021 63.546000 Cu 0.878229 0.811117 0.5 261 63.546 6.43668e-05 -3.54002 63.546000 Cu 0.0105102 0.820533 0.5 265 63.546 0.000249508 -3.54 63.546000 Cu 0.0765479 0.825197 2.73271e-17 297 63.546 5.06502e-05 -3.53998 63.546000 Cu 0.124276 0.846312 3.7496e-19 298 63.546 0.000141861 -3.5401 63.546000 Cu 0.142601 0.829843 0.5 299 63.546 0.000105562 -3.53993 63.546000 Cu 0.0581728 0.841648 0.5 300 63.546 0.000389633 -3.54007 63.546000 Cu 0.293389 0.82278 0 274 63.546 5.36591e-05 -3.53965 63.546000 Cu 0.227211 0.818085 0.5 276 63.546 0.000117754 -3.53977 63.546000 Cu 0.208683 0.834496 1.05439e-17 301 63.546 0.000277197 -3.53977 63.546000 Cu 0.274803 0.839169 0.5 303 63.546 0.000240726 -3.53953 63.546000 Cu 0.190313 0.850955 0.5 304 63.546 5.41655e-05 -3.54002 63.546000 Cu 0.425787 0.832217 8.69457e-17 278 63.546 3.85176e-05 -3.5398 63.546000 Cu 0.444405 0.815835 0.5 279 63.546 0.000232991 -3.54005 63.546000 Cu 0.359575 0.827491 0.5 280 63.546 1.67637e-05 -3.5397 63.546000 Cu 0.491992 0.836945 0.5 284 63.546 0.000255893 -3.53992 63.546000 Cu 0.340946 0.843861 4.34953e-19 305 63.546 0.000160538 -3.53946 63.546000 Cu 0.407157 0.848578 0.5 307 63.546 3.75014e-05 -3.53957 63.546000 Cu 0.51051 0.820533 0 281 63.546 0.000249508 -3.54 63.546000 Cu 0.558173 0.841648 6.84076e-17 282 63.546 0.000389633 -3.54007 63.546000 Cu 0.576548 0.825197 0.5 283 63.546 5.06502e-05 -3.53998 63.546000 Cu 0.642601 0.829843 2.09977e-19 285 63.546 0.000105562 -3.53993 63.546000 Cu 0.624276 0.846312 0.5 288 63.546 0.000141861 -3.5401 63.546000 Cu 0.727211 0.818085 7.64918e-18 256 63.546 0.000117754 -3.53977 63.546000 Cu 0.793389 0.82278 0.5 262 63.546 5.36591e-05 -3.53965 63.546000 Cu 0.690313 0.850955 0 286 63.546 5.41655e-05 -3.54002 63.546000 Cu 0.708683 0.834496 0.5 287 63.546 0.000277197 -3.53977 63.546000 Cu 0.774803 0.839169 3.59961e-19 289 63.546 0.000240726 -3.53953 63.546000 Cu 0.859575 0.827491 2.24976e-19 260 63.546 1.67637e-05 -3.5397 63.546000 Cu 0.944405 0.815835 4.34953e-19 263 63.546 0.000232991 -3.54005 63.546000 Cu 0.991992 0.836945 1.04989e-18 264 63.546 0.000255893 -3.53992 63.546000 Cu 0.925787 0.832217 0.5 266 63.546 3.85176e-05 -3.5398 63.546000 Cu 0.840946 0.843861 0.5 291 63.546 0.000160538 -3.53946 63.546000 Cu 0.907157 0.848578 2.24976e-19 293 63.546 3.75014e-05 -3.53957 63.546000 Cu 0.0396527 0.85806 2.63522e-17 327 63.546 0.000436536 -3.54007 63.546000 Cu 0.08713 0.879184 4.34953e-19 328 63.546 0.0004776 -3.54034 63.546000 Cu 0.105821 0.862769 0.5 329 63.546 0.000589364 -3.54012 63.546000 Cu 0.0209177 0.874435 0.5 330 63.546 0.000166032 -3.5404 63.546000 Cu 0.153223 0.883886 0.5 334 63.546 0.000384814 -3.54011 63.546000 Cu 0.256314 0.855596 8.01964e-17 302 63.546 0.000224816 -3.5398 63.546000 Cu 0.322361 0.860254 0.5 308 63.546 0.000369702 -3.53954 63.546000 Cu 0.171868 0.867433 1.64982e-19 331 63.546 0.000268971 -3.54009 63.546000 Cu 0.237825 0.872071 0.5 333 63.546 5.64705e-05 -3.53996 63.546000 Cu 0.303752 0.876693 6.06085e-17 335 63.546 0.000291804 -3.53975 63.546000 Cu 0.219241 0.888549 1.13793e-16 332 63.546 0.000232346 -3.54023 63.546000 Cu 0.388486 0.864936 3.67011e-17 306 63.546 0.000408485 -3.53961 63.546000 Cu 0.473397 0.853319 4.19955e-19 309 63.546 7.61541e-05 -3.5398 63.546000 Cu 0.454709 0.869671 0.5 312 63.546 0.000194841 -3.53996 63.546000 Cu 0.369726 0.881338 0.5 337 63.546 0.000674648 -3.53961 63.546000 Cu 0.435779 0.886033 7.04924e-19 339 63.546 0.000508969 -3.53991 63.546000 Cu 0.520918 0.874435 5.97686e-17 310 63.546 0.000166032 -3.5404 63.546000 Cu 0.539653 0.85806 0.5 311 63.546 0.000436536 -3.54007 63.546000 Cu 0.605821 0.862769 4.6495e-19 313 63.546 0.000589364 -3.54012 63.546000 Cu 0.653223 0.883886 1.20287e-17 314 63.546 0.000384814 -3.54011 63.546000 Cu 0.58713 0.879184 0.5 316 63.546 0.0004776 -3.54034 63.546000 Cu 0.822361 0.860254 3.7196e-17 290 63.546 0.000369702 -3.53954 63.546000 Cu 0.756314 0.855596 0.5 292 63.546 0.000224816 -3.5398 63.546000 Cu 0.671868 0.867433 0.5 315 63.546 0.000268971 -3.54009 63.546000 Cu 0.737825 0.872071 1.60798e-16 317 63.546 5.64705e-05 -3.53996 63.546000 Cu 0.803752 0.876693 0.5 319 63.546 0.000291804 -3.53975 63.546000 Cu 0.719241 0.888549 0.5 320 63.546 0.000232346 -3.54023 63.546000 Cu 0.954709 0.869671 9.48048e-17 294 63.546 0.000194841 -3.53996 63.546000 Cu 0.973397 0.853319 0.5 295 63.546 7.61541e-05 -3.5398 63.546000 Cu 0.888486 0.864936 0.5 296 63.546 0.000408485 -3.53961 63.546000 Cu 0.869726 0.881338 4.26254e-17 321 63.546 0.000674648 -3.53961 63.546000 Cu 0.935779 0.886033 0.5 323 63.546 0.000508969 -3.53991 63.546000 Cu 0.0493854 0.911874 2.34875e-17 358 63.546 7.74753e-05 -3.54005 63.546000 Cu 0.0683043 0.895557 0.5 359 63.546 0.000342539 -3.54027 63.546000 Cu 0.134541 0.900303 5.26593e-17 360 63.546 0.000667592 -3.54011 63.546000 Cu 0.115721 0.916676 0.5 363 63.546 0.000758724 -3.53991 63.546000 Cu 0.00200285 0.890788 0 325 63.546 6.44023e-05 -3.54023 63.546000 Cu 0.285115 0.89319 0.5 338 63.546 7.87885e-05 -3.53992 63.546000 Cu 0.181829 0.921461 0 361 63.546 0.000863245 -3.53994 63.546000 Cu 0.200591 0.905029 0.5 362 63.546 0.000648579 -3.54031 63.546000 Cu 0.266507 0.90972 1.04839e-17 364 63.546 0.000618823 -3.54029 63.546000 Cu 0.332268 0.914326 0.5 366 63.546 0.000271973 -3.53968 63.546000 Cu 0.350917 0.897798 6.28882e-17 336 63.546 0.000585096 -3.5393 63.546000 Cu 0.483074 0.907106 3.27115e-17 340 63.546 0.000753722 -3.53976 63.546000 Cu 0.416832 0.902415 0.5 342 63.546 0.00168195 -3.53943 63.546000 Cu 0.398134 0.918871 4.04956e-19 368 63.546 0.00135523 -3.53939 63.546000 Cu 0.46413 0.923456 0.5 370 63.546 0.00275438 -3.53932 63.546000 Cu 0.502003 0.890788 0.5 341 63.546 6.44023e-05 -3.54023 63.546000 Cu 0.568304 0.895557 1.68102e-16 343 63.546 0.000342539 -3.54027 63.546000 Cu 0.615721 0.916676 4.10056e-17 344 63.546 0.000758724 -3.53991 63.546000 Cu 0.634541 0.900303 0.5 345 63.546 0.000667592 -3.54011 63.546000 Cu 0.549385 0.911874 0.5 346 63.546 7.74753e-05 -3.54005 63.546000 Cu 0.785115 0.89319 1.04989e-17 318 63.546 7.87885e-05 -3.53992 63.546000 Cu 0.700591 0.905029 2.55273e-17 347 63.546 0.000648579 -3.54031 63.546000 Cu 0.766507 0.90972 0.5 349 63.546 0.000618823 -3.54029 63.546000 Cu 0.681829 0.921461 0.5 350 63.546 0.000863245 -3.53994 63.546000 Cu 0.832268 0.914326 1.21397e-16 351 63.546 0.000271973 -3.53968 63.546000 Cu 0.916832 0.902415 1.93479e-18 322 63.546 0.00168195 -3.53943 63.546000 Cu 0.850917 0.897798 0.5 324 63.546 0.000585096 -3.5393 63.546000 Cu 0.983074 0.907106 0.5 326 63.546 0.000753722 -3.53976 63.546000 Cu 0.898134 0.918871 0.5 353 63.546 0.00135523 -3.53939 63.546000 Cu 0.96413 0.923456 5.04846e-17 355 63.546 0.00275438 -3.53932 63.546000 Cu 0.0112014 0.94448 0 356 63.546 0.00684247 -3.53729 63.546000 Cu 0.0303923 0.92817 0.5 388 63.546 0.00120349 -3.53947 63.546000 Cu 0.0966212 0.93299 6.5018e-17 389 63.546 0.000326462 -3.53968 63.546000 Cu 0.143426 0.954148 0 390 63.546 0.00199223 -3.54141 63.546000 Cu 0.162836 0.937838 0.5 391 63.546 0.000916312 -3.53993 63.546000 Cu 0.0772685 0.949271 0.5 392 63.546 0.00171929 -3.53863 63.546000 Cu 0.313814 0.930901 4.19955e-19 365 63.546 0.00184352 -3.54106 63.546000 Cu 0.247902 0.926227 0.5 367 63.546 0.00180547 -3.54078 63.546000 Cu 0.229028 0.94265 7.16173e-17 393 63.546 0.00201635 -3.54095 63.546000 Cu 0.295428 0.947406 0.5 395 63.546 0.00473184 -3.54237 63.546000 Cu 0.210044 0.958975 0.5 396 63.546 0.00477476 -3.54292 63.546000 Cu 0.445413 0.939905 5.5494e-19 369 63.546 0.00403412 -3.53801 63.546000 Cu 0.379586 0.935419 0.5 371 63.546 0.000744396 -3.53998 63.546000 Cu 0.361557 0.952068 5.09945e-19 397 63.546 0.00630945 -3.54172 63.546000 Cu 0.426996 0.956507 0.5 399 63.546 0.00573126 -3.53651 63.546000 Cu 0.492103 0.960977 9.44898e-19 401 63.546 0.0133735 -3.53382 63.546000 Cu 0.530392 0.92817 4.696e-17 372 63.546 0.00120349 -3.53947 63.546000 Cu 0.577269 0.949271 1.49234e-17 373 63.546 0.00171929 -3.53863 63.546000 Cu 0.596621 0.93299 0.5 374 63.546 0.000326462 -3.53968 63.546000 Cu 0.511201 0.94448 0.5 375 63.546 0.00684247 -3.53729 63.546000 Cu 0.662836 0.937838 5.39942e-19 376 63.546 0.000916312 -3.53993 63.546000 Cu 0.643426 0.954148 0.5 379 63.546 0.00199223 -3.54141 63.546000 Cu 0.747902 0.926227 3.54562e-17 348 63.546 0.00180547 -3.54078 63.546000 Cu 0.813814 0.930901 0.5 354 63.546 0.00184352 -3.54106 63.546000 Cu 0.710044 0.958975 1.19087e-16 377 63.546 0.00477476 -3.54292 63.546000 Cu 0.729028 0.94265 0.5 378 63.546 0.00201635 -3.54095 63.546000 Cu 0.795428 0.947406 1.37715e-16 380 63.546 0.00473184 -3.54237 63.546000 Cu 0.879586 0.935419 5.14745e-17 352 63.546 0.000744396 -3.53998 63.546000 Cu 0.945413 0.939905 0.5 357 63.546 0.00403412 -3.53801 63.546000 Cu 0.861557 0.952068 0.5 382 63.546 0.00630945 -3.54172 63.546000 Cu 0.926996 0.956507 1.25986e-17 384 63.546 0.00573126 -3.53651 63.546000 Cu 0.992103 0.960977 0.5 386 63.546 0.0133735 -3.53382 63.546000 Cu 0.0159416 0.998811 3.47813e-17 425 63.546 0.855363 -3.4721 63.546000 Cu 0.0573128 0.965529 5.69939e-19 414 63.546 0.0187654 -3.53409 63.546000 Cu 0.103516 0.986221 8.62257e-17 415 63.546 0.155537 -3.53167 63.546000 Cu 0.123802 0.97039 0.5 416 63.546 0.0250315 -3.54477 63.546000 Cu 0.0372148 0.982191 0.5 417 63.546 0.0905088 -3.53469 63.546000 Cu 0.276896 0.963718 3.28915e-17 394 63.546 0.0033032 -3.5397 63.546000 Cu 0.19121 0.975097 3.36714e-17 418 63.546 0.0146922 -3.54263 63.546000 Cu 0.240002 0.996146 5.94086e-17 419 63.546 0.530345 -3.45492 63.546000 Cu 0.259144 0.979935 0.5 420 63.546 0.0316571 -3.52349 63.546000 Cu 0.174654 0.99089 0.5 421 63.546 0.478519 -3.46883 63.546000 Cu 0.32443 0.984899 4.79948e-19 422 63.546 0.0171208 -3.5281 63.546000 Cu 0.409032 0.973479 1.4334e-16 398 63.546 0.0354941 -3.54012 63.546000 Cu 0.343848 0.968607 0.5 400 63.546 0.0208095 -3.53949 63.546000 Cu 0.473038 0.977696 0.5 404 63.546 0.0406775 -3.5148 63.546000 Cu 0.391067 0.990204 0.5 423 63.546 0.389164 -3.48593 63.546000 Cu 0.454236 0.995513 4.49952e-20 424 63.546 0.507824 -3.44212 63.546000 Cu 0.515942 0.998811 0.5 444 63.546 0.855363 -3.4721 63.546000 Cu 0.537215 0.982191 2.99968e-20 402 63.546 0.0905088 -3.53469 63.546000 Cu 0.557313 0.965529 0.5 403 63.546 0.0187654 -3.53409 63.546000 Cu 0.623802 0.97039 3.84559e-17 405 63.546 0.0250315 -3.54477 63.546000 Cu 0.603516 0.986221 0.5 408 63.546 0.155537 -3.53167 63.546000 Cu 0.776896 0.963718 0.5 383 63.546 0.0033032 -3.5397 63.546000 Cu 0.674654 0.99089 1.34985e-19 406 63.546 0.478519 -3.46883 63.546000 Cu 0.69121 0.975097 0.5 407 63.546 0.0146922 -3.54263 63.546000 Cu 0.759144 0.979935 5.94386e-17 409 63.546 0.0316571 -3.52349 63.546000 Cu 0.82443 0.984899 0.5 410 63.546 0.0171208 -3.5281 63.546000 Cu 0.740002 0.996146 0.5 411 63.546 0.530345 -3.45492 63.546000 Cu 0.843848 0.968607 1.94979e-19 381 63.546 0.0208095 -3.53949 63.546000 Cu 0.973038 0.977696 6.59929e-19 385 63.546 0.0406775 -3.5148 63.546000 Cu 0.909032 0.973479 0.5 387 63.546 0.0354941 -3.54012 63.546000 Cu 0.891067 0.990204 4.6645e-17 412 63.546 0.389164 -3.48593 63.546000 Cu 0.954236 0.995513 0.5 413 63.546 0.507824 -3.44212