Number of particles = 816 A = 1 Angstrom (basic length-scale) H0(1,1) = 21.0976 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 89.3957 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.11701 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 0.0887427 0.0196121 0.5 448 63.546 5.1111 -3.40984 63.546000 Cu 0.0887427 0.0196121 2.67692e-15 449 63.546 5.1111 -3.40984 63.546000 Cu 0.182 0.00343221 0.5 447 63.546 8.49463 -3.40369 63.546000 Cu 0.193973 0.0265229 0.75 451 63.546 0.499915 -3.49526 63.546000 Cu 0.284117 0.00314402 0.75 455 63.546 3.19699 -3.42236 63.546000 Cu 0.182 0.00343221 1 456 63.546 8.49463 -3.40369 63.546000 Cu 0.193973 0.0265229 0.25 457 63.546 0.499915 -3.49526 63.546000 Cu 0.284117 0.00314402 0.25 458 63.546 3.19699 -3.42236 63.546000 Cu 0.294163 0.0297126 0.5 481 63.546 0.240379 -3.50776 63.546000 Cu 0.294163 0.0297126 6.40731e-16 493 63.546 0.240379 -3.50776 63.546000 Cu 0.381552 0.0114797 0.5 489 63.546 6.93839 -3.45242 63.546000 Cu 0.381552 0.0114797 4.28705e-14 490 63.546 6.93839 -3.45242 63.546000 Cu 0.39872 0.0352204 0.75 491 63.546 0.0336505 -3.53521 63.546000 Cu 0.488087 0.0155319 0.75 492 63.546 5.62075 -3.50871 63.546000 Cu 0.39872 0.0352204 0.25 495 63.546 0.0336505 -3.53521 63.546000 Cu 0.488087 0.0155319 0.25 496 63.546 5.62075 -3.50871 63.546000 Cu 0.588743 0.0196121 0.5 531 63.546 5.1111 -3.40984 63.546000 Cu 0.588743 0.0196121 1 539 63.546 5.1111 -3.40984 63.546000 Cu 0.682 0.00343221 0.5 413 63.546 8.49463 -3.40369 63.546000 Cu 0.682 0.00343221 5.33409e-15 414 63.546 8.49463 -3.40369 63.546000 Cu 0.693973 0.0265229 0.75 415 63.546 0.499915 -3.49526 63.546000 Cu 0.784117 0.00314402 0.75 416 63.546 3.19699 -3.42236 63.546000 Cu 0.693973 0.0265229 0.25 417 63.546 0.499915 -3.49526 63.546000 Cu 0.784117 0.00314402 0.25 418 63.546 3.19699 -3.42236 63.546000 Cu 0.794163 0.0297126 0.5 422 63.546 0.240379 -3.50776 63.546000 Cu 0.794163 0.0297126 1.35943e-16 423 63.546 0.240379 -3.50776 63.546000 Cu 0.881552 0.0114797 0.5 421 63.546 6.93839 -3.45242 63.546000 Cu 0.89872 0.0352204 0.75 425 63.546 0.0336505 -3.53521 63.546000 Cu 0.988087 0.0155319 0.75 429 63.546 5.62075 -3.50871 63.546000 Cu 0.881552 0.0114797 1 430 63.546 6.93839 -3.45242 63.546000 Cu 0.89872 0.0352204 0.25 431 63.546 0.0336505 -3.53521 63.546000 Cu 0.988087 0.0155319 0.25 432 63.546 5.62075 -3.50871 63.546000 Cu 0.0152911 0.0643506 0.75 443 63.546 0.00111777 -3.53965 63.546000 Cu 0.103633 0.044376 0.75 450 63.546 0.0813208 -3.53588 63.546000 Cu 0.0152911 0.0643506 0.25 453 63.546 0.00111777 -3.53965 63.546000 Cu 0.103633 0.044376 0.25 454 63.546 0.0813208 -3.53588 63.546000 Cu 0.117775 0.0691625 0.5 473 63.546 0.0144344 -3.53851 63.546000 Cu 0.117775 0.0691625 3.47825e-16 486 63.546 0.0144344 -3.53851 63.546000 Cu 0.00104652 0.0399341 0.5 439 63.546 0.00660545 -3.53922 63.546000 Cu 0.00104652 0.0399341 2.54902e-15 452 63.546 0.00660545 -3.53922 63.546000 Cu 0.206832 0.0504529 0.5 482 63.546 0.115153 -3.53299 63.546000 Cu 0.206832 0.0504529 1.56276e-15 483 63.546 0.115153 -3.53299 63.546000 Cu 0.221198 0.0745218 0.75 484 63.546 0.0239033 -3.53737 63.546000 Cu 0.309566 0.0543157 0.75 485 63.546 0.0429565 -3.53855 63.546000 Cu 0.221198 0.0745218 0.25 488 63.546 0.0239033 -3.53737 63.546000 Cu 0.309566 0.0543157 0.25 494 63.546 0.0429565 -3.53855 63.546000 Cu 0.412524 0.0595863 0.5 523 63.546 0.00503442 -3.53959 63.546000 Cu 0.412524 0.0595863 1.97076e-15 536 63.546 0.00503442 -3.53959 63.546000 Cu 0.501047 0.0399341 0.5 532 63.546 0.00660545 -3.53922 63.546000 Cu 0.501047 0.0399341 1 533 63.546 0.00660545 -3.53922 63.546000 Cu 0.515291 0.0643506 0.75 534 63.546 0.00111777 -3.53965 63.546000 Cu 0.603633 0.044376 0.75 535 63.546 0.0813208 -3.53588 63.546000 Cu 0.515291 0.0643506 0.25 538 63.546 0.00111777 -3.53965 63.546000 Cu 0.603633 0.044376 0.25 540 63.546 0.0813208 -3.53588 63.546000 Cu 0.617775 0.0691625 0.5 579 63.546 0.0144344 -3.53851 63.546000 Cu 0.617775 0.0691625 1 580 63.546 0.0144344 -3.53851 63.546000 Cu 0.706832 0.0504529 0.5 419 63.546 0.115153 -3.53299 63.546000 Cu 0.721198 0.0745218 0.75 420 63.546 0.0239033 -3.53737 63.546000 Cu 0.809566 0.0543157 0.75 424 63.546 0.0429565 -3.53855 63.546000 Cu 0.706832 0.0504529 1 426 63.546 0.115153 -3.53299 63.546000 Cu 0.721198 0.0745218 0.25 427 63.546 0.0239033 -3.53737 63.546000 Cu 0.809566 0.0543157 0.25 428 63.546 0.0429565 -3.53855 63.546000 Cu 0.912524 0.0595863 0.5 440 63.546 0.00503442 -3.53959 63.546000 Cu 0.912524 0.0595863 1.01703e-18 441 63.546 0.00503442 -3.53959 63.546000 Cu 0.0295042 0.0888312 0.5 474 63.546 9.33764e-05 -3.53995 63.546000 Cu 0.0295042 0.0888312 8.97617e-16 475 63.546 9.33764e-05 -3.53995 63.546000 Cu 0.0438487 0.113288 0.75 476 63.546 1.964e-05 -3.53995 63.546000 Cu 0.132319 0.0936878 0.75 477 63.546 0.00271469 -3.53982 63.546000 Cu 0.0438487 0.113288 0.25 480 63.546 1.964e-05 -3.53995 63.546000 Cu 0.132319 0.0936878 0.25 487 63.546 0.00271469 -3.53982 63.546000 Cu 0.235389 0.0987971 0.5 515 63.546 0.00540083 -3.53929 63.546000 Cu 0.323865 0.0789478 0.5 524 63.546 0.00819815 -3.53957 63.546000 Cu 0.323865 0.0789478 1.39003e-15 525 63.546 0.00819815 -3.53957 63.546000 Cu 0.235389 0.0987971 8.68716e-16 528 63.546 0.00540083 -3.53929 63.546000 Cu 0.338172 0.103448 0.75 526 63.546 0.00225654 -3.5399 63.546000 Cu 0.338172 0.103448 0.25 530 63.546 0.00225654 -3.5399 63.546000 Cu 0.426809 0.0839832 0.75 527 63.546 0.000893835 -3.53985 63.546000 Cu 0.426809 0.0839832 0.25 537 63.546 0.000893835 -3.53985 63.546000 Cu 0.441046 0.10843 0.5 572 63.546 0.000368928 -3.53993 63.546000 Cu 0.441046 0.10843 1.74252e-16 573 63.546 0.000368928 -3.53993 63.546000 Cu 0.529504 0.0888312 0.5 571 63.546 9.33764e-05 -3.53995 63.546000 Cu 0.543849 0.113288 0.75 575 63.546 1.964e-05 -3.53995 63.546000 Cu 0.632319 0.0936878 0.75 581 63.546 0.00271469 -3.53982 63.546000 Cu 0.529504 0.0888312 2.3324e-16 582 63.546 9.33764e-05 -3.53995 63.546000 Cu 0.543849 0.113288 0.25 583 63.546 1.964e-05 -3.53995 63.546000 Cu 0.632319 0.0936878 0.25 584 63.546 0.00271469 -3.53982 63.546000 Cu 0.823865 0.0789478 0.5 433 63.546 0.00819815 -3.53957 63.546000 Cu 0.735389 0.0987971 0.5 434 63.546 0.00540083 -3.53929 63.546000 Cu 0.735389 0.0987971 1 435 63.546 0.00540083 -3.53929 63.546000 Cu 0.823865 0.0789478 1 444 63.546 0.00819815 -3.53957 63.546000 Cu 0.838172 0.103448 0.75 437 63.546 0.00225654 -3.5399 63.546000 Cu 0.838172 0.103448 0.25 445 63.546 0.00225654 -3.5399 63.546000 Cu 0.926809 0.0839832 0.75 442 63.546 0.000893835 -3.53985 63.546000 Cu 0.926809 0.0839832 0.25 446 63.546 0.000893835 -3.53985 63.546000 Cu 0.941046 0.10843 0.5 465 63.546 0.000368928 -3.53993 63.546000 Cu 0.941046 0.10843 1.29307e-15 478 63.546 0.000368928 -3.53993 63.546000 Cu 0.0582767 0.137743 0.5 507 63.546 0.000102345 -3.53995 63.546000 Cu 0.146699 0.118168 0.5 516 63.546 0.000585959 -3.53994 63.546000 Cu 0.146699 0.118168 1 517 63.546 0.000585959 -3.53994 63.546000 Cu 0.161186 0.142626 0.75 518 63.546 0.000265615 -3.53995 63.546000 Cu 0.0582767 0.137743 1.04246e-15 520 63.546 0.000102345 -3.53995 63.546000 Cu 0.161186 0.142626 0.25 522 63.546 0.000265615 -3.53995 63.546000 Cu 0.249671 0.123158 0.75 519 63.546 0.00140895 -3.53973 63.546000 Cu 0.249671 0.123158 0.25 529 63.546 0.00140895 -3.53973 63.546000 Cu 0.264142 0.14756 0.5 564 63.546 0.000537365 -3.53987 63.546000 Cu 0.264142 0.14756 3.4791e-16 565 63.546 0.000537365 -3.53987 63.546000 Cu 0.352471 0.127915 0.5 563 63.546 0.000917847 -3.53995 63.546000 Cu 0.367052 0.152375 0.75 567 63.546 0.000479579 -3.53995 63.546000 Cu 0.455389 0.132867 0.75 574 63.546 0.000220952 -3.53992 63.546000 Cu 0.352471 0.127915 3.4791e-16 576 63.546 0.000917847 -3.53995 63.546000 Cu 0.367052 0.152375 0.25 577 63.546 0.000479579 -3.53995 63.546000 Cu 0.455389 0.132867 0.25 578 63.546 0.000220952 -3.53992 63.546000 Cu 0.646699 0.118168 0.5 623 63.546 0.000585959 -3.53994 63.546000 Cu 0.558277 0.137743 0.5 624 63.546 0.000102345 -3.53995 63.546000 Cu 0.558277 0.137743 7.74556e-16 625 63.546 0.000102345 -3.53995 63.546000 Cu 0.661186 0.142626 0.75 627 63.546 0.000265615 -3.53995 63.546000 Cu 0.646699 0.118168 1.09755e-15 631 63.546 0.000585959 -3.53994 63.546000 Cu 0.661186 0.142626 0.25 632 63.546 0.000265615 -3.53995 63.546000 Cu 0.749671 0.123158 0.75 436 63.546 0.00140895 -3.53973 63.546000 Cu 0.749671 0.123158 0.25 438 63.546 0.00140895 -3.53973 63.546000 Cu 0.764142 0.14756 0.5 459 63.546 0.000537365 -3.53987 63.546000 Cu 0.764142 0.14756 1 470 63.546 0.000537365 -3.53987 63.546000 Cu 0.852471 0.127915 0.5 466 63.546 0.000917847 -3.53995 63.546000 Cu 0.852471 0.127915 1.06907e-15 467 63.546 0.000917847 -3.53995 63.546000 Cu 0.867052 0.152375 0.75 468 63.546 0.000479579 -3.53995 63.546000 Cu 0.955389 0.132867 0.75 469 63.546 0.000220952 -3.53992 63.546000 Cu 0.867052 0.152375 0.25 472 63.546 0.000479579 -3.53995 63.546000 Cu 0.955389 0.132867 0.25 479 63.546 0.000220952 -3.53992 63.546000 Cu 0.0730148 0.16219 0.75 511 63.546 0.000106682 -3.53992 63.546000 Cu 0.0730148 0.16219 0.25 521 63.546 0.000106682 -3.53992 63.546000 Cu 0.0880652 0.186629 0.5 556 63.546 1.64268e-05 -3.5399 63.546000 Cu 0.0880652 0.186629 8.6897e-16 557 63.546 1.64268e-05 -3.5399 63.546000 Cu 0.176018 0.16708 0.5 555 63.546 7.07674e-05 -3.53991 63.546000 Cu 0.191088 0.191531 0.75 559 63.546 1.92064e-05 -3.53991 63.546000 Cu 0.279046 0.171976 0.75 566 63.546 6.10491e-05 -3.5399 63.546000 Cu 0.176018 0.16708 5.21399e-16 568 63.546 7.07674e-05 -3.53991 63.546000 Cu 0.191088 0.191531 0.25 569 63.546 1.92064e-05 -3.53991 63.546000 Cu 0.279046 0.171976 0.25 570 63.546 6.10491e-05 -3.5399 63.546000 Cu 0.470029 0.157309 0.5 615 63.546 0.00019888 -3.53991 63.546000 Cu 0.382018 0.176843 0.5 616 63.546 5.99879e-05 -3.53992 63.546000 Cu 0.382018 0.176843 3.47571e-16 617 63.546 5.99879e-05 -3.53992 63.546000 Cu 0.485041 0.181753 0.75 619 63.546 2.3858e-05 -3.5399 63.546000 Cu 0.470029 0.157309 6.51749e-17 628 63.546 0.00019888 -3.53991 63.546000 Cu 0.485041 0.181753 0.25 629 63.546 2.3858e-05 -3.5399 63.546000 Cu 0.573015 0.16219 0.75 626 63.546 0.000106682 -3.53992 63.546000 Cu 0.573015 0.16219 0.25 630 63.546 0.000106682 -3.53992 63.546000 Cu 0.588065 0.186629 0.5 667 63.546 1.64268e-05 -3.5399 63.546000 Cu 0.588065 0.186629 3.4791e-16 675 63.546 1.64268e-05 -3.5399 63.546000 Cu 0.676018 0.16708 0.5 460 63.546 7.07674e-05 -3.53991 63.546000 Cu 0.676018 0.16708 6.95227e-16 461 63.546 7.07674e-05 -3.53991 63.546000 Cu 0.691088 0.191531 0.75 462 63.546 1.92064e-05 -3.53991 63.546000 Cu 0.779046 0.171976 0.75 463 63.546 6.10491e-05 -3.5399 63.546000 Cu 0.691088 0.191531 0.25 464 63.546 1.92064e-05 -3.53991 63.546000 Cu 0.779046 0.171976 0.25 471 63.546 6.10491e-05 -3.5399 63.546000 Cu 0.882018 0.176843 0.5 499 63.546 5.99879e-05 -3.53992 63.546000 Cu 0.970029 0.157309 0.5 508 63.546 0.00019888 -3.53991 63.546000 Cu 0.970029 0.157309 4.23764e-19 509 63.546 0.00019888 -3.53991 63.546000 Cu 0.985041 0.181753 0.75 510 63.546 2.3858e-05 -3.5399 63.546000 Cu 0.882018 0.176843 1.21595e-15 512 63.546 5.99879e-05 -3.53992 63.546000 Cu 0.985041 0.181753 0.25 514 63.546 2.3858e-05 -3.5399 63.546000 Cu 0.014977 0.230619 0.75 551 63.546 5.75705e-06 -3.53991 63.546000 Cu 0.103062 0.211068 0.75 558 63.546 2.02635e-05 -3.53991 63.546000 Cu 0.014977 0.230619 0.25 561 63.546 5.75705e-06 -3.53991 63.546000 Cu 0.103062 0.211068 0.25 562 63.546 2.02635e-05 -3.53991 63.546000 Cu 7.59931e-05 0.20619 0.5 547 63.546 2.39079e-05 -3.53991 63.546000 Cu 7.59931e-05 0.20619 1.27299e-16 560 63.546 2.39079e-05 -3.53991 63.546000 Cu 0.294091 0.196417 0.5 607 63.546 1.71213e-05 -3.53991 63.546000 Cu 0.206071 0.215972 0.5 608 63.546 3.32986e-05 -3.53991 63.546000 Cu 0.206071 0.215972 3.27485e-16 609 63.546 3.32986e-05 -3.53991 63.546000 Cu 0.30903 0.220859 0.75 611 63.546 1.90982e-05 -3.53992 63.546000 Cu 0.294091 0.196417 8.68886e-16 620 63.546 1.71213e-05 -3.53991 63.546000 Cu 0.30903 0.220859 0.25 621 63.546 1.90982e-05 -3.53992 63.546000 Cu 0.397086 0.201299 0.75 618 63.546 3.3976e-05 -3.53992 63.546000 Cu 0.397086 0.201299 0.25 622 63.546 3.3976e-05 -3.53992 63.546000 Cu 0.411986 0.225746 0.5 659 63.546 1.39531e-05 -3.53992 63.546000 Cu 0.411986 0.225746 5.21314e-16 672 63.546 1.39531e-05 -3.53992 63.546000 Cu 0.500076 0.20619 0.5 668 63.546 2.39079e-05 -3.53991 63.546000 Cu 0.500076 0.20619 1.17137e-15 669 63.546 2.39079e-05 -3.53991 63.546000 Cu 0.514977 0.230619 0.75 670 63.546 5.75705e-06 -3.53991 63.546000 Cu 0.603062 0.211068 0.75 671 63.546 2.02635e-05 -3.53991 63.546000 Cu 0.514977 0.230619 0.25 674 63.546 5.75705e-06 -3.53991 63.546000 Cu 0.603062 0.211068 0.25 676 63.546 2.02635e-05 -3.53991 63.546000 Cu 0.706071 0.215972 0.5 497 63.546 3.32986e-05 -3.53991 63.546000 Cu 0.794091 0.196417 0.5 500 63.546 1.71213e-05 -3.53991 63.546000 Cu 0.794091 0.196417 6.95058e-16 501 63.546 1.71213e-05 -3.53991 63.546000 Cu 0.80903 0.220859 0.75 502 63.546 1.90982e-05 -3.53992 63.546000 Cu 0.706071 0.215972 5.2123e-16 504 63.546 3.32986e-05 -3.53991 63.546000 Cu 0.80903 0.220859 0.25 506 63.546 1.90982e-05 -3.53992 63.546000 Cu 0.897086 0.201299 0.75 503 63.546 3.3976e-05 -3.53992 63.546000 Cu 0.897086 0.201299 0.25 513 63.546 3.3976e-05 -3.53992 63.546000 Cu 0.911986 0.225746 0.5 548 63.546 1.39531e-05 -3.53992 63.546000 Cu 0.911986 0.225746 5.21314e-16 549 63.546 1.39531e-05 -3.53992 63.546000 Cu 0.117973 0.235508 0.5 599 63.546 1.58754e-05 -3.53993 63.546000 Cu 0.0298468 0.255045 0.5 600 63.546 3.95073e-05 -3.53991 63.546000 Cu 0.0298468 0.255045 8.68886e-16 601 63.546 3.95073e-05 -3.53991 63.546000 Cu 0.132781 0.259959 0.75 603 63.546 2.97836e-05 -3.53993 63.546000 Cu 0.117973 0.235508 2.33833e-16 612 63.546 1.58754e-05 -3.53993 63.546000 Cu 0.132781 0.259959 0.25 613 63.546 2.97836e-05 -3.53993 63.546000 Cu 0.220907 0.240402 0.75 610 63.546 5.15798e-06 -3.53992 63.546000 Cu 0.220907 0.240402 0.25 614 63.546 5.15798e-06 -3.53992 63.546000 Cu 0.235727 0.264837 0.5 651 63.546 3.70297e-06 -3.53992 63.546000 Cu 0.323861 0.245283 0.5 660 63.546 6.66055e-06 -3.53991 63.546000 Cu 0.323861 0.245283 8.68801e-16 661 63.546 6.66055e-06 -3.53991 63.546000 Cu 0.235727 0.264837 7.59385e-16 664 63.546 3.70297e-06 -3.53992 63.546000 Cu 0.426858 0.250174 0.75 663 63.546 9.97284e-06 -3.5399 63.546000 Cu 0.426858 0.250174 0.25 673 63.546 9.97284e-06 -3.5399 63.546000 Cu 0.529847 0.255045 0.5 707 63.546 3.95073e-05 -3.53991 63.546000 Cu 0.617973 0.235508 0.5 715 63.546 1.58754e-05 -3.53993 63.546000 Cu 0.617973 0.235508 1.34672e-16 716 63.546 1.58754e-05 -3.53993 63.546000 Cu 0.632781 0.259959 0.75 717 63.546 2.97836e-05 -3.53993 63.546000 Cu 0.529847 0.255045 1 718 63.546 3.95073e-05 -3.53991 63.546000 Cu 0.632781 0.259959 0.25 720 63.546 2.97836e-05 -3.53993 63.546000 Cu 0.720907 0.240402 0.75 498 63.546 5.15798e-06 -3.53992 63.546000 Cu 0.720907 0.240402 0.25 505 63.546 5.15798e-06 -3.53992 63.546000 Cu 0.823861 0.245283 0.5 541 63.546 6.66055e-06 -3.53991 63.546000 Cu 0.735727 0.264837 0.5 542 63.546 3.70297e-06 -3.53992 63.546000 Cu 0.735727 0.264837 8.6897e-16 543 63.546 3.70297e-06 -3.53992 63.546000 Cu 0.823861 0.245283 6.95227e-16 552 63.546 6.66055e-06 -3.53991 63.546000 Cu 0.926858 0.250174 0.75 550 63.546 9.97284e-06 -3.5399 63.546000 Cu 0.926858 0.250174 0.25 554 63.546 9.97284e-06 -3.5399 63.546000 Cu 0.0446429 0.279483 0.75 602 63.546 2.22264e-05 -3.53992 63.546000 Cu 0.0446429 0.279483 0.25 606 63.546 2.22264e-05 -3.53992 63.546000 Cu 0.0593525 0.303919 0.5 643 63.546 1.05521e-05 -3.53992 63.546000 Cu 0.147592 0.284399 0.5 652 63.546 6.22082e-05 -3.53992 63.546000 Cu 0.147592 0.284399 6.95058e-16 653 63.546 6.22082e-05 -3.53992 63.546000 Cu 0.0593525 0.303919 7.12008e-16 656 63.546 1.05521e-05 -3.53992 63.546000 Cu 0.250567 0.289268 0.75 655 63.546 2.76795e-05 -3.53991 63.546000 Cu 0.250567 0.289268 0.25 665 63.546 2.76795e-05 -3.53991 63.546000 Cu 0.338724 0.269713 0.75 662 63.546 7.07904e-06 -3.53992 63.546000 Cu 0.338724 0.269713 0.25 666 63.546 7.07904e-06 -3.53992 63.546000 Cu 0.35354 0.294154 0.5 699 63.546 4.10105e-05 -3.53994 63.546000 Cu 0.441721 0.274594 0.5 708 63.546 2.98539e-05 -3.53991 63.546000 Cu 0.441721 0.274594 1.04271e-15 709 63.546 2.98539e-05 -3.53991 63.546000 Cu 0.456439 0.299025 0.75 710 63.546 2.74596e-05 -3.53992 63.546000 Cu 0.35354 0.294154 9.8737e-17 712 63.546 4.10105e-05 -3.53994 63.546000 Cu 0.456439 0.299025 0.25 714 63.546 2.74596e-05 -3.53992 63.546000 Cu 0.544643 0.279483 0.75 711 63.546 2.22264e-05 -3.53992 63.546000 Cu 0.544643 0.279483 0.25 719 63.546 2.22264e-05 -3.53992 63.546000 Cu 0.647592 0.284399 0.5 755 63.546 6.22082e-05 -3.53992 63.546000 Cu 0.559352 0.303919 0.5 756 63.546 1.05521e-05 -3.53992 63.546000 Cu 0.559352 0.303919 8.28374e-16 757 63.546 1.05521e-05 -3.53992 63.546000 Cu 0.647592 0.284399 3.47825e-16 763 63.546 6.22082e-05 -3.53992 63.546000 Cu 0.750567 0.289268 0.75 544 63.546 2.76795e-05 -3.53991 63.546000 Cu 0.750567 0.289268 0.25 546 63.546 2.76795e-05 -3.53991 63.546000 Cu 0.838724 0.269713 0.75 545 63.546 7.07904e-06 -3.53992 63.546000 Cu 0.838724 0.269713 0.25 553 63.546 7.07904e-06 -3.53992 63.546000 Cu 0.941721 0.274594 0.5 591 63.546 2.98539e-05 -3.53991 63.546000 Cu 0.85354 0.294154 0.5 592 63.546 4.10105e-05 -3.53994 63.546000 Cu 0.85354 0.294154 9.02363e-16 593 63.546 4.10105e-05 -3.53994 63.546000 Cu 0.956439 0.299025 0.75 595 63.546 2.74596e-05 -3.53992 63.546000 Cu 0.941721 0.274594 8.68886e-16 604 63.546 2.98539e-05 -3.53991 63.546000 Cu 0.956439 0.299025 0.25 605 63.546 2.74596e-05 -3.53992 63.546000 Cu 0.0740145 0.328359 0.75 647 63.546 2.67897e-05 -3.53992 63.546000 Cu 0.162317 0.30883 0.75 654 63.546 6.42074e-05 -3.53992 63.546000 Cu 0.0740145 0.328359 0.25 657 63.546 2.67897e-05 -3.53992 63.546000 Cu 0.162317 0.30883 0.25 658 63.546 6.42074e-05 -3.53992 63.546000 Cu 0.176972 0.333264 0.5 691 63.546 0.000122486 -3.53994 63.546000 Cu 0.265273 0.313686 0.5 700 63.546 7.99022e-05 -3.5399 63.546000 Cu 0.265273 0.313686 3.47825e-16 701 63.546 7.99022e-05 -3.5399 63.546000 Cu 0.279823 0.338101 0.75 702 63.546 0.000271555 -3.53987 63.546000 Cu 0.176972 0.333264 2.09e-16 704 63.546 0.000122486 -3.53994 63.546000 Cu 0.279823 0.338101 0.25 706 63.546 0.000271555 -3.53987 63.546000 Cu 0.3682 0.318591 0.75 703 63.546 0.000104414 -3.53994 63.546000 Cu 0.3682 0.318591 0.25 713 63.546 0.000104414 -3.53994 63.546000 Cu 0.471056 0.323442 0.5 747 63.546 0.000129118 -3.53988 63.546000 Cu 0.382728 0.343038 0.5 748 63.546 0.000459383 -3.53995 63.546000 Cu 0.382728 0.343038 6.39121e-16 749 63.546 0.000459383 -3.53995 63.546000 Cu 0.471056 0.323442 1.65437e-16 760 63.546 0.000129118 -3.53988 63.546000 Cu 0.574015 0.328359 0.75 758 63.546 2.67897e-05 -3.53992 63.546000 Cu 0.662317 0.30883 0.75 759 63.546 6.42074e-05 -3.53992 63.546000 Cu 0.574015 0.328359 0.25 762 63.546 2.67897e-05 -3.53992 63.546000 Cu 0.662317 0.30883 0.25 764 63.546 6.42074e-05 -3.53992 63.546000 Cu 0.765273 0.313686 0.5 585 63.546 7.99022e-05 -3.5399 63.546000 Cu 0.676972 0.333264 0.5 586 63.546 0.000122486 -3.53994 63.546000 Cu 0.676972 0.333264 6.95227e-16 587 63.546 0.000122486 -3.53994 63.546000 Cu 0.779823 0.338101 0.75 589 63.546 0.000271555 -3.53987 63.546000 Cu 0.765273 0.313686 1.21629e-15 596 63.546 7.99022e-05 -3.5399 63.546000 Cu 0.779823 0.338101 0.25 597 63.546 0.000271555 -3.53987 63.546000 Cu 0.8682 0.318591 0.75 594 63.546 0.000104414 -3.53994 63.546000 Cu 0.8682 0.318591 0.25 598 63.546 0.000104414 -3.53994 63.546000 Cu 0.882728 0.343038 0.5 635 63.546 0.000459383 -3.53995 63.546000 Cu 0.971056 0.323442 0.5 644 63.546 0.000129118 -3.53988 63.546000 Cu 0.971056 0.323442 6.95227e-16 645 63.546 0.000129118 -3.53988 63.546000 Cu 0.882728 0.343038 8.68716e-16 648 63.546 0.000459383 -3.53995 63.546000 Cu 0.0886232 0.352808 0.5 692 63.546 0.000286866 -3.53993 63.546000 Cu 0.0886232 0.352808 5.21399e-16 693 63.546 0.000286866 -3.53993 63.546000 Cu 0.103215 0.377287 0.75 694 63.546 0.00169876 -3.5398 63.546000 Cu 0.103215 0.377287 0.25 698 63.546 0.00169876 -3.5398 63.546000 Cu 0.000162243 0.372199 0.5 683 63.546 0.00363399 -3.53949 63.546000 Cu 0.000162243 0.372199 5.21484e-16 696 63.546 0.00363399 -3.53949 63.546000 Cu 0.191464 0.357714 0.75 695 63.546 0.000288267 -3.53997 63.546000 Cu 0.191464 0.357714 0.25 705 63.546 0.000288267 -3.53997 63.546000 Cu 0.294239 0.362496 0.5 739 63.546 0.00132116 -3.53973 63.546000 Cu 0.206036 0.382192 0.5 740 63.546 0.00100753 -3.53995 63.546000 Cu 0.206036 0.382192 5.21399e-16 741 63.546 0.00100753 -3.53995 63.546000 Cu 0.294239 0.362496 6.95142e-16 752 63.546 0.00132116 -3.53973 63.546000 Cu 0.397286 0.367492 0.75 750 63.546 0.00210367 -3.5399 63.546000 Cu 0.485649 0.347839 0.75 751 63.546 0.000725149 -3.53977 63.546000 Cu 0.397286 0.367492 0.25 754 63.546 0.00210367 -3.5399 63.546000 Cu 0.485649 0.347839 0.25 761 63.546 0.000725149 -3.53977 63.546000 Cu 0.500162 0.372199 0.5 786 63.546 0.00363399 -3.53949 63.546000 Cu 0.500162 0.372199 8.68716e-16 787 63.546 0.00363399 -3.53949 63.546000 Cu 0.588623 0.352808 0.5 785 63.546 0.000286866 -3.53993 63.546000 Cu 0.603215 0.377287 0.75 789 63.546 0.00169876 -3.5398 63.546000 Cu 0.588623 0.352808 5.21569e-16 793 63.546 0.000286866 -3.53993 63.546000 Cu 0.603215 0.377287 0.25 794 63.546 0.00169876 -3.5398 63.546000 Cu 0.691464 0.357714 0.75 588 63.546 0.000288267 -3.53997 63.546000 Cu 0.691464 0.357714 0.25 590 63.546 0.000288267 -3.53997 63.546000 Cu 0.706036 0.382192 0.5 633 63.546 0.00100753 -3.53995 63.546000 Cu 0.794239 0.362496 0.5 636 63.546 0.00132116 -3.53973 63.546000 Cu 0.794239 0.362496 3.4791e-16 637 63.546 0.00132116 -3.53973 63.546000 Cu 0.706036 0.382192 1.04263e-15 640 63.546 0.00100753 -3.53995 63.546000 Cu 0.897286 0.367492 0.75 639 63.546 0.00210367 -3.5399 63.546000 Cu 0.985649 0.347839 0.75 646 63.546 0.000725149 -3.53977 63.546000 Cu 0.897286 0.367492 0.25 649 63.546 0.00210367 -3.5399 63.546000 Cu 0.985649 0.347839 0.25 650 63.546 0.000725149 -3.53977 63.546000 Cu 0.0146451 0.396507 0.75 687 63.546 0.017184 -3.53822 63.546000 Cu 0.0146451 0.396507 0.25 697 63.546 0.017184 -3.53822 63.546000 Cu 0.11791 0.401834 0.5 731 63.546 0.00982148 -3.53891 63.546000 Cu 0.0290902 0.420652 0.5 732 63.546 0.0871842 -3.53318 63.546000 Cu 0.0290902 0.420652 5.21399e-16 733 63.546 0.0871842 -3.53318 63.546000 Cu 0.11791 0.401834 8.68801e-16 744 63.546 0.00982148 -3.53891 63.546000 Cu 0.220615 0.406696 0.75 742 63.546 0.00339682 -3.53978 63.546000 Cu 0.308749 0.386852 0.75 743 63.546 0.00584998 -3.53923 63.546000 Cu 0.220615 0.406696 0.25 746 63.546 0.00339682 -3.53978 63.546000 Cu 0.308749 0.386852 0.25 753 63.546 0.00584998 -3.53923 63.546000 Cu 0.323324 0.411102 0.5 778 63.546 0.0278127 -3.53778 63.546000 Cu 0.323324 0.411102 8.68716e-16 779 63.546 0.0278127 -3.53778 63.546000 Cu 0.411981 0.391979 0.5 777 63.546 0.00989217 -3.53945 63.546000 Cu 0.426568 0.416602 0.75 781 63.546 0.0523125 -3.53751 63.546000 Cu 0.411981 0.391979 4.23764e-19 790 63.546 0.00989217 -3.53945 63.546000 Cu 0.426568 0.416602 0.25 791 63.546 0.0523125 -3.53751 63.546000 Cu 0.514645 0.396507 0.75 788 63.546 0.017184 -3.53822 63.546000 Cu 0.514645 0.396507 0.25 792 63.546 0.017184 -3.53822 63.546000 Cu 0.52909 0.420652 0.5 801 63.546 0.0871842 -3.53318 63.546000 Cu 0.61791 0.401834 0.5 809 63.546 0.00982148 -3.53891 63.546000 Cu 0.61791 0.401834 8.68886e-16 810 63.546 0.00982148 -3.53891 63.546000 Cu 0.52909 0.420652 6.31069e-16 812 63.546 0.0871842 -3.53318 63.546000 Cu 0.720615 0.406696 0.75 634 63.546 0.00339682 -3.53978 63.546000 Cu 0.808749 0.386852 0.75 638 63.546 0.00584998 -3.53923 63.546000 Cu 0.720615 0.406696 0.25 641 63.546 0.00339682 -3.53978 63.546000 Cu 0.808749 0.386852 0.25 642 63.546 0.00584998 -3.53923 63.546000 Cu 0.823324 0.411102 0.5 677 63.546 0.0278127 -3.53778 63.546000 Cu 0.823324 0.411102 5.87676e-16 688 63.546 0.0278127 -3.53778 63.546000 Cu 0.911981 0.391979 0.5 684 63.546 0.00989217 -3.53945 63.546000 Cu 0.911981 0.391979 3.15365e-16 685 63.546 0.00989217 -3.53945 63.546000 Cu 0.926568 0.416602 0.75 686 63.546 0.0523125 -3.53751 63.546000 Cu 0.926568 0.416602 0.25 690 63.546 0.0523125 -3.53751 63.546000 Cu 0.0429283 0.444539 0.75 734 63.546 0.399397 -3.50927 63.546000 Cu 0.132771 0.426541 0.75 735 63.546 0.0559471 -3.53612 63.546000 Cu 0.0429283 0.444539 0.25 738 63.546 0.399397 -3.50927 63.546000 Cu 0.132771 0.426541 0.25 745 63.546 0.0559471 -3.53612 63.546000 Cu 0.148767 0.451305 0.5 770 63.546 0.452805 -3.48041 63.546000 Cu 0.148767 0.451305 6.95058e-16 771 63.546 0.452805 -3.48041 63.546000 Cu 0.235394 0.431189 0.5 769 63.546 0.0133812 -3.53808 63.546000 Cu 0.248055 0.456064 0.75 773 63.546 0.138254 -3.50782 63.546000 Cu 0.235394 0.431189 9.1694e-16 782 63.546 0.0133812 -3.53808 63.546000 Cu 0.248055 0.456064 0.25 783 63.546 0.138254 -3.50782 63.546000 Cu 0.337109 0.435247 0.75 780 63.546 0.117167 -3.52902 63.546000 Cu 0.337109 0.435247 0.25 784 63.546 0.117167 -3.52902 63.546000 Cu 0.350656 0.458942 0.5 796 63.546 0.584021 -3.49452 63.546000 Cu 0.441256 0.441409 0.5 802 63.546 0.248216 -3.52291 63.546000 Cu 0.441256 0.441409 5.21569e-16 803 63.546 0.248216 -3.52291 63.546000 Cu 0.350656 0.458942 4.20374e-16 806 63.546 0.584021 -3.49452 63.546000 Cu 0.648767 0.451305 2.32901e-16 12 63.546 0.452805 -3.48041 63.546000 Cu 0.542928 0.444539 0.75 805 63.546 0.399397 -3.50927 63.546000 Cu 0.632771 0.426541 0.75 811 63.546 0.0559471 -3.53612 63.546000 Cu 0.542928 0.444539 0.25 813 63.546 0.399397 -3.50927 63.546000 Cu 0.632771 0.426541 0.25 814 63.546 0.0559471 -3.53612 63.546000 Cu 0.648767 0.451305 0.5 816 63.546 0.452805 -3.48041 63.546000 Cu 0.735394 0.431189 0.5 678 63.546 0.0133812 -3.53808 63.546000 Cu 0.735394 0.431189 7.26331e-16 679 63.546 0.0133812 -3.53808 63.546000 Cu 0.748055 0.456064 0.75 680 63.546 0.138254 -3.50782 63.546000 Cu 0.748055 0.456064 0.25 682 63.546 0.138254 -3.50782 63.546000 Cu 0.837109 0.435247 0.75 681 63.546 0.117167 -3.52902 63.546000 Cu 0.837109 0.435247 0.25 689 63.546 0.117167 -3.52902 63.546000 Cu 0.941256 0.441409 0.5 724 63.546 0.248216 -3.52291 63.546000 Cu 0.850656 0.458942 0.5 725 63.546 0.584021 -3.49452 63.546000 Cu 0.850656 0.458942 1 726 63.546 0.584021 -3.49452 63.546000 Cu 0.941256 0.441409 5.73522e-16 736 63.546 0.248216 -3.52291 63.546000 Cu 0.0585396 0.467709 0.5 765 63.546 6.43023 -3.46281 63.546000 Cu 0.041502 0.490149 0.75 768 63.546 9.48453 -3.45027 63.546000 Cu 0.153383 0.478797 0.75 772 63.546 6.48158 -3.41713 63.546000 Cu 0.0585396 0.467709 1 774 63.546 6.43023 -3.46281 63.546000 Cu 0.041502 0.490149 0.25 775 63.546 9.48453 -3.45027 63.546000 Cu 0.153383 0.478797 0.25 776 63.546 6.48158 -3.41713 63.546000 Cu 0.256175 0.480139 0.5 797 63.546 4.90514 -3.51072 63.546000 Cu 0.256175 0.480139 4.91058e-16 798 63.546 4.90514 -3.51072 63.546000 Cu 0.443323 0.494712 1.46792e-16 47 63.546 7.19287 -3.44728 63.546000 Cu 0.358172 0.48205 0.75 799 63.546 7.14838 -3.46931 63.546000 Cu 0.456184 0.466973 0.75 804 63.546 5.37336 -3.48438 63.546000 Cu 0.358172 0.48205 0.25 807 63.546 7.14838 -3.46931 63.546000 Cu 0.456184 0.466973 0.25 808 63.546 5.37336 -3.48438 63.546000 Cu 0.443323 0.494712 0.5 815 63.546 7.19287 -3.44728 63.546000 Cu 0.653383 0.478797 0.25 5 63.546 6.48158 -3.41713 63.546000 Cu 0.541502 0.490149 0.25 46 63.546 9.48453 -3.45027 63.546000 Cu 0.653383 0.478797 0.75 393 63.546 6.48158 -3.41713 63.546000 Cu 0.541502 0.490149 0.75 400 63.546 9.48453 -3.45027 63.546000 Cu 0.55854 0.467709 4.02762e-15 411 63.546 6.43023 -3.46281 63.546000 Cu 0.55854 0.467709 0.5 412 63.546 6.43023 -3.46281 63.546000 Cu 0.756175 0.480139 0.5 721 63.546 4.90514 -3.51072 63.546000 Cu 0.756175 0.480139 5.75895e-16 729 63.546 4.90514 -3.51072 63.546000 Cu 0.858172 0.48205 0.75 727 63.546 7.14838 -3.46931 63.546000 Cu 0.956184 0.466973 0.75 728 63.546 5.37336 -3.48438 63.546000 Cu 0.858172 0.48205 0.25 730 63.546 7.14838 -3.46931 63.546000 Cu 0.956184 0.466973 0.25 737 63.546 5.37336 -3.48438 63.546000 Cu 0.943323 0.494712 0.5 766 63.546 7.19287 -3.44728 63.546000 Cu 0.943323 0.494712 2.36511e-15 767 63.546 7.19287 -3.44728 63.546000 Cu 0.00948831 0.515946 0.75 6 63.546 5.99073 -3.48651 63.546000 Cu 0.100864 0.533166 0.75 10 63.546 0.200041 -3.51567 63.546000 Cu 0.00948831 0.515946 0.25 13 63.546 5.99073 -3.48651 63.546000 Cu 0.100864 0.533166 0.25 14 63.546 0.200041 -3.51567 63.546000 Cu 0.116275 0.50703 0.5 795 63.546 4.53826 -3.45553 63.546000 Cu 0.116275 0.50703 1.02051e-15 800 63.546 4.53826 -3.45553 63.546000 Cu 0.219838 0.503941 0.75 1 63.546 0.637358 -3.51636 63.546000 Cu 0.304388 0.526638 0.75 2 63.546 0.354588 -3.51335 63.546000 Cu 0.219838 0.503941 0.25 3 63.546 0.637358 -3.51636 63.546000 Cu 0.304388 0.526638 0.25 4 63.546 0.354588 -3.51335 63.546000 Cu 0.202277 0.528632 0.5 8 63.546 0.122889 -3.52556 63.546000 Cu 0.202277 0.528632 5.0233e-16 9 63.546 0.122889 -3.52556 63.546000 Cu 0.322322 0.503549 0.5 82 63.546 5.24882 -3.44838 63.546000 Cu 0.322322 0.503549 6.97515e-17 83 63.546 5.24882 -3.44838 63.546000 Cu 0.409555 0.521299 0.5 81 63.546 3.73461 -3.47163 63.546000 Cu 0.409555 0.521299 8.29137e-16 89 63.546 3.73461 -3.47163 63.546000 Cu 0.509488 0.515946 0.75 48 63.546 5.99073 -3.48651 63.546000 Cu 0.600864 0.533166 0.75 49 63.546 0.200041 -3.51567 63.546000 Cu 0.509488 0.515946 0.25 50 63.546 5.99073 -3.48651 63.546000 Cu 0.600864 0.533166 0.25 57 63.546 0.200041 -3.51567 63.546000 Cu 0.616275 0.50703 0.5 722 63.546 4.53826 -3.45553 63.546000 Cu 0.616275 0.50703 1.00347e-16 723 63.546 4.53826 -3.45553 63.546000 Cu 0.822322 0.503549 0.5 19 63.546 5.24882 -3.44838 63.546000 Cu 0.719838 0.503941 0.75 20 63.546 0.637358 -3.51636 63.546000 Cu 0.804388 0.526638 0.75 24 63.546 0.354588 -3.51335 63.546000 Cu 0.822322 0.503549 9.66606e-16 26 63.546 5.24882 -3.44838 63.546000 Cu 0.719838 0.503941 0.25 27 63.546 0.637358 -3.51636 63.546000 Cu 0.804388 0.526638 0.25 28 63.546 0.354588 -3.51335 63.546000 Cu 0.702277 0.528632 0.5 45 63.546 0.122889 -3.52556 63.546000 Cu 0.702277 0.528632 5.8454e-16 56 63.546 0.122889 -3.52556 63.546000 Cu 0.909555 0.521299 0.5 22 63.546 3.73461 -3.47163 63.546000 Cu 0.909555 0.521299 1.91796e-16 23 63.546 3.73461 -3.47163 63.546000 Cu 0.0873067 0.5585 0.5 30 63.546 0.0418879 -3.53318 63.546000 Cu 0.0873067 0.5585 8.56766e-16 31 63.546 0.0418879 -3.53318 63.546000 Cu 0.291057 0.5503 0.5 7 63.546 0.103362 -3.52728 63.546000 Cu 0.18889 0.553472 0.75 11 63.546 0.0575742 -3.53406 63.546000 Cu 0.277442 0.574279 0.75 15 63.546 0.0253785 -3.53545 63.546000 Cu 0.291057 0.5503 8.73632e-16 16 63.546 0.103362 -3.52728 63.546000 Cu 0.18889 0.553472 0.25 17 63.546 0.0575742 -3.53406 63.546000 Cu 0.277442 0.574279 0.25 18 63.546 0.0253785 -3.53545 63.546000 Cu 0.394746 0.54533 0.75 87 63.546 0.00324052 -3.53747 63.546000 Cu 0.483878 0.564466 0.75 88 63.546 0.014323 -3.53755 63.546000 Cu 0.394746 0.54533 0.25 90 63.546 0.00324052 -3.53747 63.546000 Cu 0.483878 0.564466 0.25 97 63.546 0.014323 -3.53755 63.546000 Cu 0.380595 0.569526 0.5 128 63.546 0.00167025 -3.53884 63.546000 Cu 0.380595 0.569526 7.89896e-16 129 63.546 0.00167025 -3.53884 63.546000 Cu 0.498396 0.540258 0.5 85 63.546 0.0812446 -3.53364 63.546000 Cu 0.498396 0.540258 5.9988e-16 86 63.546 0.0812446 -3.53364 63.546000 Cu 0.587307 0.5585 0.5 84 63.546 0.0418879 -3.53318 63.546000 Cu 0.587307 0.5585 5.36824e-16 96 63.546 0.0418879 -3.53318 63.546000 Cu 0.791057 0.5503 0.5 52 63.546 0.103362 -3.52728 63.546000 Cu 0.791057 0.5503 1 53 63.546 0.103362 -3.52728 63.546000 Cu 0.68889 0.553472 0.75 54 63.546 0.0575742 -3.53406 63.546000 Cu 0.777442 0.574279 0.75 55 63.546 0.0253785 -3.53545 63.546000 Cu 0.68889 0.553472 0.25 58 63.546 0.0575742 -3.53406 63.546000 Cu 0.777442 0.574279 0.25 65 63.546 0.0253785 -3.53545 63.546000 Cu 0.998396 0.540258 0.5 21 63.546 0.0812446 -3.53364 63.546000 Cu 0.998396 0.540258 6.59461e-16 34 63.546 0.0812446 -3.53364 63.546000 Cu 0.894746 0.54533 0.75 25 63.546 0.00324052 -3.53747 63.546000 Cu 0.983878 0.564466 0.75 32 63.546 0.014323 -3.53755 63.546000 Cu 0.894746 0.54533 0.25 35 63.546 0.00324052 -3.53747 63.546000 Cu 0.983878 0.564466 0.25 36 63.546 0.014323 -3.53755 63.546000 Cu 0.880595 0.569526 0.5 51 63.546 0.00167025 -3.53884 63.546000 Cu 0.880595 0.569526 3.92999e-16 64 63.546 0.00167025 -3.53884 63.546000 Cu 0.0727692 0.583269 0.75 33 63.546 0.0103336 -3.53876 63.546000 Cu 0.0727692 0.583269 0.25 42 63.546 0.0103336 -3.53876 63.546000 Cu 0.0583295 0.607883 0.5 59 63.546 0.00275898 -3.53965 63.546000 Cu 0.0583295 0.607883 3.39011e-19 72 63.546 0.00275898 -3.53965 63.546000 Cu 0.160991 0.602878 0.75 39 63.546 0.0071352 -3.53952 63.546000 Cu 0.160991 0.602878 0.25 43 63.546 0.0071352 -3.53952 63.546000 Cu 0.17521 0.578258 0.5 29 63.546 0.0196883 -3.5382 63.546000 Cu 0.263509 0.598497 0.5 37 63.546 0.00598993 -3.53862 63.546000 Cu 0.263509 0.598497 6.04626e-16 38 63.546 0.00598993 -3.53862 63.546000 Cu 0.17521 0.578258 4.697e-16 41 63.546 0.0196883 -3.5382 63.546000 Cu 0.469624 0.588786 0.5 127 63.546 0.00486564 -3.53901 63.546000 Cu 0.366473 0.593767 0.75 130 63.546 0.00125254 -3.53923 63.546000 Cu 0.455294 0.613123 0.75 134 63.546 0.00150616 -3.5395 63.546000 Cu 0.469624 0.588786 6.64716e-16 136 63.546 0.00486564 -3.53901 63.546000 Cu 0.366473 0.593767 0.25 137 63.546 0.00125254 -3.53923 63.546000 Cu 0.455294 0.613123 0.25 138 63.546 0.00150616 -3.5395 63.546000 Cu 0.572769 0.583269 0.75 94 63.546 0.0103336 -3.53876 63.546000 Cu 0.572769 0.583269 0.25 98 63.546 0.0103336 -3.53876 63.546000 Cu 0.558329 0.607883 0.5 132 63.546 0.00275898 -3.53965 63.546000 Cu 0.558329 0.607883 5.32417e-16 133 63.546 0.00275898 -3.53965 63.546000 Cu 0.660991 0.602878 0.75 95 63.546 0.0071352 -3.53952 63.546000 Cu 0.660991 0.602878 0.25 105 63.546 0.0071352 -3.53952 63.546000 Cu 0.763509 0.598497 0.5 91 63.546 0.00598993 -3.53862 63.546000 Cu 0.67521 0.578258 0.5 92 63.546 0.0196883 -3.5382 63.546000 Cu 0.67521 0.578258 6.13864e-16 93 63.546 0.0196883 -3.5382 63.546000 Cu 0.763509 0.598497 3.20366e-16 104 63.546 0.00598993 -3.53862 63.546000 Cu 0.969624 0.588786 0.5 60 63.546 0.00486564 -3.53901 63.546000 Cu 0.969624 0.588786 8.78886e-16 61 63.546 0.00486564 -3.53901 63.546000 Cu 0.866473 0.593767 0.75 62 63.546 0.00125254 -3.53923 63.546000 Cu 0.955294 0.613123 0.75 63 63.546 0.00150616 -3.5395 63.546000 Cu 0.866473 0.593767 0.25 66 63.546 0.00125254 -3.53923 63.546000 Cu 0.955294 0.613123 0.25 73 63.546 0.00150616 -3.5395 63.546000 Cu 0.146754 0.627423 0.5 68 63.546 0.00256744 -3.53985 63.546000 Cu 0.146754 0.627423 7.98541e-16 69 63.546 0.00256744 -3.53985 63.546000 Cu 0.0440137 0.632405 0.75 70 63.546 0.0007258 -3.53989 63.546000 Cu 0.132639 0.651913 0.75 71 63.546 0.000904718 -3.53992 63.546000 Cu 0.0440137 0.632405 0.25 74 63.546 0.0007258 -3.53989 63.546000 Cu 0.132639 0.651913 0.25 78 63.546 0.000904718 -3.53992 63.546000 Cu 0.249375 0.622807 0.75 40 63.546 0.00138042 -3.53943 63.546000 Cu 0.249375 0.622807 0.25 44 63.546 0.00138042 -3.53943 63.546000 Cu 0.235311 0.647173 0.5 67 63.546 0.000319538 -3.5397 63.546000 Cu 0.235311 0.647173 5.91151e-16 77 63.546 0.000319538 -3.5397 63.546000 Cu 0.352264 0.618063 0.5 171 63.546 0.000798622 -3.53951 63.546000 Cu 0.441046 0.637494 0.5 173 63.546 0.000640289 -3.53971 63.546000 Cu 0.441046 0.637494 4.33934e-17 174 63.546 0.000640289 -3.53971 63.546000 Cu 0.338111 0.642392 0.75 175 63.546 0.000363693 -3.53964 63.546000 Cu 0.352264 0.618063 5.57419e-16 177 63.546 0.000798622 -3.53951 63.546000 Cu 0.338111 0.642392 0.25 178 63.546 0.000363693 -3.53964 63.546000 Cu 0.646754 0.627423 0.5 131 63.546 0.00256744 -3.53985 63.546000 Cu 0.544014 0.632405 0.75 135 63.546 0.0007258 -3.53989 63.546000 Cu 0.632639 0.651913 0.75 142 63.546 0.000904718 -3.53992 63.546000 Cu 0.646754 0.627423 1.65776e-16 144 63.546 0.00256744 -3.53985 63.546000 Cu 0.544014 0.632405 0.25 145 63.546 0.0007258 -3.53989 63.546000 Cu 0.632639 0.651913 0.25 146 63.546 0.000904718 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0.676377 7.13873e-16 120 63.546 0.000288394 -3.53993 63.546000 Cu 0.0157838 0.681303 0.25 121 63.546 8.01837e-05 -3.5399 63.546000 Cu 0.221303 0.671566 0.75 75 63.546 7.94314e-05 -3.53981 63.546000 Cu 0.31009 0.691131 0.75 76 63.546 2.80164e-05 -3.53978 63.546000 Cu 0.221303 0.671566 0.25 79 63.546 7.94314e-05 -3.53981 63.546000 Cu 0.31009 0.691131 0.25 80 63.546 2.80164e-05 -3.53978 63.546000 Cu 0.324101 0.666749 0.5 218 63.546 0.000114842 -3.53974 63.546000 Cu 0.324101 0.666749 9.51774e-16 219 63.546 0.000114842 -3.53974 63.546000 Cu 0.426958 0.661869 0.75 176 63.546 0.000263754 -3.53977 63.546000 Cu 0.426958 0.661869 0.25 185 63.546 0.000263754 -3.53977 63.546000 Cu 0.412925 0.686255 0.5 217 63.546 0.000112134 -3.53981 63.546000 Cu 0.412925 0.686255 8.46341e-16 225 63.546 0.000112134 -3.53981 63.546000 Cu 0.529852 0.656866 0.5 172 63.546 0.00022919 -3.53992 63.546000 Cu 0.618565 0.676377 0.5 180 63.546 0.000288394 -3.53993 63.546000 Cu 0.618565 0.676377 1.10263e-16 181 63.546 0.000288394 -3.53993 63.546000 Cu 0.515784 0.681303 0.75 182 63.546 8.01837e-05 -3.5399 63.546000 Cu 0.529852 0.656866 1.58996e-16 184 63.546 0.00022919 -3.53992 63.546000 Cu 0.515784 0.681303 0.25 186 63.546 8.01837e-05 -3.5399 63.546000 Cu 0.824101 0.666749 0.5 139 63.546 0.000114842 -3.53974 63.546000 Cu 0.721303 0.671566 0.75 143 63.546 7.94314e-05 -3.53981 63.546000 Cu 0.81009 0.691131 0.75 150 63.546 2.80164e-05 -3.53978 63.546000 Cu 0.824101 0.666749 6.35222e-16 152 63.546 0.000114842 -3.53974 63.546000 Cu 0.721303 0.671566 0.25 153 63.546 7.94314e-05 -3.53981 63.546000 Cu 0.81009 0.691131 0.25 154 63.546 2.80164e-05 -3.53978 63.546000 Cu 0.926958 0.661869 0.75 110 63.546 0.000263754 -3.53977 63.546000 Cu 0.926958 0.661869 0.25 114 63.546 0.000263754 -3.53977 63.546000 Cu 0.912925 0.686255 0.5 148 63.546 0.000112134 -3.53981 63.546000 Cu 0.912925 0.686255 3.40791e-16 149 63.546 0.000112134 -3.53981 63.546000 Cu 0.104516 0.700818 0.75 118 63.546 9.58649e-05 -3.5399 63.546000 Cu 0.104516 0.700818 0.25 122 63.546 9.58649e-05 -3.5399 63.546000 Cu 0.00172697 0.705718 0.5 147 63.546 4.85798e-05 -3.53987 63.546000 Cu 0.0904943 0.725241 0.5 156 63.546 7.65346e-05 -3.5399 63.546000 Cu 0.0904943 0.725241 4.00626e-16 157 63.546 7.65346e-05 -3.5399 63.546000 Cu 0.00172697 0.705718 6.2217e-16 160 63.546 4.85798e-05 -3.53987 63.546000 Cu 0.296094 0.715516 0.5 115 63.546 2.75826e-05 -3.53982 63.546000 Cu 0.207267 0.69598 0.5 116 63.546 5.15982e-05 -3.53985 63.546000 Cu 0.207267 0.69598 5.8615e-16 117 63.546 5.15982e-05 -3.53985 63.546000 Cu 0.19328 0.720392 0.75 119 63.546 4.58229e-05 -3.53986 63.546000 Cu 0.296094 0.715516 2.36376e-16 124 63.546 2.75826e-05 -3.53982 63.546000 Cu 0.19328 0.720392 0.25 125 63.546 4.58229e-05 -3.53986 63.546000 Cu 0.398919 0.710652 0.75 223 63.546 0.000107932 -3.53984 63.546000 Cu 0.487667 0.730127 0.75 224 63.546 0.000105887 -3.53989 63.546000 Cu 0.398919 0.710652 0.25 226 63.546 0.000107932 -3.53984 63.546000 Cu 0.487667 0.730127 0.25 233 63.546 0.000105887 -3.53989 63.546000 Cu 0.604516 0.700818 0.75 183 63.546 9.58649e-05 -3.5399 63.546000 Cu 0.604516 0.700818 0.25 193 63.546 9.58649e-05 -3.5399 63.546000 Cu 0.590494 0.725241 0.5 220 63.546 7.65346e-05 -3.5399 63.546000 Cu 0.501727 0.705718 0.5 221 63.546 4.85798e-05 -3.53987 63.546000 Cu 0.501727 0.705718 2.03152e-16 222 63.546 4.85798e-05 -3.53987 63.546000 Cu 0.590494 0.725241 5.08517e-19 232 63.546 7.65346e-05 -3.5399 63.546000 Cu 0.707267 0.69598 0.5 179 63.546 5.15982e-05 -3.53985 63.546000 Cu 0.796094 0.715516 0.5 188 63.546 2.75826e-05 -3.53982 63.546000 Cu 0.796094 0.715516 3.25705e-16 189 63.546 2.75826e-05 -3.53982 63.546000 Cu 0.69328 0.720392 0.75 190 63.546 4.58229e-05 -3.53986 63.546000 Cu 0.707267 0.69598 4.45969e-16 192 63.546 5.15982e-05 -3.53985 63.546000 Cu 0.69328 0.720392 0.25 194 63.546 4.58229e-05 -3.53986 63.546000 Cu 0.898919 0.710652 0.75 151 63.546 0.000107932 -3.53984 63.546000 Cu 0.987667 0.730127 0.75 158 63.546 0.000105887 -3.53989 63.546000 Cu 0.898919 0.710652 0.25 161 63.546 0.000107932 -3.53984 63.546000 Cu 0.987667 0.730127 0.25 162 63.546 0.000105887 -3.53989 63.546000 Cu 0.0762663 0.749664 0.75 159 63.546 4.35875e-05 -3.53991 63.546000 Cu 0.0762663 0.749664 0.25 168 63.546 4.35875e-05 -3.53991 63.546000 Cu 0.164728 0.769208 0.75 165 63.546 6.08598e-05 -3.53992 63.546000 Cu 0.164728 0.769208 0.25 169 63.546 6.08598e-05 -3.53992 63.546000 Cu 0.281987 0.739923 0.75 123 63.546 5.68341e-05 -3.53988 63.546000 Cu 0.281987 0.739923 0.25 126 63.546 5.68341e-05 -3.53988 63.546000 Cu 0.179155 0.7448 0.5 155 63.546 0.000103713 -3.53987 63.546000 Cu 0.267656 0.764331 0.5 163 63.546 7.29949e-05 -3.53989 63.546000 Cu 0.267656 0.764331 6.12169e-16 164 63.546 7.29949e-05 -3.53989 63.546000 Cu 0.179155 0.7448 2.56208e-16 167 63.546 0.000103713 -3.53987 63.546000 Cu 0.473401 0.754554 0.5 263 63.546 3.85753e-05 -3.53992 63.546000 Cu 0.384798 0.735051 0.5 264 63.546 8.03377e-05 -3.53987 63.546000 Cu 0.384798 0.735051 7.81082e-16 265 63.546 8.03377e-05 -3.53987 63.546000 Cu 0.370546 0.759466 0.75 266 63.546 0.000104723 -3.53989 63.546000 Cu 0.473401 0.754554 3.274e-16 272 63.546 3.85753e-05 -3.53992 63.546000 Cu 0.370546 0.759466 0.25 273 63.546 0.000104723 -3.53989 63.546000 Cu 0.576266 0.749664 0.75 230 63.546 4.35875e-05 -3.53991 63.546000 Cu 0.576266 0.749664 0.25 234 63.546 4.35875e-05 -3.53991 63.546000 Cu 0.664728 0.769208 0.75 231 63.546 6.08598e-05 -3.53992 63.546000 Cu 0.664728 0.769208 0.25 241 63.546 6.08598e-05 -3.53992 63.546000 Cu 0.781987 0.739923 0.75 191 63.546 5.68341e-05 -3.53988 63.546000 Cu 0.781987 0.739923 0.25 201 63.546 5.68341e-05 -3.53988 63.546000 Cu 0.767656 0.764331 0.5 227 63.546 7.29949e-05 -3.53989 63.546000 Cu 0.679155 0.7448 0.5 228 63.546 0.000103713 -3.53987 63.546000 Cu 0.679155 0.7448 6.22509e-16 229 63.546 0.000103713 -3.53987 63.546000 Cu 0.767656 0.764331 1 240 63.546 7.29949e-05 -3.53989 63.546000 Cu 0.884798 0.735051 0.5 187 63.546 8.03377e-05 -3.53987 63.546000 Cu 0.973401 0.754554 0.5 196 63.546 3.85753e-05 -3.53992 63.546000 Cu 0.973401 0.754554 7.02431e-16 197 63.546 3.85753e-05 -3.53992 63.546000 Cu 0.870546 0.759466 0.75 198 63.546 0.000104723 -3.53989 63.546000 Cu 0.884798 0.735051 1.32214e-17 200 63.546 8.03377e-05 -3.53987 63.546000 Cu 0.870546 0.759466 0.25 202 63.546 0.000104723 -3.53989 63.546000 Cu 0.0618721 0.774087 0.5 195 63.546 8.56043e-05 -3.53994 63.546000 Cu 0.150136 0.793655 0.5 204 63.546 0.000101973 -3.53995 63.546000 Cu 0.150136 0.793655 2.87566e-16 205 63.546 0.000101973 -3.53995 63.546000 Cu 0.0472568 0.798533 0.75 206 63.546 0.000145842 -3.53994 63.546000 Cu 0.0618721 0.774087 2.95787e-16 208 63.546 8.56043e-05 -3.53994 63.546000 Cu 0.0472568 0.798533 0.25 210 63.546 0.000145842 -3.53994 63.546000 Cu 0.253064 0.788748 0.75 166 63.546 8.33271e-05 -3.53991 63.546000 Cu 0.253064 0.788748 0.25 170 63.546 8.33271e-05 -3.53991 63.546000 Cu 0.45901 0.778985 0.75 270 63.546 0.000144358 -3.53992 63.546000 Cu 0.45901 0.778985 0.25 274 63.546 0.000144358 -3.53992 63.546000 Cu 0.356042 0.783874 0.5 307 63.546 9.11054e-05 -3.53988 63.546000 Cu 0.444275 0.803415 0.5 309 63.546 9.11431e-05 -3.5399 63.546000 Cu 0.444275 0.803415 3.21044e-16 310 63.546 9.11431e-05 -3.5399 63.546000 Cu 0.356042 0.783874 6.91583e-16 313 63.546 9.11054e-05 -3.53988 63.546000 Cu 0.650136 0.793655 0.5 267 63.546 0.000101973 -3.53995 63.546000 Cu 0.561872 0.774087 0.5 268 63.546 8.56043e-05 -3.53994 63.546000 Cu 0.561872 0.774087 8.92193e-16 269 63.546 8.56043e-05 -3.53994 63.546000 Cu 0.547257 0.798533 0.75 271 63.546 0.000145842 -3.53994 63.546000 Cu 0.650136 0.793655 1.02483e-15 280 63.546 0.000101973 -3.53995 63.546000 Cu 0.547257 0.798533 0.25 281 63.546 0.000145842 -3.53994 63.546000 Cu 0.753064 0.788748 0.75 238 63.546 8.33271e-05 -3.53991 63.546000 Cu 0.753064 0.788748 0.25 242 63.546 8.33271e-05 -3.53991 63.546000 Cu 0.95901 0.778985 0.75 199 63.546 0.000144358 -3.53992 63.546000 Cu 0.95901 0.778985 0.25 209 63.546 0.000144358 -3.53992 63.546000 Cu 0.944275 0.803415 0.5 235 63.546 9.11431e-05 -3.5399 63.546000 Cu 0.856042 0.783874 0.5 236 63.546 9.11054e-05 -3.53988 63.546000 Cu 0.856042 0.783874 5.4852e-16 237 63.546 9.11054e-05 -3.53988 63.546000 Cu 0.944275 0.803415 3.39011e-19 248 63.546 9.11431e-05 -3.5399 63.546000 Cu 0.13528 0.818116 0.75 207 63.546 0.000206411 -3.53992 63.546000 Cu 0.13528 0.818116 0.25 214 63.546 0.000206411 -3.53992 63.546000 Cu 0.120182 0.84256 0.5 243 63.546 0.000315092 -3.5399 63.546000 Cu 0.0323051 0.822965 0.5 244 63.546 7.03678e-05 -3.53989 63.546000 Cu 0.0323051 0.822965 3.53843e-16 245 63.546 7.03678e-05 -3.53989 63.546000 Cu 0.120182 0.84256 5.09025e-16 256 63.546 0.000315092 -3.5399 63.546000 Cu 0.23825 0.813187 0.5 203 63.546 6.02067e-05 -3.5399 63.546000 Cu 0.22323 0.837624 0.75 211 63.546 2.28268e-05 -3.53986 63.546000 Cu 0.23825 0.813187 9.99235e-17 213 63.546 6.02067e-05 -3.5399 63.546000 Cu 0.22323 0.837624 0.25 215 63.546 2.28268e-05 -3.53986 63.546000 Cu 0.326257 0.832716 0.5 350 63.546 4.65897e-05 -3.53988 63.546000 Cu 0.326257 0.832716 9.76183e-16 351 63.546 4.65897e-05 -3.53988 63.546000 Cu 0.341247 0.80829 0.75 311 63.546 5.71062e-05 -3.53988 63.546000 Cu 0.429261 0.827842 0.75 312 63.546 1.26726e-05 -3.53989 63.546000 Cu 0.341247 0.80829 0.25 314 63.546 5.71062e-05 -3.53988 63.546000 Cu 0.429261 0.827842 0.25 321 63.546 1.26726e-05 -3.53989 63.546000 Cu 0.63528 0.818116 0.75 278 63.546 0.000206411 -3.53992 63.546000 Cu 0.63528 0.818116 0.25 282 63.546 0.000206411 -3.53992 63.546000 Cu 0.532305 0.822965 0.5 308 63.546 7.03678e-05 -3.53989 63.546000 Cu 0.620182 0.84256 0.5 316 63.546 0.000315092 -3.5399 63.546000 Cu 0.620182 0.84256 9.17788e-16 317 63.546 0.000315092 -3.5399 63.546000 Cu 0.532305 0.822965 9.6169e-16 320 63.546 7.03678e-05 -3.53989 63.546000 Cu 0.826257 0.832716 0.5 275 63.546 4.65897e-05 -3.53988 63.546000 Cu 0.73825 0.813187 0.5 276 63.546 6.02067e-05 -3.5399 63.546000 Cu 0.73825 0.813187 8.62275e-16 277 63.546 6.02067e-05 -3.5399 63.546000 Cu 0.72323 0.837624 0.75 279 63.546 2.28268e-05 -3.53986 63.546000 Cu 0.826257 0.832716 1.13569e-15 288 63.546 4.65897e-05 -3.53988 63.546000 Cu 0.72323 0.837624 0.25 289 63.546 2.28268e-05 -3.53986 63.546000 Cu 0.841247 0.80829 0.75 239 63.546 5.71062e-05 -3.53988 63.546000 Cu 0.929261 0.827842 0.75 246 63.546 1.26726e-05 -3.53989 63.546000 Cu 0.841247 0.80829 0.25 249 63.546 5.71062e-05 -3.53988 63.546000 Cu 0.929261 0.827842 0.25 250 63.546 1.26726e-05 -3.53989 63.546000 Cu 0.0172169 0.847372 0.75 247 63.546 0.000265779 -3.53986 63.546000 Cu 0.105111 0.867024 0.75 254 63.546 0.000855917 -3.53992 63.546000 Cu 0.0172169 0.847372 0.25 257 63.546 0.000265779 -3.53986 63.546000 Cu 0.105111 0.867024 0.25 258 63.546 0.000855917 -3.53992 63.546000 Cu 0.00214553 0.87177 0.5 283 63.546 0.00122389 -3.53976 63.546000 Cu 0.00214553 0.87177 1 296 63.546 0.00122389 -3.53976 63.546000 Cu 0.311148 0.857148 0.75 212 63.546 8.49164e-05 -3.53989 63.546000 Cu 0.311148 0.857148 0.25 216 63.546 8.49164e-05 -3.53989 63.546000 Cu 0.296061 0.881602 0.5 251 63.546 0.000102606 -3.53993 63.546000 Cu 0.208128 0.862074 0.5 252 63.546 1.57631e-05 -3.53987 63.546000 Cu 0.208128 0.862074 6.15136e-16 253 63.546 1.57631e-05 -3.53987 63.546000 Cu 0.296061 0.881602 2.35443e-16 260 63.546 0.000102606 -3.53993 63.546000 Cu 0.414176 0.852278 0.5 349 63.546 6.85964e-05 -3.53988 63.546000 Cu 0.399015 0.876729 0.75 355 63.546 0.000447058 -3.53985 63.546000 Cu 0.414176 0.852278 1.49504e-15 357 63.546 6.85964e-05 -3.53988 63.546000 Cu 0.399015 0.876729 0.25 358 63.546 0.000447058 -3.53985 63.546000 Cu 0.517217 0.847372 0.75 318 63.546 0.000265779 -3.53986 63.546000 Cu 0.605111 0.867024 0.75 319 63.546 0.000855917 -3.53992 63.546000 Cu 0.517217 0.847372 0.25 322 63.546 0.000265779 -3.53986 63.546000 Cu 0.605111 0.867024 0.25 329 63.546 0.000855917 -3.53992 63.546000 Cu 0.502146 0.87177 0.5 353 63.546 0.00122389 -3.53976 63.546000 Cu 0.502146 0.87177 3.95796e-16 354 63.546 0.00122389 -3.53976 63.546000 Cu 0.811148 0.857148 0.75 286 63.546 8.49164e-05 -3.53989 63.546000 Cu 0.811148 0.857148 0.25 290 63.546 8.49164e-05 -3.53989 63.546000 Cu 0.708128 0.862074 0.5 315 63.546 1.57631e-05 -3.53987 63.546000 Cu 0.796061 0.881602 0.5 324 63.546 0.000102606 -3.53993 63.546000 Cu 0.796061 0.881602 5.01991e-16 325 63.546 0.000102606 -3.53993 63.546000 Cu 0.708128 0.862074 4.23764e-19 328 63.546 1.57631e-05 -3.53987 63.546000 Cu 0.914176 0.852278 0.5 284 63.546 6.85964e-05 -3.53988 63.546000 Cu 0.914176 0.852278 1.00593e-15 285 63.546 6.85964e-05 -3.53988 63.546000 Cu 0.899015 0.876729 0.75 287 63.546 0.000447058 -3.53985 63.546000 Cu 0.899015 0.876729 0.25 297 63.546 0.000447058 -3.53985 63.546000 Cu 0.0900334 0.891502 0.5 292 63.546 0.00253544 -3.53989 63.546000 Cu 0.0900334 0.891502 5.70556e-16 293 63.546 0.00253544 -3.53989 63.546000 Cu 0.0750279 0.915997 0.75 295 63.546 0.00879697 -3.53958 63.546000 Cu 0.0750279 0.915997 0.25 304 63.546 0.00879697 -3.53958 63.546000 Cu 0.193087 0.886527 0.75 255 63.546 7.31034e-05 -3.53985 63.546000 Cu 0.28101 0.90606 0.75 259 63.546 0.000336593 -3.53995 63.546000 Cu 0.193087 0.886527 0.25 261 63.546 7.31034e-05 -3.53985 63.546000 Cu 0.28101 0.90606 0.25 262 63.546 0.000336593 -3.53995 63.546000 Cu 0.178134 0.910953 0.5 291 63.546 0.000685698 -3.53976 63.546000 Cu 0.178134 0.910953 1.24756e-16 303 63.546 0.000685698 -3.53976 63.546000 Cu 0.487141 0.896136 0.75 356 63.546 0.0050336 -3.53945 63.546000 Cu 0.487141 0.896136 0.25 365 63.546 0.0050336 -3.53945 63.546000 Cu 0.472315 0.920429 0.5 381 63.546 0.0213424 -3.53776 63.546000 Cu 0.383966 0.901216 0.5 382 63.546 0.00232787 -3.53971 63.546000 Cu 0.383966 0.901216 1.38825e-16 383 63.546 0.00232787 -3.53971 63.546000 Cu 0.472315 0.920429 1 390 63.546 0.0213424 -3.53776 63.546000 Cu 0.590033 0.891502 0.5 352 63.546 0.00253544 -3.53989 63.546000 Cu 0.575028 0.915997 0.75 362 63.546 0.00879697 -3.53958 63.546000 Cu 0.590033 0.891502 4.66479e-16 364 63.546 0.00253544 -3.53989 63.546000 Cu 0.575028 0.915997 0.25 366 63.546 0.00879697 -3.53958 63.546000 Cu 0.693087 0.886527 0.75 326 63.546 7.31034e-05 -3.53985 63.546000 Cu 0.78101 0.90606 0.75 327 63.546 0.000336593 -3.53995 63.546000 Cu 0.693087 0.886527 0.25 330 63.546 7.31034e-05 -3.53985 63.546000 Cu 0.78101 0.90606 0.25 337 63.546 0.000336593 -3.53995 63.546000 Cu 0.678134 0.910953 0.5 360 63.546 0.000685698 -3.53976 63.546000 Cu 0.678134 0.910953 1.1234e-15 361 63.546 0.000685698 -3.53976 63.546000 Cu 0.987141 0.896136 0.75 294 63.546 0.0050336 -3.53945 63.546000 Cu 0.987141 0.896136 0.25 298 63.546 0.0050336 -3.53945 63.546000 Cu 0.883966 0.901216 0.5 323 63.546 0.00232787 -3.53971 63.546000 Cu 0.972315 0.920429 0.5 332 63.546 0.0213424 -3.53776 63.546000 Cu 0.972315 0.920429 1.18027e-15 333 63.546 0.0213424 -3.53776 63.546000 Cu 0.883966 0.901216 2.08492e-16 336 63.546 0.00232787 -3.53971 63.546000 Cu 0.0602283 0.940613 0.5 331 63.546 0.0421367 -3.53867 63.546000 Cu 0.149159 0.959686 0.5 340 63.546 0.0334071 -3.53532 63.546000 Cu 0.149159 0.959686 4.87329e-17 341 63.546 0.0334071 -3.53532 63.546000 Cu 0.0602283 0.940613 1 344 63.546 0.0421367 -3.53867 63.546000 Cu 0.163342 0.935322 0.75 301 63.546 0.00571585 -3.53948 63.546000 Cu 0.163342 0.935322 0.25 305 63.546 0.00571585 -3.53948 63.546000 Cu 0.266263 0.930559 0.5 299 63.546 0.00142532 -3.53977 63.546000 Cu 0.266263 0.930559 9.58978e-16 300 63.546 0.00142532 -3.53977 63.546000 Cu 0.251596 0.954981 0.75 302 63.546 0.00652406 -3.53943 63.546000 Cu 0.251596 0.954981 0.25 306 63.546 0.00652406 -3.53943 63.546000 Cu 0.36882 0.925744 0.75 384 63.546 0.0132843 -3.53831 63.546000 Cu 0.457451 0.944512 0.75 388 63.546 0.107003 -3.53339 63.546000 Cu 0.36882 0.925744 0.25 391 63.546 0.0132843 -3.53831 63.546000 Cu 0.457451 0.944512 0.25 392 63.546 0.107003 -3.53339 63.546000 Cu 0.354249 0.950545 0.5 401 63.546 0.0784395 -3.53576 63.546000 Cu 0.354249 0.950545 3.44698e-15 407 63.546 0.0784395 -3.53576 63.546000 Cu 0.649159 0.959686 0.5 385 63.546 0.0334071 -3.53532 63.546000 Cu 0.560228 0.940613 0.5 386 63.546 0.0421367 -3.53867 63.546000 Cu 0.560228 0.940613 2.51385e-15 387 63.546 0.0421367 -3.53867 63.546000 Cu 0.649159 0.959686 5.79963e-16 397 63.546 0.0334071 -3.53532 63.546000 Cu 0.663342 0.935322 0.75 363 63.546 0.00571585 -3.53948 63.546000 Cu 0.663342 0.935322 0.25 373 63.546 0.00571585 -3.53948 63.546000 Cu 0.766263 0.930559 0.5 359 63.546 0.00142532 -3.53977 63.546000 Cu 0.751596 0.954981 0.75 370 63.546 0.00652406 -3.53943 63.546000 Cu 0.766263 0.930559 7.25738e-16 372 63.546 0.00142532 -3.53977 63.546000 Cu 0.751596 0.954981 0.25 374 63.546 0.00652406 -3.53943 63.546000 Cu 0.86882 0.925744 0.75 334 63.546 0.0132843 -3.53831 63.546000 Cu 0.957451 0.944512 0.75 335 63.546 0.107003 -3.53339 63.546000 Cu 0.86882 0.925744 0.25 338 63.546 0.0132843 -3.53831 63.546000 Cu 0.957451 0.944512 0.25 345 63.546 0.107003 -3.53339 63.546000 Cu 0.854249 0.950545 0.5 368 63.546 0.0784395 -3.53576 63.546000 Cu 0.854249 0.950545 1 369 63.546 0.0784395 -3.53576 63.546000 Cu 0.0445208 0.965214 0.75 342 63.546 0.240287 -3.50761 63.546000 Cu 0.131782 0.983436 0.75 343 63.546 6.93231 -3.45299 63.546000 Cu 0.0445208 0.965214 0.25 346 63.546 0.240287 -3.50761 63.546000 Cu 0.131782 0.983436 0.25 348 63.546 6.93231 -3.45299 63.546000 Cu 0.0343253 0.991788 0.5 375 63.546 3.21629 -3.42313 63.546000 Cu 0.0343253 0.991788 6.16322e-16 376 63.546 3.21629 -3.42313 63.546000 Cu 0.238184 0.979387 0.5 339 63.546 5.6225 -3.50975 63.546000 Cu 0.238184 0.979387 6.23704e-15 347 63.546 5.6225 -3.50975 63.546000 Cu 0.444309 0.968444 0.5 403 63.546 0.483607 -3.49548 63.546000 Cu 0.444309 0.968444 1 404 63.546 0.483607 -3.49548 63.546000 Cu 0.33889 0.975301 0.75 405 63.546 5.10029 -3.40933 63.546000 Cu 0.432057 0.991524 0.75 406 63.546 8.50911 -3.40334 63.546000 Cu 0.33889 0.975301 0.25 408 63.546 5.10029 -3.40933 63.546000 Cu 0.432057 0.991524 0.25 410 63.546 8.50911 -3.40334 63.546000 Cu 0.544521 0.965214 0.75 389 63.546 0.240287 -3.50761 63.546000 Cu 0.631782 0.983436 0.75 396 63.546 6.93231 -3.45299 63.546000 Cu 0.544521 0.965214 0.25 398 63.546 0.240287 -3.50761 63.546000 Cu 0.631782 0.983436 0.25 399 63.546 6.93231 -3.45299 63.546000 Cu 0.534325 0.991788 0.5 402 63.546 3.21629 -3.42313 63.546000 Cu 0.534325 0.991788 2.95016e-15 409 63.546 3.21629 -3.42313 63.546000 Cu 0.738184 0.979387 0.5 394 63.546 5.6225 -3.50975 63.546000 Cu 0.738184 0.979387 1 395 63.546 5.6225 -3.50975 63.546000 Cu 0.944309 0.968444 0.5 367 63.546 0.483607 -3.49548 63.546000 Cu 0.83889 0.975301 0.75 371 63.546 5.10029 -3.40933 63.546000 Cu 0.932057 0.991524 0.75 377 63.546 8.50911 -3.40334 63.546000 Cu 0.944309 0.968444 3.71529e-14 378 63.546 0.483607 -3.49548 63.546000 Cu 0.83889 0.975301 0.25 379 63.546 5.10029 -3.40933 63.546000 Cu 0.932057 0.991524 0.25 380 63.546 8.50911 -3.40334