Number of particles = 912 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.4023 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 94.5077 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.10165 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 0.0322673 0.0110544 0.75 707 63.546 6.69334 -3.44428 63.546000 Cu 0.0987996 0.0274099 6.93155e-16 711 63.546 0.0370596 -3.53277 63.546000 Cu 0.124316 0.000364827 1 715 63.546 9.0981 -3.36292 63.546000 Cu 0.0322673 0.0110544 0.25 716 63.546 6.69334 -3.44428 63.546000 Cu 0.0987996 0.0274099 0.5 717 63.546 0.0370596 -3.53277 63.546000 Cu 0.124316 0.000364827 0.5 718 63.546 9.0981 -3.36292 63.546000 Cu 0.189171 0.0181971 0.75 783 63.546 2.04023 -3.43031 63.546000 Cu 0.282314 0.0110553 1 791 63.546 6.68716 -3.44427 63.546000 Cu 0.189171 0.0181971 0.25 792 63.546 2.04023 -3.43031 63.546000 Cu 0.282314 0.0110553 0.5 794 63.546 6.68716 -3.44427 63.546000 Cu 0.374352 0.0003713 0.75 466 63.546 9.09189 -3.36297 63.546000 Cu 0.374352 0.0003713 0.25 467 63.546 9.09189 -3.36297 63.546000 Cu 0.439192 0.0182008 1 468 63.546 2.03877 -3.4304 63.546000 Cu 0.439192 0.0182008 0.5 470 63.546 2.03877 -3.4304 63.546000 Cu 0.348817 0.0274116 0.75 859 63.546 0.0370447 -3.53273 63.546000 Cu 0.348817 0.0274116 0.25 864 63.546 0.0370447 -3.53273 63.546000 Cu 0.532306 0.0110575 0.75 497 63.546 6.68985 -3.44438 63.546000 Cu 0.532306 0.0110575 0.25 498 63.546 6.68985 -3.44438 63.546000 Cu 0.598835 0.0274158 6.80064e-19 499 63.546 0.0376046 -3.5328 63.546000 Cu 0.624327 0.000363221 3.47172e-16 500 63.546 9.09677 -3.36288 63.546000 Cu 0.598835 0.0274158 0.5 503 63.546 0.0376046 -3.5328 63.546000 Cu 0.624327 0.000363221 0.5 504 63.546 9.09677 -3.36288 63.546000 Cu 0.689163 0.0182 0.75 555 63.546 2.04319 -3.4303 63.546000 Cu 0.689163 0.0182 0.25 556 63.546 2.04319 -3.4303 63.546000 Cu 0.782264 0.0110548 1.72855e-15 558 63.546 6.69155 -3.44434 63.546000 Cu 0.782264 0.0110548 0.5 562 63.546 6.69155 -3.44434 63.546000 Cu 0.874304 0.000360163 0.75 631 63.546 9.09859 -3.36289 63.546000 Cu 0.848799 0.0274121 0.75 632 63.546 0.0368502 -3.53282 63.546000 Cu 0.848799 0.0274121 0.25 633 63.546 0.0368502 -3.53282 63.546000 Cu 0.939146 0.0181995 6.93325e-16 635 63.546 2.04372 -3.43034 63.546000 Cu 0.874304 0.000360163 0.25 639 63.546 9.09859 -3.36289 63.546000 Cu 0.939146 0.0181995 0.5 640 63.546 2.04372 -3.43034 63.546000 Cu 0.00524104 0.0364262 0.75 708 63.546 0.0424311 -3.53265 63.546000 Cu 0.00524104 0.0364262 0.25 709 63.546 0.0424311 -3.53265 63.546000 Cu 0.0718413 0.0535341 4.08208e-16 710 63.546 0.00327573 -3.53949 63.546000 Cu 0.0718413 0.0535341 0.5 714 63.546 0.00327573 -3.53949 63.546000 Cu 0.164056 0.0447095 0.75 784 63.546 0.0108626 -3.53895 63.546000 Cu 0.164056 0.0447095 0.25 785 63.546 0.0108626 -3.53895 63.546000 Cu 0.229577 0.0624305 4.19259e-16 786 63.546 0.00543873 -3.53906 63.546000 Cu 0.255232 0.0364211 6.93665e-16 787 63.546 0.0424128 -3.53266 63.546000 Cu 0.229577 0.0624305 0.5 790 63.546 0.00543873 -3.53906 63.546000 Cu 0.255232 0.0364211 0.5 793 63.546 0.0424128 -3.53266 63.546000 Cu 0.321847 0.0535285 0.75 860 63.546 0.0033848 -3.53948 63.546000 Cu 0.321847 0.0535285 0.25 861 63.546 0.0033848 -3.53948 63.546000 Cu 0.414081 0.0447081 3.46322e-16 464 63.546 0.0110775 -3.53895 63.546000 Cu 0.414081 0.0447081 0.5 469 63.546 0.0110775 -3.53895 63.546000 Cu 0.479594 0.0624341 0.75 490 63.546 0.00546137 -3.53904 63.546000 Cu 0.479594 0.0624341 0.25 491 63.546 0.00546137 -3.53904 63.546000 Cu 0.505274 0.0364288 0.75 489 63.546 0.0424069 -3.53266 63.546000 Cu 0.571877 0.0535375 1 493 63.546 0.00327441 -3.53947 63.546000 Cu 0.505274 0.0364288 0.25 501 63.546 0.0424069 -3.53266 63.546000 Cu 0.571877 0.0535375 0.5 502 63.546 0.00327441 -3.53947 63.546000 Cu 0.664111 0.0447199 0.75 547 63.546 0.0109041 -3.53895 63.546000 Cu 0.664111 0.0447199 0.25 559 63.546 0.0109041 -3.53895 63.546000 Cu 0.729627 0.0624419 5.10048e-19 551 63.546 0.00549072 -3.53906 63.546000 Cu 0.755283 0.036432 4.3184e-17 557 63.546 0.0422348 -3.53266 63.546000 Cu 0.729627 0.0624419 0.5 560 63.546 0.00549072 -3.53906 63.546000 Cu 0.755283 0.036432 0.5 561 63.546 0.0422348 -3.53266 63.546000 Cu 0.82189 0.0535429 0.75 623 63.546 0.0031742 -3.5395 63.546000 Cu 0.82189 0.0535429 0.25 636 63.546 0.0031742 -3.5395 63.546000 Cu 0.914071 0.0447139 1 634 63.546 0.0108709 -3.53896 63.546000 Cu 0.914071 0.0447139 0.5 638 63.546 0.0108709 -3.53896 63.546000 Cu 0.979596 0.0624368 0.75 699 63.546 0.00536746 -3.53907 63.546000 Cu 0.979596 0.0624368 0.25 712 63.546 0.00536746 -3.53907 63.546000 Cu 0.0456026 0.0797706 1.74436e-16 703 63.546 0.000344323 -3.53978 63.546000 Cu 0.0456026 0.0797706 0.5 713 63.546 0.000344323 -3.53978 63.546000 Cu 0.137606 0.0709841 0.75 775 63.546 0.00119002 -3.53991 63.546000 Cu 0.111363 0.0972179 0.75 776 63.546 0.000129475 -3.53988 63.546000 Cu 0.111363 0.0972179 0.25 777 63.546 0.000129475 -3.53988 63.546000 Cu 0.137606 0.0709841 0.25 788 63.546 0.00119002 -3.53991 63.546000 Cu 0.203385 0.0885352 8.66911e-16 779 63.546 0.000546742 -3.53968 63.546000 Cu 0.203385 0.0885352 0.5 789 63.546 0.000546742 -3.53968 63.546000 Cu 0.295584 0.0797616 0.75 851 63.546 0.000366035 -3.53976 63.546000 Cu 0.295584 0.0797616 0.25 862 63.546 0.000366035 -3.53976 63.546000 Cu 0.387614 0.0709846 4.52242e-17 463 63.546 0.00110497 -3.53991 63.546000 Cu 0.387614 0.0709846 0.5 465 63.546 0.00110497 -3.53991 63.546000 Cu 0.453388 0.0885314 0.75 481 63.546 0.000505756 -3.53965 63.546000 Cu 0.453388 0.0885314 0.25 494 63.546 0.000505756 -3.53965 63.546000 Cu 0.361328 0.0972105 1 855 63.546 0.000102915 -3.53987 63.546000 Cu 0.361328 0.0972105 0.5 863 63.546 0.000102915 -3.53987 63.546000 Cu 0.545592 0.0797656 8.5518e-16 492 63.546 0.000352137 -3.53975 63.546000 Cu 0.545592 0.0797656 0.5 496 63.546 0.000352137 -3.53975 63.546000 Cu 0.611316 0.0972086 0.75 539 63.546 0.000132556 -3.53985 63.546000 Cu 0.637632 0.0709899 0.75 548 63.546 0.00112806 -3.5399 63.546000 Cu 0.637632 0.0709899 0.25 549 63.546 0.00112806 -3.5399 63.546000 Cu 0.611316 0.0972086 0.25 552 63.546 0.000132556 -3.53985 63.546000 Cu 0.703393 0.0885378 1 550 63.546 0.000544742 -3.53965 63.546000 Cu 0.703393 0.0885378 0.5 554 63.546 0.000544742 -3.53965 63.546000 Cu 0.795622 0.0797712 0.75 624 63.546 0.000378323 -3.53975 63.546000 Cu 0.795622 0.0797712 0.25 625 63.546 0.000378323 -3.53975 63.546000 Cu 0.86136 0.0972175 8.12166e-16 626 63.546 0.000129891 -3.53985 63.546000 Cu 0.887657 0.070995 1 627 63.546 0.00106499 -3.5399 63.546000 Cu 0.86136 0.0972175 0.5 630 63.546 0.000129891 -3.53985 63.546000 Cu 0.887657 0.070995 0.5 637 63.546 0.00106499 -3.5399 63.546000 Cu 0.953433 0.0885444 0.75 700 63.546 0.000549737 -3.53967 63.546000 Cu 0.953433 0.0885444 0.25 701 63.546 0.000549737 -3.53967 63.546000 Cu 0.0192607 0.105962 1.53694e-16 702 63.546 7.41325e-05 -3.53977 63.546000 Cu 0.0192607 0.105962 0.5 706 63.546 7.41325e-05 -3.53977 63.546000 Cu 0.0849539 0.123415 0.75 767 63.546 1.83608e-05 -3.5398 63.546000 Cu 0.0849539 0.123415 0.25 780 63.546 1.83608e-05 -3.5398 63.546000 Cu 0.177073 0.114704 1 778 63.546 7.95895e-05 -3.53977 63.546000 Cu 0.177073 0.114704 0.5 782 63.546 7.95895e-05 -3.53977 63.546000 Cu 0.242797 0.132141 0.75 843 63.546 7.11161e-06 -3.53979 63.546000 Cu 0.269229 0.105953 0.75 852 63.546 5.19924e-05 -3.5398 63.546000 Cu 0.269229 0.105953 0.25 853 63.546 5.19924e-05 -3.5398 63.546000 Cu 0.242797 0.132141 0.25 856 63.546 7.11161e-06 -3.53979 63.546000 Cu 0.334936 0.123408 9.5889e-17 854 63.546 7.87019e-06 -3.53983 63.546000 Cu 0.334936 0.123408 0.5 858 63.546 7.87019e-06 -3.53983 63.546000 Cu 0.427026 0.114689 0.75 482 63.546 4.94441e-05 -3.53977 63.546000 Cu 0.427026 0.114689 0.25 483 63.546 4.94441e-05 -3.53977 63.546000 Cu 0.492744 0.132127 1.74266e-16 484 63.546 2.21907e-05 -3.5398 63.546000 Cu 0.492744 0.132127 0.5 488 63.546 2.21907e-05 -3.5398 63.546000 Cu 0.519195 0.105948 1 485 63.546 3.91229e-05 -3.53978 63.546000 Cu 0.519195 0.105948 0.5 495 63.546 3.91229e-05 -3.53978 63.546000 Cu 0.58489 0.123399 0.75 540 63.546 1.54511e-05 -3.53982 63.546000 Cu 0.58489 0.123399 0.25 541 63.546 1.54511e-05 -3.53982 63.546000 Cu 0.676983 0.114693 3.47002e-16 543 63.546 8.78045e-05 -3.53975 63.546000 Cu 0.676983 0.114693 0.5 553 63.546 8.78045e-05 -3.53975 63.546000 Cu 0.769209 0.105955 0.75 615 63.546 5.6702e-05 -3.53976 63.546000 Cu 0.742685 0.132127 0.75 616 63.546 4.24966e-05 -3.53978 63.546000 Cu 0.742685 0.132127 0.25 617 63.546 4.24966e-05 -3.53978 63.546000 Cu 0.769209 0.105955 0.25 628 63.546 5.6702e-05 -3.53976 63.546000 Cu 0.834887 0.123408 1.73926e-16 619 63.546 8.42936e-06 -3.53979 63.546000 Cu 0.834887 0.123408 0.5 629 63.546 8.42936e-06 -3.53979 63.546000 Cu 0.92704 0.1147 0.75 691 63.546 6.9583e-05 -3.53974 63.546000 Cu 0.992746 0.132133 1 695 63.546 1.58434e-05 -3.53975 63.546000 Cu 0.92704 0.1147 0.25 704 63.546 6.9583e-05 -3.53974 63.546000 Cu 0.992746 0.132133 0.5 705 63.546 1.58434e-05 -3.53975 63.546000 Cu 0.0584564 0.149588 0.75 768 63.546 1.91105e-05 -3.53979 63.546000 Cu 0.0584564 0.149588 0.25 769 63.546 1.91105e-05 -3.53979 63.546000 Cu 0.124247 0.167041 4.60233e-16 770 63.546 8.38578e-06 -3.5398 63.546000 Cu 0.150644 0.140873 6.93155e-16 771 63.546 1.31453e-05 -3.53977 63.546000 Cu 0.124247 0.167041 0.5 774 63.546 8.38578e-06 -3.5398 63.546000 Cu 0.150644 0.140873 0.5 781 63.546 1.31453e-05 -3.53977 63.546000 Cu 0.216408 0.158326 0.75 844 63.546 1.36798e-05 -3.5398 63.546000 Cu 0.216408 0.158326 0.25 845 63.546 1.36798e-05 -3.5398 63.546000 Cu 0.308517 0.149596 3.47683e-16 847 63.546 1.43251e-05 -3.53982 63.546000 Cu 0.308517 0.149596 0.5 857 63.546 1.43251e-05 -3.53982 63.546000 Cu 0.400634 0.14087 0.75 474 63.546 1.49342e-05 -3.53981 63.546000 Cu 0.374315 0.167058 0.75 475 63.546 1.47685e-05 -3.53982 63.546000 Cu 0.374315 0.167058 0.25 476 63.546 1.47685e-05 -3.53982 63.546000 Cu 0.466414 0.158327 1.74266e-16 478 63.546 1.28294e-05 -3.53983 63.546000 Cu 0.400634 0.14087 0.25 486 63.546 1.49342e-05 -3.53981 63.546000 Cu 0.466414 0.158327 0.5 487 63.546 1.28294e-05 -3.53983 63.546000 Cu 0.558468 0.149584 0.75 531 63.546 3.82358e-05 -3.53984 63.546000 Cu 0.624258 0.167045 8.50079e-19 535 63.546 2.7301e-05 -3.53984 63.546000 Cu 0.650578 0.140866 1.95518e-17 542 63.546 2.24191e-05 -3.5398 63.546000 Cu 0.558468 0.149584 0.25 544 63.546 3.82358e-05 -3.53984 63.546000 Cu 0.624258 0.167045 0.5 545 63.546 2.7301e-05 -3.53984 63.546000 Cu 0.650578 0.140866 0.5 546 63.546 2.24191e-05 -3.5398 63.546000 Cu 0.716341 0.158316 0.75 607 63.546 1.07439e-05 -3.53983 63.546000 Cu 0.808387 0.149579 3.55673e-16 618 63.546 6.22228e-05 -3.53981 63.546000 Cu 0.716341 0.158316 0.25 620 63.546 1.07439e-05 -3.53983 63.546000 Cu 0.808387 0.149579 0.5 622 63.546 6.22228e-05 -3.53981 63.546000 Cu 0.874176 0.167037 0.75 683 63.546 3.86401e-05 -3.53983 63.546000 Cu 0.900554 0.140863 0.75 692 63.546 2.1267e-05 -3.53976 63.546000 Cu 0.900554 0.140863 0.25 693 63.546 2.1267e-05 -3.53976 63.546000 Cu 0.966315 0.158309 4.2555e-16 694 63.546 1.36341e-05 -3.5398 63.546000 Cu 0.874176 0.167037 0.25 696 63.546 3.86401e-05 -3.53983 63.546000 Cu 0.966315 0.158309 0.5 698 63.546 1.36341e-05 -3.5398 63.546000 Cu 0.0320983 0.17576 0.75 759 63.546 3.69295e-05 -3.53982 63.546000 Cu 0.00591483 0.201957 0.75 760 63.546 2.06023e-06 -3.53986 63.546000 Cu 0.0979451 0.19322 1.73586e-16 763 63.546 2.72033e-05 -3.53984 63.546000 Cu 0.0320983 0.17576 0.25 772 63.546 3.69295e-05 -3.53982 63.546000 Cu 0.0979451 0.19322 0.5 773 63.546 2.72033e-05 -3.53984 63.546000 Cu 0.00591483 0.201957 0.25 761 63.546 2.06023e-06 -3.53986 63.546000 Cu 0.190078 0.184494 0.75 835 63.546 5.95445e-06 -3.53981 63.546000 Cu 0.255947 0.201949 8.50079e-19 839 63.546 6.741e-06 -3.53981 63.546000 Cu 0.282209 0.175773 2.36152e-16 846 63.546 1.01925e-05 -3.53981 63.546000 Cu 0.190078 0.184494 0.25 848 63.546 5.95445e-06 -3.53981 63.546000 Cu 0.255947 0.201949 0.5 849 63.546 6.741e-06 -3.53981 63.546000 Cu 0.282209 0.175773 0.5 850 63.546 1.01925e-05 -3.53981 63.546000 Cu 0.440178 0.184511 2.01469e-16 477 63.546 4.98791e-06 -3.53983 63.546000 Cu 0.440178 0.184511 0.5 480 63.546 4.98791e-06 -3.53983 63.546000 Cu 0.348071 0.193234 0.75 901 63.546 3.0273e-06 -3.53981 63.546000 Cu 0.348071 0.193234 0.25 906 63.546 3.0273e-06 -3.53981 63.546000 Cu 0.506056 0.201969 0.75 523 63.546 1.20981e-05 -3.53982 63.546000 Cu 0.532225 0.175783 0.75 532 63.546 1.22341e-05 -3.53985 63.546000 Cu 0.532225 0.175783 0.25 533 63.546 1.22341e-05 -3.53985 63.546000 Cu 0.598107 0.193244 1 534 63.546 1.00565e-05 -3.53985 63.546000 Cu 0.506056 0.201969 0.25 536 63.546 1.20981e-05 -3.53982 63.546000 Cu 0.598107 0.193244 0.5 538 63.546 1.00565e-05 -3.53985 63.546000 Cu 0.690121 0.184502 0.75 608 63.546 7.93523e-06 -3.53986 63.546000 Cu 0.690121 0.184502 0.25 609 63.546 7.93523e-06 -3.53986 63.546000 Cu 0.756019 0.201968 1 610 63.546 1.62097e-05 -3.53986 63.546000 Cu 0.782124 0.175768 1.73926e-16 611 63.546 2.93628e-05 -3.53985 63.546000 Cu 0.756019 0.201968 0.5 614 63.546 1.62097e-05 -3.53986 63.546000 Cu 0.782124 0.175768 0.5 621 63.546 2.93628e-05 -3.53985 63.546000 Cu 0.847997 0.193237 0.75 684 63.546 7.06894e-06 -3.53987 63.546000 Cu 0.847997 0.193237 0.25 685 63.546 7.06894e-06 -3.53987 63.546000 Cu 0.940031 0.184495 3.46832e-16 687 63.546 1.33019e-05 -3.53986 63.546000 Cu 0.940031 0.184495 0.5 697 63.546 1.33019e-05 -3.53986 63.546000 Cu 0.0717771 0.219424 3.31531e-17 762 63.546 6.3184e-06 -3.53986 63.546000 Cu 0.0717771 0.219424 0.5 766 63.546 6.3184e-06 -3.53986 63.546000 Cu 0.137652 0.236883 0.75 827 63.546 6.19315e-06 -3.53985 63.546000 Cu 0.163795 0.210681 0.75 836 63.546 3.62505e-05 -3.53984 63.546000 Cu 0.163795 0.210681 0.25 837 63.546 3.62505e-05 -3.53984 63.546000 Cu 0.137652 0.236883 0.25 840 63.546 6.19315e-06 -3.53985 63.546000 Cu 0.22968 0.22813 1 838 63.546 5.12413e-05 -3.53984 63.546000 Cu 0.22968 0.22813 0.5 842 63.546 5.12413e-05 -3.53984 63.546000 Cu 0.321806 0.219409 0.75 902 63.546 1.74651e-06 -3.53981 63.546000 Cu 0.321806 0.219409 0.25 903 63.546 1.74651e-06 -3.53981 63.546000 Cu 0.387656 0.236862 1 471 63.546 9.20241e-06 -3.53981 63.546000 Cu 0.413936 0.210688 1.73926e-16 472 63.546 1.19841e-06 -3.53981 63.546000 Cu 0.387656 0.236862 0.5 473 63.546 9.20241e-06 -3.53981 63.546000 Cu 0.413936 0.210688 0.5 479 63.546 1.19841e-06 -3.53981 63.546000 Cu 0.479798 0.228139 0.75 524 63.546 1.9032e-05 -3.53981 63.546000 Cu 0.479798 0.228139 0.25 525 63.546 1.9032e-05 -3.53981 63.546000 Cu 0.571909 0.219428 6.80064e-19 527 63.546 1.67684e-05 -3.53983 63.546000 Cu 0.571909 0.219428 0.5 537 63.546 1.67684e-05 -3.53983 63.546000 Cu 0.663969 0.210704 0.75 599 63.546 1.01913e-05 -3.53985 63.546000 Cu 0.637723 0.236892 0.75 600 63.546 1.78657e-05 -3.53982 63.546000 Cu 0.637723 0.236892 0.25 601 63.546 1.78657e-05 -3.53982 63.546000 Cu 0.663969 0.210704 0.25 612 63.546 1.01913e-05 -3.53985 63.546000 Cu 0.729805 0.22816 3.46832e-16 603 63.546 1.33059e-05 -3.53985 63.546000 Cu 0.729805 0.22816 0.5 613 63.546 1.33059e-05 -3.53985 63.546000 Cu 0.821862 0.21944 0.75 675 63.546 2.23631e-05 -3.53986 63.546000 Cu 0.821862 0.21944 0.25 688 63.546 2.23631e-05 -3.53986 63.546000 Cu 0.887674 0.236904 8.66231e-16 679 63.546 1.69558e-05 -3.53984 63.546000 Cu 0.913861 0.210701 1 686 63.546 5.04486e-06 -3.53987 63.546000 Cu 0.887674 0.236904 0.5 689 63.546 1.69558e-05 -3.53984 63.546000 Cu 0.913861 0.210701 0.5 690 63.546 5.04486e-06 -3.53987 63.546000 Cu 0.97972 0.228155 0.75 751 63.546 1.13647e-05 -3.53986 63.546000 Cu 0.97972 0.228155 0.25 764 63.546 1.13647e-05 -3.53986 63.546000 Cu 0.0194719 0.271827 1.73756e-16 754 63.546 1.86862e-05 -3.53985 63.546000 Cu 0.0455882 0.245623 1.73756e-16 755 63.546 1.07539e-05 -3.53986 63.546000 Cu 0.0194719 0.271827 0.5 758 63.546 1.86862e-05 -3.53985 63.546000 Cu 0.0455882 0.245623 0.5 765 63.546 1.07539e-05 -3.53986 63.546000 Cu 0.111529 0.26308 0.75 828 63.546 2.23379e-05 -3.53986 63.546000 Cu 0.111529 0.26308 0.25 829 63.546 2.23379e-05 -3.53986 63.546000 Cu 0.203555 0.254342 3.46322e-16 831 63.546 1.28909e-05 -3.53988 63.546000 Cu 0.203555 0.254342 0.5 841 63.546 1.28909e-05 -3.53988 63.546000 Cu 0.295544 0.245593 0.75 893 63.546 4.2278e-05 -3.53986 63.546000 Cu 0.269401 0.271816 0.75 894 63.546 2.33675e-05 -3.53988 63.546000 Cu 0.269401 0.271816 0.25 895 63.546 2.33675e-05 -3.53988 63.546000 Cu 0.295544 0.245593 0.25 904 63.546 4.2278e-05 -3.53986 63.546000 Cu 0.453461 0.254324 0.75 515 63.546 1.12433e-05 -3.53985 63.546000 Cu 0.453461 0.254324 0.25 528 63.546 1.12433e-05 -3.53985 63.546000 Cu 0.361396 0.263056 3.46492e-16 897 63.546 3.00574e-05 -3.53987 63.546000 Cu 0.361396 0.263056 0.5 905 63.546 3.00574e-05 -3.53987 63.546000 Cu 0.519265 0.271791 1.44003e-16 519 63.546 2.70898e-05 -3.53983 63.546000 Cu 0.545583 0.245603 3.40032e-19 526 63.546 3.74692e-06 -3.53982 63.546000 Cu 0.519265 0.271791 0.5 529 63.546 2.70898e-05 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6.10357e-17 823 63.546 5.63797e-06 -3.53989 63.546000 Cu 0.0853352 0.289289 0.25 832 63.546 6.51814e-06 -3.53987 63.546000 Cu 0.151152 0.306762 0.5 833 63.546 5.63797e-06 -3.53989 63.546000 Cu 0.177369 0.280553 1.73416e-16 830 63.546 3.83542e-06 -3.53988 63.546000 Cu 0.177369 0.280553 0.5 834 63.546 3.83542e-06 -3.53988 63.546000 Cu 0.243152 0.298022 0.75 885 63.546 1.30094e-05 -3.53987 63.546000 Cu 0.243152 0.298022 0.25 898 63.546 1.30094e-05 -3.53987 63.546000 Cu 0.33519 0.289278 3.46662e-16 896 63.546 9.63062e-06 -3.53987 63.546000 Cu 0.33519 0.289278 0.5 900 63.546 9.63062e-06 -3.53987 63.546000 Cu 0.401042 0.306732 0.75 508 63.546 2.66092e-06 -3.53985 63.546000 Cu 0.427203 0.280526 0.75 516 63.546 2.25376e-05 -3.53986 63.546000 Cu 0.427203 0.280526 0.25 517 63.546 2.25376e-05 -3.53986 63.546000 Cu 0.493082 0.29798 8.67081e-18 518 63.546 7.17187e-06 -3.53984 63.546000 Cu 0.401042 0.306732 0.25 520 63.546 2.66092e-06 -3.53985 63.546000 Cu 0.493082 0.29798 0.5 522 63.546 7.17187e-06 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0.25 756 63.546 6.50936e-06 -3.53985 63.546000 Cu 0.993271 0.298019 0.5 757 63.546 3.68262e-06 -3.53986 63.546000 Cu 0.0329879 0.341691 0.75 811 63.546 7.5424e-06 -3.53986 63.546000 Cu 0.0591432 0.315492 0.75 820 63.546 3.47835e-06 -3.53988 63.546000 Cu 0.0591432 0.315492 0.25 821 63.546 3.47835e-06 -3.53988 63.546000 Cu 0.124992 0.332973 2.0963e-16 822 63.546 1.51565e-05 -3.53988 63.546000 Cu 0.0329879 0.341691 0.25 824 63.546 7.5424e-06 -3.53986 63.546000 Cu 0.124992 0.332973 0.5 826 63.546 1.51565e-05 -3.53988 63.546000 Cu 0.217001 0.324228 0.75 886 63.546 6.70057e-06 -3.53988 63.546000 Cu 0.217001 0.324228 0.25 887 63.546 6.70057e-06 -3.53988 63.546000 Cu 0.282784 0.341694 2.36152e-16 888 63.546 2.05994e-05 -3.53988 63.546000 Cu 0.309009 0.315484 8.5858e-17 889 63.546 8.037e-06 -3.53987 63.546000 Cu 0.282784 0.341694 0.5 892 63.546 2.05994e-05 -3.53988 63.546000 Cu 0.309009 0.315484 0.5 899 63.546 8.037e-06 -3.53987 63.546000 Cu 0.37482 0.332934 0.75 509 63.546 3.4023e-06 -3.53984 63.546000 Cu 0.37482 0.332934 0.25 510 63.546 3.4023e-06 -3.53984 63.546000 Cu 0.466893 0.32418 1.73586e-16 512 63.546 1.26082e-05 -3.53982 63.546000 Cu 0.466893 0.32418 0.5 521 63.546 1.26082e-05 -3.53982 63.546000 Cu 0.558993 0.315431 0.75 583 63.546 1.46159e-05 -3.53982 63.546000 Cu 0.532702 0.341611 0.75 584 63.546 2.96003e-05 -3.53977 63.546000 Cu 0.532702 0.341611 0.25 585 63.546 2.96003e-05 -3.53977 63.546000 Cu 0.624864 0.332874 3.46322e-16 587 63.546 1.3097e-05 -3.53978 63.546000 Cu 0.558993 0.315431 0.25 596 63.546 1.46159e-05 -3.53982 63.546000 Cu 0.624864 0.332874 0.5 597 63.546 1.3097e-05 -3.53978 63.546000 Cu 0.717002 0.32415 0.75 659 63.546 7.01794e-06 -3.53979 63.546000 Cu 0.782881 0.341603 6.80064e-19 663 63.546 1.76984e-05 -3.53979 63.546000 Cu 0.809145 0.31544 7.32769e-17 670 63.546 1.23108e-05 -3.53981 63.546000 Cu 0.717002 0.32415 0.25 672 63.546 7.01794e-06 -3.53979 63.546000 Cu 0.782881 0.341603 0.5 673 63.546 1.76984e-05 -3.53979 63.546000 Cu 0.809145 0.31544 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63.546000 Cu 0.586684 0.455147 0.75 644 63.546 0.0103425 -3.53826 63.546000 Cu 0.586684 0.455147 0.25 645 63.546 0.0103425 -3.53826 63.546000 Cu 0.651282 0.472534 0 646 63.546 0.0405844 -3.53249 63.546000 Cu 0.561029 0.481771 0.25 648 63.546 2.08315 -3.43092 63.546000 Cu 0.651282 0.472534 0.5 650 63.546 0.0405844 -3.53249 63.546000 Cu 0.744786 0.463526 0.75 721 63.546 0.0425187 -3.5329 63.546000 Cu 0.744786 0.463526 0.25 722 63.546 0.0425187 -3.5329 63.546000 Cu 0.810718 0.481816 1 723 63.546 2.07059 -3.42634 63.546000 Cu 0.810718 0.481816 0.5 726 63.546 2.07059 -3.42634 63.546000 Cu 0.835332 0.455044 2.60464e-16 724 63.546 0.0127641 -3.53804 63.546000 Cu 0.835332 0.455044 0.5 733 63.546 0.0127641 -3.53804 63.546000 Cu 0.90005 0.4723 0.75 797 63.546 0.0342542 -3.53157 63.546000 Cu 0.90005 0.4723 0.25 798 63.546 0.0342542 -3.53157 63.546000 Cu 0.992279 0.463102 1.39923e-16 800 63.546 0.0788447 -3.53327 63.546000 Cu 0.992279 0.463102 0.5 809 63.546 0.0788447 -3.53327 63.546000 Cu 0.125608 0.50027 0.25 93 63.546 7.40918 -3.38752 63.546000 Cu 0.125608 0.50027 0.75 99 63.546 7.40918 -3.38752 63.546000 Cu 0.215206 0.51109 0.5 40 63.546 5.81226 -3.45176 63.546000 Cu 0.215206 0.51109 1 42 63.546 5.81226 -3.45176 63.546000 Cu 0.225707 0.489091 0.75 908 63.546 10.9173 -3.39019 63.546000 Cu 0.225707 0.489091 0.25 909 63.546 10.9173 -3.39019 63.546000 Cu 0.473283 0.511049 0.25 8 63.546 8.98476 -3.38694 63.546000 Cu 0.473283 0.511049 0.75 9 63.546 8.98476 -3.38694 63.546000 Cu 0.375126 0.499678 0.75 564 63.546 7.65632 -3.3752 63.546000 Cu 0.375126 0.499678 0.25 565 63.546 7.65632 -3.3752 63.546000 Cu 0.467977 0.488976 3.77775e-16 566 63.546 6.52833 -3.44143 63.546000 Cu 0.467977 0.488976 0.5 573 63.546 6.52833 -3.44143 63.546000 Cu 0.625677 0.499625 2.54514e-16 642 63.546 9.14194 -3.36712 63.546000 Cu 0.625677 0.499625 0.5 649 63.546 9.14194 -3.36712 63.546000 Cu 0.724568 0.510936 0.5 248 63.546 8.98239 -3.38306 63.546000 Cu 0.724568 0.510936 1 255 63.546 8.98239 -3.38306 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0.304817 0.519139 0.75 39 63.546 4.74927 -3.37617 63.546000 Cu 0.243614 0.537087 0.5 41 63.546 0.0889747 -3.53478 63.546000 Cu 0.243614 0.537087 1.48594e-16 49 63.546 0.0889747 -3.53478 63.546000 Cu 0.491664 0.536753 0.25 7 63.546 0.258962 -3.51889 63.546000 Cu 0.399512 0.525609 0.5 10 63.546 2.52707 -3.49805 63.546000 Cu 0.491664 0.536753 0.75 16 63.546 0.258962 -3.51889 63.546000 Cu 0.399512 0.525609 1 17 63.546 2.52707 -3.49805 63.546000 Cu 0.336916 0.544548 0.25 37 63.546 0.107707 -3.5322 63.546000 Cu 0.336916 0.544548 0.75 48 63.546 0.107707 -3.5322 63.546000 Cu 0.559149 0.519575 0.5 1 63.546 5.24378 -3.38651 63.546000 Cu 0.586247 0.544648 0.5 2 63.546 0.0682212 -3.52547 63.546000 Cu 0.559149 0.519575 4.13649e-16 4 63.546 5.24378 -3.38651 63.546000 Cu 0.586247 0.544648 1.76306e-16 5 63.546 0.0682212 -3.52547 63.546000 Cu 0.652575 0.525745 0.25 323 63.546 2.41195 -3.48837 63.546000 Cu 0.652575 0.525745 0.75 329 63.546 2.41195 -3.48837 63.546000 Cu 0.810115 0.51965 0.25 247 63.546 5.31113 -3.39057 63.546000 Cu 0.743145 0.536786 0.5 252 63.546 0.250249 -3.52431 63.546000 Cu 0.810115 0.51965 0.75 254 63.546 5.31113 -3.39057 63.546000 Cu 0.743145 0.536786 1 256 63.546 0.250249 -3.52431 63.546000 Cu 0.995806 0.536365 0.25 172 63.546 0.12638 -3.52527 63.546000 Cu 0.995806 0.536365 0.75 173 63.546 0.12638 -3.52527 63.546000 Cu 0.904118 0.52559 0.5 174 63.546 2.43656 -3.49165 63.546000 Cu 0.904118 0.52559 3.35441e-16 178 63.546 2.43656 -3.49165 63.546000 Cu 0.837624 0.544618 0.25 250 63.546 0.0681452 -3.52285 63.546000 Cu 0.837624 0.544618 0.75 251 63.546 0.0681452 -3.52285 63.546000 Cu 0.111726 0.571376 0.5 104 63.546 0.00386232 -3.53915 63.546000 Cu 0.111726 0.571376 1.70016e-19 108 63.546 0.00386232 -3.53915 63.546000 Cu 0.0200752 0.562542 0.25 171 63.546 0.0132569 -3.53865 63.546000 Cu 0.0200752 0.562542 0.75 184 63.546 0.0132569 -3.53865 63.546000 Cu 0.271147 0.562589 0.5 46 63.546 0.0178312 -3.5361 63.546000 Cu 0.271147 0.562589 1 50 63.546 0.0178312 -3.5361 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-3.53977 63.546000 Cu 0.599368 0.640824 0.25 19 63.546 7.09667e-05 -3.53987 63.546000 Cu 0.507291 0.632112 0.5 23 63.546 8.24207e-05 -3.53987 63.546000 Cu 0.599368 0.640824 0.75 29 63.546 7.09667e-05 -3.53987 63.546000 Cu 0.507291 0.632112 3.33741e-16 30 63.546 8.24207e-05 -3.53987 63.546000 Cu 0.665134 0.623319 0.5 334 63.546 0.000117503 -3.53991 63.546000 Cu 0.665134 0.623319 2.31902e-16 343 63.546 0.000117503 -3.53991 63.546000 Cu 0.757041 0.632053 0.25 330 63.546 0.000179863 -3.5399 63.546000 Cu 0.69131 0.64954 0.5 340 63.546 3.18556e-05 -3.5399 63.546000 Cu 0.757041 0.632053 0.75 342 63.546 0.000179863 -3.5399 63.546000 Cu 0.69131 0.64954 4.04638e-16 344 63.546 3.18556e-05 -3.5399 63.546000 Cu 0.914694 0.623427 0.25 257 63.546 0.000114983 -3.53981 63.546000 Cu 0.941059 0.649624 0.25 266 63.546 1.9078e-05 -3.53982 63.546000 Cu 0.941059 0.649624 0.75 267 63.546 1.9078e-05 -3.53982 63.546000 Cu 0.849026 0.640858 0.5 268 63.546 4.9527e-05 -3.53981 63.546000 Cu 0.914694 0.623427 0.75 270 63.546 0.000114983 -3.53981 63.546000 Cu 0.849026 0.640858 1.51144e-16 272 63.546 4.9527e-05 -3.53981 63.546000 Cu 0.125312 0.667118 0.25 187 63.546 1.8681e-05 -3.53973 63.546000 Cu 0.0331121 0.658377 0.5 191 63.546 5.46887e-05 -3.53978 63.546000 Cu 0.0593793 0.684549 0.5 198 63.546 2.15286e-05 -3.5398 63.546000 Cu 0.125312 0.667118 0.75 200 63.546 1.8681e-05 -3.53973 63.546000 Cu 0.0331121 0.658377 2.37682e-16 201 63.546 5.46887e-05 -3.53978 63.546000 Cu 0.0593793 0.684549 1.90078e-16 202 63.546 2.15286e-05 -3.5398 63.546000 Cu 0.283428 0.658376 0.25 109 63.546 2.97324e-05 -3.5398 63.546000 Cu 0.309605 0.684559 0.25 118 63.546 2.00178e-05 -3.53983 63.546000 Cu 0.309605 0.684559 0.75 119 63.546 2.00178e-05 -3.53983 63.546000 Cu 0.217522 0.675831 0.5 120 63.546 4.4504e-05 -3.53978 63.546000 Cu 0.283428 0.658376 0.75 122 63.546 2.97324e-05 -3.5398 63.546000 Cu 0.217522 0.675831 1.27342e-16 124 63.546 4.4504e-05 -3.53978 63.546000 Cu 0.467602 0.675788 0.25 60 63.546 1.0352e-05 -3.53985 63.546000 Cu 0.467602 0.675788 0.75 61 63.546 1.0352e-05 -3.53985 63.546000 Cu 0.37551 0.667085 0.5 62 63.546 8.13507e-06 -3.53982 63.546000 Cu 0.37551 0.667085 1.53014e-18 66 63.546 8.13507e-06 -3.53982 63.546000 Cu 0.533449 0.658305 0.5 27 63.546 1.24133e-05 -3.53988 63.546000 Cu 0.559649 0.684504 0.5 28 63.546 9.28101e-06 -3.53988 63.546000 Cu 0.533449 0.658305 2.34112e-16 31 63.546 1.24133e-05 -3.53988 63.546000 Cu 0.559649 0.684504 5.93015e-16 34 63.546 9.28101e-06 -3.53988 63.546000 Cu 0.62547 0.667018 0.25 396 63.546 1.45817e-05 -3.53988 63.546000 Cu 0.62547 0.667018 0.75 397 63.546 1.45817e-05 -3.53988 63.546000 Cu 0.809415 0.684501 0.25 337 63.546 3.9171e-05 -3.53988 63.546000 Cu 0.78324 0.658286 0.25 338 63.546 3.63722e-05 -3.53988 63.546000 Cu 0.78324 0.658286 0.75 339 63.546 3.63722e-05 -3.53988 63.546000 Cu 0.717467 0.675744 0.5 341 63.546 3.46951e-05 -3.53989 63.546000 Cu 0.809415 0.684501 0.75 350 63.546 3.9171e-05 -3.53988 63.546000 Cu 0.717467 0.675744 4.2946e-16 351 63.546 3.46951e-05 -3.53989 63.546000 Cu 0.967287 0.675817 0.25 265 63.546 1.5985e-05 -3.53982 63.546000 Cu 0.875242 0.667058 0.5 269 63.546 6.69123e-06 -3.53983 63.546000 Cu 0.967287 0.675817 0.75 278 63.546 1.5985e-05 -3.53982 63.546000 Cu 0.875242 0.667058 3.1912e-16 279 63.546 6.69123e-06 -3.53983 63.546000 Cu 0.15155 0.693279 0.25 196 63.546 2.31619e-05 -3.53979 63.546000 Cu 0.15155 0.693279 0.75 197 63.546 2.31619e-05 -3.53979 63.546000 Cu 0.0856558 0.710736 0.5 199 63.546 1.2157e-05 -3.53984 63.546000 Cu 0.0856558 0.710736 1.90248e-16 209 63.546 1.2157e-05 -3.53984 63.546000 Cu 0.243653 0.702013 0.5 121 63.546 1.25014e-05 -3.53979 63.546000 Cu 0.243653 0.702013 1.34823e-16 131 63.546 1.25014e-05 -3.53979 63.546000 Cu 0.177727 0.719469 0.25 195 63.546 3.8426e-05 -3.53983 63.546000 Cu 0.177727 0.719469 0.75 208 63.546 3.8426e-05 -3.53983 63.546000 Cu 0.493847 0.701982 0.25 59 63.546 1.11485e-05 -3.53984 63.546000 Cu 0.401737 0.693267 0.5 63 63.546 4.87405e-06 -3.53983 63.546000 Cu 0.42796 0.719457 0.5 70 63.546 8.00203e-06 -3.53983 63.546000 Cu 0.493847 0.701982 0.75 72 63.546 1.11485e-05 -3.53984 63.546000 Cu 0.401737 0.693267 5.47451e-16 73 63.546 4.87405e-06 -3.53983 63.546000 Cu 0.42796 0.719457 6.54051e-16 74 63.546 8.00203e-06 -3.53983 63.546000 Cu 0.33583 0.710738 0.25 117 63.546 1.63562e-05 -3.5398 63.546000 Cu 0.33583 0.710738 0.75 130 63.546 1.63562e-05 -3.5398 63.546000 Cu 0.585964 0.710711 0.5 32 63.546 6.35828e-05 -3.53986 63.546000 Cu 0.585964 0.710711 5.67003e-16 35 63.546 6.35828e-05 -3.53986 63.546000 Cu 0.651696 0.693224 0.25 395 63.546 2.24572e-05 -3.53989 63.546000 Cu 0.651696 0.693224 0.75 401 63.546 2.24572e-05 -3.53989 63.546000 Cu 0.743692 0.701968 0.5 348 63.546 1.66496e-05 -3.53989 63.546000 Cu 0.743692 0.701968 7.5215e-16 352 63.546 1.66496e-05 -3.53989 63.546000 Cu 0.677979 0.719455 0.25 399 63.546 4.42139e-05 -3.53989 63.546000 Cu 0.677979 0.719455 0.75 400 63.546 4.42139e-05 -3.53989 63.546000 Cu 0.993523 0.702001 0.25 274 63.546 2.56696e-05 -3.53982 63.546000 Cu 0.993523 0.702001 0.75 275 63.546 2.56696e-05 -3.53982 63.546000 Cu 0.901439 0.693259 0.5 276 63.546 5.32775e-05 -3.53985 63.546000 Cu 0.927773 0.719472 0.5 277 63.546 1.43089e-05 -3.53987 63.546000 Cu 0.901439 0.693259 2.26291e-16 280 63.546 5.32775e-05 -3.53985 63.546000 Cu 0.927773 0.719472 8.5688e-17 287 63.546 1.43089e-05 -3.53987 63.546000 Cu 0.835735 0.710728 0.25 346 63.546 1.03787e-05 -3.53987 63.546000 Cu 0.835735 0.710728 0.75 347 63.546 1.03787e-05 -3.53987 63.546000 Cu 0.111913 0.736938 0.5 206 63.546 3.78172e-05 -3.53983 63.546000 Cu 0.111913 0.736938 4.63803e-16 210 63.546 3.78172e-05 -3.53983 63.546000 Cu 0.0198402 0.728194 0.25 273 63.546 2.06596e-05 -3.53986 63.546000 Cu 0.046159 0.754401 0.25 282 63.546 1.86478e-05 -3.53985 63.546000 Cu 0.046159 0.754401 0.75 283 63.546 1.86478e-05 -3.53985 63.546000 Cu 0.0198402 0.728194 0.75 286 63.546 2.06596e-05 -3.53986 63.546000 Cu 0.269874 0.728186 0.5 128 63.546 3.63631e-05 -3.53981 63.546000 Cu 0.296137 0.754383 0.5 129 63.546 1.13224e-05 -3.53985 63.546000 Cu 0.269874 0.728186 4.36091e-16 132 63.546 3.63631e-05 -3.53981 63.546000 Cu 0.296137 0.754383 2.46693e-16 139 63.546 1.13224e-05 -3.53985 63.546000 Cu 0.20406 0.74565 0.25 204 63.546 1.72979e-05 -3.53983 63.546000 Cu 0.20406 0.74565 0.75 205 63.546 1.72979e-05 -3.53983 63.546000 Cu 0.454152 0.745639 0.5 71 63.546 4.07547e-05 -3.53985 63.546000 Cu 0.454152 0.745639 1 81 63.546 4.07547e-05 -3.53985 63.546000 Cu 0.362005 0.73692 0.25 126 63.546 1.28966e-05 -3.53981 63.546000 Cu 0.362005 0.73692 0.75 127 63.546 1.28966e-05 -3.53981 63.546000 Cu 0.612108 0.736922 0.5 33 63.546 1.41089e-05 -3.53986 63.546000 Cu 0.612108 0.736922 3.34761e-16 36 63.546 1.41089e-05 -3.53986 63.546000 Cu 0.546155 0.754382 0.25 67 63.546 2.80068e-05 -3.53987 63.546000 Cu 0.520087 0.728172 0.25 68 63.546 5.54176e-05 -3.53985 63.546000 Cu 0.520087 0.728172 0.75 69 63.546 5.54176e-05 -3.53985 63.546000 Cu 0.546155 0.754382 0.75 80 63.546 2.80068e-05 -3.53987 63.546000 Cu 0.769995 0.728197 0.5 349 63.546 2.45535e-05 -3.53988 63.546000 Cu 0.796188 0.754399 0.5 356 63.546 6.80946e-06 -3.53986 63.546000 Cu 0.769995 0.728197 7.00806e-16 359 63.546 2.45535e-05 -3.53988 63.546000 Cu 0.796188 0.754399 1.53014e-18 360 63.546 6.80946e-06 -3.53986 63.546000 Cu 0.704152 0.745661 0.25 398 63.546 1.07727e-05 -3.53986 63.546000 Cu 0.704152 0.745661 0.75 407 63.546 1.07727e-05 -3.53986 63.546000 Cu 0.954108 0.745664 0.5 284 63.546 2.20779e-05 -3.53985 63.546000 Cu 0.954108 0.745664 6.09337e-16 288 63.546 2.20779e-05 -3.53985 63.546000 Cu 0.862029 0.736934 0.25 345 63.546 1.63367e-05 -3.53986 63.546000 Cu 0.862029 0.736934 0.75 358 63.546 1.63367e-05 -3.53986 63.546000 Cu 0.138271 0.763117 0.5 207 63.546 8.93281e-06 -3.53984 63.546000 Cu 0.138271 0.763117 3.10619e-16 217 63.546 8.93281e-06 -3.53984 63.546000 Cu 0.072461 0.780585 0.25 281 63.546 6.69512e-06 -3.53984 63.546000 Cu 0.072461 0.780585 0.75 294 63.546 6.69512e-06 -3.53984 63.546000 Cu 0.164541 0.789306 0.5 214 63.546 1.18714e-05 -3.53985 63.546000 Cu 0.164541 0.789306 3.52443e-16 218 63.546 1.18714e-05 -3.53985 63.546000 Cu 0.322422 0.78058 0.5 136 63.546 7.95416e-06 -3.53986 63.546000 Cu 0.322422 0.78058 2.1592e-16 140 63.546 7.95416e-06 -3.53986 63.546000 Cu 0.230345 0.771845 0.25 203 63.546 2.41958e-06 -3.53985 63.546000 Cu 0.230345 0.771845 0.75 216 63.546 2.41958e-06 -3.53985 63.546000 Cu 0.480289 0.771851 0.5 78 63.546 2.05524e-05 -3.53986 63.546000 Cu 0.480289 0.771851 7.67452e-16 82 63.546 2.05524e-05 -3.53986 63.546000 Cu 0.388236 0.763101 0.25 125 63.546 4.64647e-05 -3.53985 63.546000 Cu 0.414479 0.789314 0.25 134 63.546 5.75394e-06 -3.53986 63.546000 Cu 0.414479 0.789314 0.75 135 63.546 5.75394e-06 -3.53986 63.546000 Cu 0.388236 0.763101 0.75 138 63.546 4.64647e-05 -3.53985 63.546000 Cu 0.572375 0.780585 0.25 76 63.546 1.33941e-05 -3.53985 63.546000 Cu 0.572375 0.780585 0.75 77 63.546 1.33941e-05 -3.53985 63.546000 Cu 0.638223 0.763114 0.5 405 63.546 2.78298e-05 -3.53984 63.546000 Cu 0.638223 0.763114 6.76833e-16 408 63.546 2.78298e-05 -3.53984 63.546000 Cu 0.664499 0.789313 0.5 406 63.546 4.41979e-06 -3.53984 63.546000 Cu 0.664499 0.789313 2.55194e-16 415 63.546 4.41979e-06 -3.53984 63.546000 Cu 0.822405 0.780592 0.5 357 63.546 1.36005e-05 -3.53983 63.546000 Cu 0.822405 0.780592 5.347e-16 367 63.546 1.36005e-05 -3.53983 63.546000 Cu 0.730323 0.771853 0.25 403 63.546 6.78102e-06 -3.53983 63.546000 Cu 0.730323 0.771853 0.75 404 63.546 6.78102e-06 -3.53983 63.546000 Cu 0.980357 0.771861 0.5 285 63.546 7.40305e-06 -3.53982 63.546000 Cu 0.980357 0.771861 3.27281e-16 295 63.546 7.40305e-06 -3.53982 63.546000 Cu 0.914517 0.789315 0.25 353 63.546 2.63092e-06 -3.53983 63.546000 Cu 0.888251 0.763127 0.25 354 63.546 4.01804e-06 -3.53984 63.546000 Cu 0.888251 0.763127 0.75 355 63.546 4.01804e-06 -3.53984 63.546000 Cu 0.914517 0.789315 0.75 366 63.546 2.63092e-06 -3.53983 63.546000 Cu 0.0987168 0.806771 0.25 290 63.546 1.84902e-05 -3.53984 63.546000 Cu 0.0987168 0.806771 0.75 291 63.546 1.84902e-05 -3.53984 63.546000 Cu 0.00660616 0.798041 0.5 292 63.546 3.56862e-06 -3.53982 63.546000 Cu 0.0328556 0.824228 0.5 293 63.546 2.11795e-05 -3.53985 63.546000 Cu 0.00660616 0.798041 4.42381e-16 296 63.546 3.56862e-06 -3.53982 63.546000 Cu 0.0328556 0.824228 5.80944e-16 303 63.546 2.11795e-05 -3.53985 63.546000 Cu 0.282808 0.824243 0.25 211 63.546 6.6571e-06 -3.53984 63.546000 Cu 0.256584 0.798043 0.25 212 63.546 4.75991e-06 -3.53985 63.546000 Cu 0.256584 0.798043 0.75 213 63.546 4.75991e-06 -3.53985 63.546000 Cu 0.190745 0.815512 0.5 215 63.546 1.26612e-05 -3.53985 63.546000 Cu 0.282808 0.824243 0.75 224 63.546 6.6571e-06 -3.53984 63.546000 Cu 0.190745 0.815512 4.12799e-16 225 63.546 1.26612e-05 -3.53985 63.546000 Cu 0.440756 0.815515 0.25 133 63.546 1.10226e-05 -3.53984 63.546000 Cu 0.348678 0.806788 0.5 137 63.546 2.28582e-05 -3.53984 63.546000 Cu 0.440756 0.815515 0.75 146 63.546 1.10226e-05 -3.53984 63.546000 Cu 0.348678 0.806788 5.2994e-16 147 63.546 2.28582e-05 -3.53984 63.546000 Cu 0.598718 0.806777 0.25 75 63.546 1.62568e-05 -3.53983 63.546000 Cu 0.506571 0.798052 0.5 79 63.546 9.02607e-06 -3.53983 63.546000 Cu 0.532877 0.824236 0.5 83 63.546 1.77948e-05 -3.53983 63.546000 Cu 0.598718 0.806777 0.75 85 63.546 1.62568e-05 -3.53983 63.546000 Cu 0.506571 0.798052 1.67806e-16 86 63.546 9.02607e-06 -3.53983 63.546000 Cu 0.532877 0.824236 4.54623e-16 87 63.546 1.77948e-05 -3.53983 63.546000 Cu 0.756582 0.798045 0.25 402 63.546 7.99152e-06 -3.53982 63.546000 Cu 0.782897 0.824228 0.25 410 63.546 2.49417e-05 -3.53983 63.546000 Cu 0.782897 0.824228 0.75 411 63.546 2.49417e-05 -3.53983 63.546000 Cu 0.69079 0.815508 0.5 412 63.546 1.0909e-05 -3.53983 63.546000 Cu 0.756582 0.798045 0.75 414 63.546 7.99152e-06 -3.53982 63.546000 Cu 0.69079 0.815508 2.24421e-17 416 63.546 1.0909e-05 -3.53983 63.546000 Cu 0.940794 0.815501 0.25 362 63.546 7.17848e-06 -3.53983 63.546000 Cu 0.940794 0.815501 0.75 363 63.546 7.17848e-06 -3.53983 63.546000 Cu 0.848717 0.806772 0.5 364 63.546 7.42222e-06 -3.53981 63.546000 Cu 0.848717 0.806772 5.54252e-16 368 63.546 7.42222e-06 -3.53981 63.546000 Cu 0.124863 0.832967 0.25 289 63.546 1.11643e-05 -3.53983 63.546000 Cu 0.150973 0.859139 0.25 298 63.546 4.42686e-05 -3.5398 63.546000 Cu 0.150973 0.859139 0.75 299 63.546 4.42686e-05 -3.5398 63.546000 Cu 0.0589313 0.850424 0.5 300 63.546 2.93689e-05 -3.53985 63.546000 Cu 0.124863 0.832967 0.75 302 63.546 1.11643e-05 -3.53983 63.546000 Cu 0.0589313 0.850424 1 304 63.546 2.93689e-05 -3.53985 63.546000 Cu 0.30895 0.850427 0.25 220 63.546 2.01226e-05 -3.53983 63.546000 Cu 0.30895 0.850427 0.75 221 63.546 2.01226e-05 -3.53983 63.546000 Cu 0.216917 0.841699 0.5 222 63.546 8.98233e-06 -3.53984 63.546000 Cu 0.216917 0.841699 1 226 63.546 8.98233e-06 -3.53984 63.546000 Cu 0.466985 0.841695 0.25 142 63.546 1.55361e-05 -3.53984 63.546000 Cu 0.466985 0.841695 0.75 143 63.546 1.55361e-05 -3.53984 63.546000 Cu 0.374889 0.832972 0.5 144 63.546 1.21743e-05 -3.53981 63.546000 Cu 0.401039 0.859134 0.5 145 63.546 4.71881e-05 -3.53978 63.546000 Cu 0.374889 0.832972 1.17821e-16 148 63.546 1.21743e-05 -3.53981 63.546000 Cu 0.401039 0.859134 5.03587e-16 155 63.546 4.71881e-05 -3.53978 63.546000 Cu 0.559024 0.850419 0.5 84 63.546 1.04941e-05 -3.53983 63.546000 Cu 0.559024 0.850419 7.63371e-17 90 63.546 1.04941e-05 -3.53983 63.546000 Cu 0.651093 0.85913 0.25 441 63.546 3.00455e-05 -3.5398 63.546000 Cu 0.624955 0.832964 0.25 442 63.546 2.03463e-05 -3.53982 63.546000 Cu 0.624955 0.832964 0.75 443 63.546 2.03463e-05 -3.53982 63.546000 Cu 0.651093 0.85913 0.75 447 63.546 3.00455e-05 -3.5398 63.546000 Cu 0.809019 0.850416 0.25 409 63.546 9.0195e-06 -3.53985 63.546000 Cu 0.717035 0.841682 0.5 413 63.546 3.54097e-05 -3.53984 63.546000 Cu 0.809019 0.850416 0.75 422 63.546 9.0195e-06 -3.53985 63.546000 Cu 0.717035 0.841682 1 423 63.546 3.54097e-05 -3.53984 63.546000 Cu 0.96697 0.841685 0.25 361 63.546 1.82178e-05 -3.53986 63.546000 Cu 0.874947 0.832956 0.5 365 63.546 2.03863e-05 -3.53983 63.546000 Cu 0.901021 0.859131 0.5 372 63.546 4.08954e-05 -3.53982 63.546000 Cu 0.96697 0.841685 0.75 374 63.546 1.82178e-05 -3.53986 63.546000 Cu 0.874947 0.832956 1.57265e-16 375 63.546 2.03863e-05 -3.53983 63.546000 Cu 0.901021 0.859131 5.20589e-16 376 63.546 4.08954e-05 -3.53982 63.546000 Cu 0.0851085 0.876598 0.5 301 63.546 1.64904e-05 -3.53982 63.546000 Cu 0.0851085 0.876598 9.82522e-16 311 63.546 1.64904e-05 -3.53982 63.546000 Cu 0.0193498 0.894074 0.25 369 63.546 0.000541053 -3.5398 63.546000 Cu 0.0193498 0.894074 0.75 382 63.546 0.000541053 -3.5398 63.546000 Cu 0.243076 0.867887 0.5 223 63.546 6.99788e-05 -3.53982 63.546000 Cu 0.269397 0.894071 0.5 230 63.546 0.000544542 -3.5398 63.546000 Cu 0.243076 0.867887 8.15396e-16 233 63.546 6.99788e-05 -3.53982 63.546000 Cu 0.269397 0.894071 1 234 63.546 0.000544542 -3.5398 63.546000 Cu 0.177185 0.885309 0.25 297 63.546 0.000140477 -3.5397 63.546000 Cu 0.177185 0.885309 0.75 310 63.546 0.000140477 -3.5397 63.546000 Cu 0.493151 0.867883 0.25 141 63.546 7.73659e-05 -3.53983 63.546000 Cu 0.427229 0.885303 0.5 152 63.546 0.000167547 -3.53972 63.546000 Cu 0.493151 0.867883 0.75 154 63.546 7.73659e-05 -3.53983 63.546000 Cu 0.427229 0.885303 1.53184e-16 156 63.546 0.000167547 -3.53972 63.546000 Cu 0.335169 0.876596 0.25 219 63.546 1.87078e-05 -3.53982 63.546000 Cu 0.335169 0.876596 0.75 232 63.546 1.87078e-05 -3.53982 63.546000 Cu 0.585198 0.87659 0.5 88 63.546 3.00242e-05 -3.53983 63.546000 Cu 0.585198 0.87659 6.94685e-16 91 63.546 3.00242e-05 -3.53983 63.546000 Cu 0.519413 0.894073 0.25 150 63.546 0.000607858 -3.53982 63.546000 Cu 0.519413 0.894073 0.75 151 63.546 0.000607858 -3.53982 63.546000 Cu 0.743131 0.867878 0.5 420 63.546 5.32677e-05 -3.53986 63.546000 Cu 0.769368 0.894072 0.5 421 63.546 0.000534283 -3.53983 63.546000 Cu 0.743131 0.867878 2.73726e-16 424 63.546 5.32677e-05 -3.53986 63.546000 Cu 0.769368 0.894072 6.85674e-16 431 63.546 0.000534283 -3.53983 63.546000 Cu 0.677215 0.885305 0.25 445 63.546 0.000141409 -3.53973 63.546000 Cu 0.677215 0.885305 0.75 446 63.546 0.000141409 -3.53973 63.546000 Cu 0.993054 0.867885 0.25 370 63.546 7.97628e-05 -3.53985 63.546000 Cu 0.993054 0.867885 0.75 371 63.546 7.97628e-05 -3.53985 63.546000 Cu 0.927152 0.885309 0.5 373 63.546 0.000176947 -3.53972 63.546000 Cu 0.927152 0.885309 3.94947e-16 383 63.546 0.000176947 -3.53972 63.546000 Cu 0.83514 0.876593 0.25 418 63.546 1.68471e-05 -3.53984 63.546000 Cu 0.83514 0.876593 0.75 419 63.546 1.68471e-05 -3.53984 63.546000 Cu 0.11129 0.902775 0.5 308 63.546 0.000477375 -3.53974 63.546000 Cu 0.137682 0.928873 0.5 309 63.546 0.00449325 -3.53982 63.546000 Cu 0.11129 0.902775 3.40032e-19 312 63.546 0.000477375 -3.53974 63.546000 Cu 0.137682 0.928873 5.27049e-17 319 63.546 0.00449325 -3.53982 63.546000 Cu 0.045556 0.920358 0.25 378 63.546 0.0063983 -3.53973 63.546000 Cu 0.045556 0.920358 0.75 379 63.546 0.0063983 -3.53973 63.546000 Cu 0.295569 0.920358 0.5 231 63.546 0.00628758 -3.53974 63.546000 Cu 0.295569 0.920358 2.66585e-16 241 63.546 0.00628758 -3.53974 63.546000 Cu 0.203512 0.911421 0.25 306 63.546 0.00194345 -3.53952 63.546000 Cu 0.203512 0.911421 0.75 307 63.546 0.00194345 -3.53952 63.546000 Cu 0.453509 0.911422 0.5 153 63.546 0.00201626 -3.53954 63.546000 Cu 0.453509 0.911422 5.53912e-16 163 63.546 0.00201626 -3.53954 63.546000 Cu 0.387681 0.928878 0.25 227 63.546 0.00438969 -3.53981 63.546000 Cu 0.361315 0.902779 0.25 228 63.546 0.00045951 -3.53975 63.546000 Cu 0.361315 0.902779 0.75 229 63.546 0.00045951 -3.53975 63.546000 Cu 0.387681 0.928878 0.75 240 63.546 0.00438969 -3.53981 63.546000 Cu 0.611298 0.902776 0.5 89 63.546 0.000503009 -3.53975 63.546000 Cu 0.611298 0.902776 1.13061e-16 92 63.546 0.000503009 -3.53975 63.546000 Cu 0.545549 0.920363 0.25 149 63.546 0.00655407 -3.53974 63.546000 Cu 0.545549 0.920363 0.75 162 63.546 0.00655407 -3.53974 63.546000 Cu 0.637648 0.92888 0.5 451 63.546 0.00425137 -3.53982 63.546000 Cu 0.637648 0.92888 6.67142e-16 454 63.546 0.00425137 -3.53982 63.546000 Cu 0.795527 0.920362 0.5 428 63.546 0.00661706 -3.53973 63.546000 Cu 0.795527 0.920362 7.65072e-17 432 63.546 0.00661706 -3.53973 63.546000 Cu 0.703473 0.911422 0.25 444 63.546 0.00194198 -3.53953 63.546000 Cu 0.703473 0.911422 0.75 453 63.546 0.00194198 -3.53953 63.546000 Cu 0.953474 0.91142 0.5 380 63.546 0.00197985 -3.5395 63.546000 Cu 0.953474 0.91142 1.46384e-16 384 63.546 0.00197985 -3.5395 63.546000 Cu 0.861254 0.902779 0.25 417 63.546 0.000561755 -3.53974 63.546000 Cu 0.88766 0.928874 0.25 426 63.546 0.00448997 -3.53981 63.546000 Cu 0.88766 0.928874 0.75 427 63.546 0.00448997 -3.53981 63.546000 Cu 0.861254 0.902779 0.75 430 63.546 0.000561755 -3.53974 63.546000 Cu 0.0727916 0.94659 0.25 377 63.546 0.0592214 -3.53028 63.546000 Cu 0.00689874 0.963157 0.5 388 63.546 0.236848 -3.52572 63.546000 Cu 0.0727916 0.94659 0.75 390 63.546 0.0592214 -3.53028 63.546000 Cu 0.00689874 0.963157 1 392 63.546 0.236848 -3.52572 63.546000 Cu 0.16294 0.955255 0.5 316 63.546 0.0702031 -3.52607 63.546000 Cu 0.16294 0.955255 1.1051e-16 320 63.546 0.0702031 -3.52607 63.546000 Cu 0.322796 0.946592 0.5 238 63.546 0.0591486 -3.53025 63.546000 Cu 0.322796 0.946592 5.24669e-16 242 63.546 0.0591486 -3.53025 63.546000 Cu 0.229239 0.937583 0.25 305 63.546 0.0141157 -3.53674 63.546000 Cu 0.256898 0.963161 0.25 314 63.546 0.237174 -3.52574 63.546000 Cu 0.256898 0.963161 0.75 315 63.546 0.237174 -3.52574 63.546000 Cu 0.229239 0.937583 0.75 318 63.546 0.0141157 -3.53674 63.546000 Cu 0.479213 0.937587 0.5 160 63.546 0.0143841 -3.53673 63.546000 Cu 0.479213 0.937587 1 164 63.546 0.0143841 -3.53673 63.546000 Cu 0.412935 0.955258 0.25 236 63.546 0.0707097 -3.52597 63.546000 Cu 0.412935 0.955258 0.75 237 63.546 0.0707097 -3.52597 63.546000 Cu 0.572775 0.946596 0.25 158 63.546 0.0590639 -3.53028 63.546000 Cu 0.572775 0.946596 0.75 159 63.546 0.0590639 -3.53028 63.546000 Cu 0.506891 0.963162 0.5 161 63.546 0.236858 -3.52571 63.546000 Cu 0.506891 0.963162 1 167 63.546 0.236858 -3.52571 63.546000 Cu 0.662927 0.955258 0.5 452 63.546 0.0702013 -3.52599 63.546000 Cu 0.662927 0.955258 1 459 63.546 0.0702013 -3.52599 63.546000 Cu 0.822786 0.946592 0.5 429 63.546 0.0595684 -3.53027 63.546000 Cu 0.822786 0.946592 1 438 63.546 0.0595684 -3.53027 63.546000 Cu 0.756892 0.963157 0.25 448 63.546 0.237865 -3.52574 63.546000 Cu 0.729199 0.937584 0.25 449 63.546 0.0145225 -3.5367 63.546000 Cu 0.729199 0.937584 0.75 450 63.546 0.0145225 -3.5367 63.546000 Cu 0.756892 0.963157 0.75 458 63.546 0.237865 -3.52574 63.546000 Cu 0.979221 0.937581 0.5 381 63.546 0.0141872 -3.53673 63.546000 Cu 0.979221 0.937581 5.08348e-16 391 63.546 0.0141872 -3.53673 63.546000 Cu 0.912937 0.955252 0.25 425 63.546 0.0701273 -3.52599 63.546000 Cu 0.912937 0.955252 0.75 437 63.546 0.0701273 -3.52599 63.546000 Cu 0.0971963 0.974189 0.25 386 63.546 2.40603 -3.48549 63.546000 Cu 0.0971963 0.974189 0.75 387 63.546 2.40603 -3.48549 63.546000 Cu 0.0256508 0.989061 0.5 389 63.546 9.00017 -3.38342 63.546000 Cu 0.0256508 0.989061 1 394 63.546 9.00017 -3.38342 63.546000 Cu 0.275661 0.989067 0.25 313 63.546 9.00191 -3.38336 63.546000 Cu 0.190254 0.980365 0.5 317 63.546 5.26305 -3.38904 63.546000 Cu 0.275661 0.989067 0.75 321 63.546 9.00191 -3.38336 63.546000 Cu 0.190254 0.980365 1.25302e-16 322 63.546 5.26305 -3.38904 63.546000 Cu 0.440249 0.980364 0.25 235 63.546 5.26536 -3.38909 63.546000 Cu 0.347191 0.974198 0.5 239 63.546 2.41032 -3.48526 63.546000 Cu 0.440249 0.980364 0.75 244 63.546 5.26536 -3.38909 63.546000 Cu 0.347191 0.974198 1.37696e-15 245 63.546 2.41032 -3.48526 63.546000 Cu 0.597177 0.974192 0.25 157 63.546 2.40657 -3.48551 63.546000 Cu 0.525651 0.989066 0.5 165 63.546 8.99972 -3.38329 63.546000 Cu 0.597177 0.974192 0.75 166 63.546 2.40657 -3.48551 63.546000 Cu 0.525651 0.989066 1 168 63.546 8.99972 -3.38329 63.546000 Cu 0.775635 0.989062 0.25 455 63.546 8.99998 -3.38334 63.546000 Cu 0.775635 0.989062 0.75 456 63.546 8.99998 -3.38334 63.546000 Cu 0.690236 0.980361 0.5 457 63.546 5.26402 -3.38902 63.546000 Cu 0.690236 0.980361 1 460 63.546 5.26402 -3.38902 63.546000 Cu 0.940241 0.980358 0.25 433 63.546 5.26449 -3.38907 63.546000 Cu 0.940241 0.980358 0.75 434 63.546 5.26449 -3.38907 63.546000 Cu 0.847178 0.974188 0.5 435 63.546 2.4067 -3.48558 63.546000 Cu 0.847178 0.974188 2.42749e-15 439 63.546 2.4067 -3.48558