Number of particles = 1040 A = 1 Angstrom (basic length-scale) H0(1,1) = 20.7251 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 117.472 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.10383 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 0.000888694 8.45726e-05 0.5 531 63.546 0 -3.3116 63.546000 Cu 0.000888694 8.45726e-05 5.25125e-17 532 63.546 0 -3.3116 63.546000 Cu 0.0463446 0.0169424 0.75 533 63.546 0 -3.42813 63.546000 Cu 0.0463446 0.0169424 0.25 534 63.546 0 -3.42813 63.546000 Cu 0.152595 0.0153052 0.5 543 63.546 0 -3.1867 63.546000 Cu 0.152595 0.0153052 7.52849e-17 544 63.546 0 -3.1867 63.546000 Cu 0.257167 0.0125752 0.75 546 63.546 0 -3.26546 63.546000 Cu 0.257167 0.0125752 0.25 550 63.546 0 -3.26546 63.546000 Cu 0.362695 0.0110963 0.5 569 63.546 0 -3.30733 63.546000 Cu 0.362695 0.0110963 1 578 63.546 0 -3.30733 63.546000 Cu 0.468779 0.010207 0.75 577 63.546 7.45097 -3.35848 63.546000 Cu 0.468779 0.010207 0.25 580 63.546 7.45097 -3.35848 63.546000 Cu 0.572461 0.00697589 0.5 617 63.546 0 -3.30685 63.546000 Cu 0.572461 0.00697589 1 618 63.546 0 -3.30685 63.546000 Cu 0.681219 0.0056865 0.75 620 63.546 0 -3.17702 63.546000 Cu 0.681219 0.0056865 0.25 624 63.546 0 -3.17702 63.546000 Cu 0.786973 0.0016284 0.5 671 63.546 5.83257 -3.42395 63.546000 Cu 0.728389 0.0221716 0.5 672 63.546 0.0648382 -3.53085 63.546000 Cu 0.728389 0.0221716 1 673 63.546 0.0648382 -3.53085 63.546000 Cu 0.832982 0.0196246 0.75 675 63.546 0.042777 -3.52684 63.546000 Cu 0.786973 0.0016284 0 680 63.546 5.83257 -3.42395 63.546000 Cu 0.832982 0.0196246 0.25 681 63.546 0.042777 -3.52684 63.546000 Cu 0.89401 0.000271942 0.75 679 63.546 5.3934 -3.52532 63.546000 Cu 0.89401 0.000271942 0.25 682 63.546 5.3934 -3.52532 63.546000 Cu 0.938541 0.0182234 0.5 739 63.546 0.0300891 -3.53251 63.546000 Cu 0.938541 0.0182234 1.28137e-16 747 63.546 0.0300891 -3.53251 63.546000 Cu 0.0909101 0.0339552 0.5 536 63.546 0.00490873 -3.53969 63.546000 Cu 0.0909101 0.0339552 1 547 63.546 0.00490873 -3.53969 63.546000 Cu 0.197218 0.0319876 0.75 545 63.546 0.0103331 -3.5375 63.546000 Cu 0.197218 0.0319876 0.25 549 63.546 0.0103331 -3.5375 63.546000 Cu 0.302341 0.0298476 0.5 570 63.546 0.0188296 -3.53815 63.546000 Cu 0.302341 0.0298476 1.23209e-16 571 63.546 0.0188296 -3.53815 63.546000 Cu 0.348004 0.047192 0.75 572 63.546 0.00364394 -3.53889 63.546000 Cu 0.407874 0.0284267 0.75 573 63.546 0.017017 -3.53622 63.546000 Cu 0.348004 0.047192 0.25 576 63.546 0.00364394 -3.53889 63.546000 Cu 0.407874 0.0284267 0.25 579 63.546 0.017017 -3.53622 63.546000 Cu 0.515782 0.0266594 0.5 609 63.546 0.0503798 -3.53673 63.546000 Cu 0.454393 0.045441 0.5 610 63.546 0.00188813 -3.53991 63.546000 Cu 0.454393 0.045441 0 611 63.546 0.00188813 -3.53991 63.546000 Cu 0.561043 0.0435482 0.75 613 63.546 0.00645217 -3.53922 63.546000 Cu 0.515782 0.0266594 1 621 63.546 0.0503798 -3.53673 63.546000 Cu 0.561043 0.0435482 0.25 622 63.546 0.00645217 -3.53922 63.546000 Cu 0.620811 0.0241637 0.75 619 63.546 0.0279284 -3.53653 63.546000 Cu 0.620811 0.0241637 0.25 623 63.546 0.0279284 -3.53653 63.546000 Cu 0.667059 0.0413773 0.5 663 63.546 0.00249929 -3.53872 63.546000 Cu 0.667059 0.0413773 1 676 63.546 0.00249929 -3.53872 63.546000 Cu 0.773232 0.0394208 0.75 674 63.546 0.00784346 -3.53702 63.546000 Cu 0.773232 0.0394208 0.25 678 63.546 0.00784346 -3.53702 63.546000 Cu 0.878372 0.0373521 0.5 740 63.546 0.00765981 -3.53559 63.546000 Cu 0.878372 0.0373521 2.43019e-17 741 63.546 0.00765981 -3.53559 63.546000 Cu 0.984247 0.0356163 0.75 743 63.546 0.00519706 -3.53856 63.546000 Cu 0.984247 0.0356163 0.25 748 63.546 0.00519706 -3.53856 63.546000 Cu 0.0300615 0.0528824 0.5 537 63.546 0.000721873 -3.53949 63.546000 Cu 0.0300615 0.0528824 1 538 63.546 0.000721873 -3.53949 63.546000 Cu 0.0757489 0.070028 0.75 539 63.546 0.000139385 -3.53987 63.546000 Cu 0.136343 0.051053 0.75 540 63.546 0.00040767 -3.53988 63.546000 Cu 0.0757489 0.070028 0.25 542 63.546 0.000139385 -3.53987 63.546000 Cu 0.136343 0.051053 0.25 548 63.546 0.00040767 -3.53988 63.546000 Cu 0.2424 0.0491365 0.5 561 63.546 0.00162919 -3.53951 63.546000 Cu 0.181803 0.0681345 0.5 562 63.546 1.02481e-05 -3.53992 63.546000 Cu 0.181803 0.0681345 1 563 63.546 1.02481e-05 -3.53992 63.546000 Cu 0.2424 0.0491365 1 574 63.546 0.00162919 -3.53951 63.546000 Cu 0.28778 0.066245 0.75 565 63.546 0.000174832 -3.53989 63.546000 Cu 0.28778 0.066245 0.25 575 63.546 0.000174832 -3.53989 63.546000 Cu 0.393735 0.0643577 0.5 601 63.546 0.000393835 -3.53984 63.546000 Cu 0.393735 0.0643577 1 614 63.546 0.000393835 -3.53984 63.546000 Cu 0.500004 0.0625108 0.75 612 63.546 0.000222155 -3.53996 63.546000 Cu 0.500004 0.0625108 0.25 616 63.546 0.000222155 -3.53996 63.546000 Cu 0.606414 0.0606086 0.5 664 63.546 0.00207252 -3.53961 63.546000 Cu 0.606414 0.0606086 1 665 63.546 0.00207252 -3.53961 63.546000 Cu 0.712238 0.0585644 0.75 667 63.546 0.000650516 -3.53951 63.546000 Cu 0.712238 0.0585644 0.25 677 63.546 0.000650516 -3.53951 63.546000 Cu 0.818244 0.0566478 0.5 731 63.546 0.00113779 -3.5393 63.546000 Cu 0.818244 0.0566478 1 744 63.546 0.00113779 -3.5393 63.546000 Cu 0.92406 0.0547146 0.75 742 63.546 0.00107423 -3.53892 63.546000 Cu 0.92406 0.0547146 0.25 746 63.546 0.00107423 -3.53892 63.546000 Cu 0.0151627 0.0890145 0.75 535 63.546 4.90293e-05 -3.53993 63.546000 Cu 0.0151627 0.0890145 0.25 541 63.546 4.90293e-05 -3.53993 63.546000 Cu 0.121223 0.0871144 0.5 553 63.546 1.55969e-05 -3.53994 63.546000 Cu 0.121223 0.0871144 1.43772e-16 566 63.546 1.55969e-05 -3.53994 63.546000 Cu 0.227254 0.0852153 0.75 564 63.546 5.6819e-06 -3.53993 63.546000 Cu 0.227254 0.0852153 0.25 568 63.546 5.6819e-06 -3.53993 63.546000 Cu 0.333285 0.0833223 0.5 602 63.546 9.81454e-06 -3.53994 63.546000 Cu 0.333285 0.0833223 9.77174e-17 603 63.546 9.81454e-06 -3.53994 63.546000 Cu 0.439344 0.0814381 0.75 605 63.546 3.66257e-05 -3.53994 63.546000 Cu 0.439344 0.0814381 0.25 615 63.546 3.66257e-05 -3.53994 63.546000 Cu 0.545466 0.0795526 0.5 655 63.546 6.15125e-05 -3.53995 63.546000 Cu 0.545466 0.0795526 2.43019e-17 668 63.546 6.15125e-05 -3.53995 63.546000 Cu 0.651602 0.0776471 0.75 666 63.546 0.000300029 -3.53986 63.546000 Cu 0.651602 0.0776471 0.25 670 63.546 0.000300029 -3.53986 63.546000 Cu 0.696979 0.0947101 0.5 723 63.546 4.06804e-05 -3.53993 63.546000 Cu 0.696979 0.0947101 0 736 63.546 4.06804e-05 -3.53993 63.546000 Cu 0.757581 0.0757121 0.5 732 63.546 0.000176503 -3.53983 63.546000 Cu 0.757581 0.0757121 2.43019e-17 733 63.546 0.000176503 -3.53983 63.546000 Cu 0.80303 0.0928097 0.75 734 63.546 6.7803e-05 -3.53993 63.546000 Cu 0.80303 0.0928097 0.25 738 63.546 6.7803e-05 -3.53993 63.546000 Cu 0.863633 0.0738105 0.75 735 63.546 0.000248387 -3.5398 63.546000 Cu 0.863633 0.0738105 0.25 745 63.546 0.000248387 -3.5398 63.546000 Cu 0.969666 0.0719142 0.5 807 63.546 0.00031629 -3.53977 63.546000 Cu 0.909095 0.0909129 0.5 808 63.546 7.15494e-05 -3.53993 63.546000 Cu 0.909095 0.0909129 7.13762e-17 809 63.546 7.15494e-05 -3.53993 63.546000 Cu 0.969666 0.0719142 2.43019e-17 814 63.546 0.00031629 -3.53977 63.546000 Cu 0.06061 0.106078 0.5 554 63.546 1.07306e-05 -3.53994 63.546000 Cu 0.06061 0.106078 1.41563e-16 555 63.546 1.07306e-05 -3.53994 63.546000 Cu 0.166668 0.104182 0.75 557 63.546 1.23438e-05 -3.53994 63.546000 Cu 0.166668 0.104182 0.25 567 63.546 1.23438e-05 -3.53994 63.546000 Cu 0.272721 0.102286 0.5 593 63.546 1.25756e-05 -3.53994 63.546000 Cu 0.272721 0.102286 1.17261e-16 606 63.546 1.25756e-05 -3.53994 63.546000 Cu 0.378776 0.100393 0.75 604 63.546 1.01464e-05 -3.53994 63.546000 Cu 0.378776 0.100393 0.25 608 63.546 1.01464e-05 -3.53994 63.546000 Cu 0.424241 0.117446 0.5 647 63.546 2.00546e-06 -3.53993 63.546000 Cu 0.424241 0.117446 1.15731e-16 660 63.546 2.00546e-06 -3.53993 63.546000 Cu 0.484841 0.0985013 0.5 656 63.546 5.52552e-06 -3.53994 63.546000 Cu 0.484841 0.0985013 0 657 63.546 5.52552e-06 -3.53994 63.546000 Cu 0.530302 0.115553 0.75 658 63.546 1.34829e-06 -3.53993 63.546000 Cu 0.530302 0.115553 0.25 662 63.546 1.34829e-06 -3.53993 63.546000 Cu 0.590911 0.0966076 0.75 659 63.546 7.13884e-06 -3.53994 63.546000 Cu 0.590911 0.0966076 0.25 669 63.546 7.13884e-06 -3.53994 63.546000 Cu 0.636364 0.113659 0.5 724 63.546 1.89076e-06 -3.53993 63.546000 Cu 0.636364 0.113659 4.28257e-17 725 63.546 1.89076e-06 -3.53993 63.546000 Cu 0.742425 0.111764 0.75 727 63.546 4.60875e-06 -3.53993 63.546000 Cu 0.742425 0.111764 0.25 737 63.546 4.60875e-06 -3.53993 63.546000 Cu 0.848486 0.109869 0.5 799 63.546 7.76539e-06 -3.53994 63.546000 Cu 0.848486 0.109869 1 811 63.546 7.76539e-06 -3.53994 63.546000 Cu 0.954548 0.107974 0.75 810 63.546 9.26033e-06 -3.53994 63.546000 Cu 0.954548 0.107974 0.25 813 63.546 9.26033e-06 -3.53994 63.546000 Cu 4.89712e-07 0.125022 0.5 551 63.546 6.69403e-07 -3.53993 63.546000 Cu 0.0454546 0.142067 0.75 552 63.546 1.93901e-08 -3.53993 63.546000 Cu 0.106061 0.123128 0.75 556 63.546 1.29232e-06 -3.53993 63.546000 Cu 0.0454546 0.142067 0.25 559 63.546 1.93901e-08 -3.53993 63.546000 Cu 0.106061 0.123128 0.25 560 63.546 1.29232e-06 -3.53993 63.546000 Cu 4.89712e-07 0.125022 1 558 63.546 6.69403e-07 -3.53993 63.546000 Cu 0.151515 0.140174 0.5 585 63.546 4.28415e-08 -3.53993 63.546000 Cu 0.212121 0.121234 0.5 594 63.546 2.0537e-06 -3.53993 63.546000 Cu 0.212121 0.121234 8.49717e-17 595 63.546 2.0537e-06 -3.53993 63.546000 Cu 0.257576 0.13828 0.75 596 63.546 6.91734e-08 -3.53993 63.546000 Cu 0.151515 0.140174 1 598 63.546 4.28415e-08 -3.53993 63.546000 Cu 0.257576 0.13828 0.25 600 63.546 6.91734e-08 -3.53993 63.546000 Cu 0.318181 0.11934 0.75 597 63.546 2.44099e-06 -3.53993 63.546000 Cu 0.318181 0.11934 0.25 607 63.546 2.44099e-06 -3.53993 63.546000 Cu 0.363636 0.136386 0.5 648 63.546 7.9174e-08 -3.53993 63.546000 Cu 0.363636 0.136386 1.21509e-16 649 63.546 7.9174e-08 -3.53993 63.546000 Cu 0.469697 0.134492 0.75 651 63.546 6.70731e-08 -3.53993 63.546000 Cu 0.469697 0.134492 0.25 661 63.546 6.70731e-08 -3.53993 63.546000 Cu 0.575758 0.132598 0.5 715 63.546 5.85067e-08 -3.53993 63.546000 Cu 0.681818 0.130704 0.75 726 63.546 8.66172e-08 -3.53993 63.546000 Cu 0.575758 0.132598 2.74798e-16 728 63.546 5.85067e-08 -3.53993 63.546000 Cu 0.681818 0.130704 0.25 730 63.546 8.66172e-08 -3.53993 63.546000 Cu 0.787879 0.128811 0.5 800 63.546 1.71934e-07 -3.53993 63.546000 Cu 0.787879 0.128811 9.72076e-17 801 63.546 1.71934e-07 -3.53993 63.546000 Cu 0.89394 0.126917 0.75 803 63.546 3.36716e-07 -3.53993 63.546000 Cu 0.89394 0.126917 0.25 812 63.546 3.36716e-07 -3.53993 63.546000 Cu 0.0909091 0.159112 0.5 586 63.546 1.7692e-10 -3.53993 63.546000 Cu 0.0909091 0.159112 2.12089e-16 587 63.546 1.7692e-10 -3.53993 63.546000 Cu 0.19697 0.157218 0.75 589 63.546 3.79784e-10 -3.53993 63.546000 Cu 0.19697 0.157218 0.25 599 63.546 3.79784e-10 -3.53993 63.546000 Cu 0.30303 0.155324 0.5 639 63.546 5.70048e-10 -3.53993 63.546000 Cu 0.409091 0.15343 0.75 650 63.546 6.14032e-10 -3.53993 63.546000 Cu 0.30303 0.155324 4.55448e-17 652 63.546 5.70048e-10 -3.53993 63.546000 Cu 0.409091 0.15343 0.25 654 63.546 6.14032e-10 -3.53993 63.546000 Cu 0.515152 0.151537 0.5 716 63.546 5.43219e-10 -3.53993 63.546000 Cu 0.515152 0.151537 1.24738e-16 717 63.546 5.43219e-10 -3.53993 63.546000 Cu 0.621212 0.149643 0.75 719 63.546 5.69517e-10 -3.53993 63.546000 Cu 0.621212 0.149643 0.25 729 63.546 5.69517e-10 -3.53993 63.546000 Cu 0.727273 0.147749 0.5 791 63.546 9.70624e-10 -3.53993 63.546000 Cu 0.772727 0.164793 0.75 795 63.546 3.85665e-12 -3.53993 63.546000 Cu 0.833333 0.145855 0.75 802 63.546 2.40194e-09 -3.53993 63.546000 Cu 0.727273 0.147749 2.48287e-16 804 63.546 9.70624e-10 -3.53993 63.546000 Cu 0.772727 0.164793 0.25 805 63.546 3.85665e-12 -3.53993 63.546000 Cu 0.833333 0.145855 0.25 806 63.546 2.40194e-09 -3.53993 63.546000 Cu 0.878788 0.1629 0.5 867 63.546 1.51998e-11 -3.53993 63.546000 Cu 0.939394 0.143961 0.5 875 63.546 7.00465e-09 -3.53993 63.546000 Cu 0.939394 0.143961 1 876 63.546 7.00465e-09 -3.53993 63.546000 Cu 0.984848 0.161006 0.75 877 63.546 5.88611e-11 -3.53993 63.546000 Cu 0.878788 0.1629 1.24908e-16 878 63.546 1.51998e-11 -3.53993 63.546000 Cu 0.984848 0.161006 0.25 880 63.546 5.88611e-11 -3.53993 63.546000 Cu 0.030303 0.17805 0.5 581 63.546 1.48648e-13 -3.53993 63.546000 Cu 0.136364 0.176156 0.75 588 63.546 4.2394e-13 -3.53993 63.546000 Cu 0.030303 0.17805 1 590 63.546 1.48648e-13 -3.53993 63.546000 Cu 0.136364 0.176156 0.25 592 63.546 4.2394e-13 -3.53993 63.546000 Cu 0.242424 0.174262 0.5 640 63.546 8.28829e-13 -3.53993 63.546000 Cu 0.242424 0.174262 1.72492e-16 641 63.546 8.28829e-13 -3.53993 63.546000 Cu 0.348485 0.172369 0.75 643 63.546 1.13238e-12 -3.53993 63.546000 Cu 0.348485 0.172369 0.25 653 63.546 1.13238e-12 -3.53993 63.546000 Cu 0.393939 0.189413 0.5 708 63.546 3.92603e-16 -3.53993 63.546000 Cu 0.393939 0.189413 1 709 63.546 3.92603e-16 -3.53993 63.546000 Cu 0.454545 0.170475 0.5 707 63.546 1.16207e-12 -3.53993 63.546000 Cu 0.5 0.187519 0.75 711 63.546 3.97927e-16 -3.53993 63.546000 Cu 0.560606 0.168581 0.75 718 63.546 1.10545e-12 -3.53993 63.546000 Cu 0.454545 0.170475 3.39887e-19 720 63.546 1.16207e-12 -3.53993 63.546000 Cu 0.5 0.187519 0.25 721 63.546 3.97927e-16 -3.53993 63.546000 Cu 0.560606 0.168581 0.25 722 63.546 1.10545e-12 -3.53993 63.546000 Cu 0.606061 0.185625 0.5 783 63.546 4.66499e-16 -3.53993 63.546000 Cu 0.666667 0.166687 0.5 792 63.546 1.48625e-12 -3.53993 63.546000 Cu 0.666667 0.166687 2.80746e-16 793 63.546 1.48625e-12 -3.53993 63.546000 Cu 0.712121 0.183732 0.75 794 63.546 1.21281e-15 -3.53993 63.546000 Cu 0.606061 0.185625 0 796 63.546 4.66499e-16 -3.53993 63.546000 Cu 0.712121 0.183732 0.25 798 63.546 1.21281e-15 -3.53993 63.546000 Cu 0.818182 0.181838 0.5 868 63.546 6.53436e-15 -3.53993 63.546000 Cu 0.818182 0.181838 2.86694e-16 869 63.546 6.53435e-15 -3.53993 63.546000 Cu 0.924242 0.179944 0.75 871 63.546 3.60654e-14 -3.53993 63.546000 Cu 0.924242 0.179944 0.25 879 63.546 3.60654e-14 -3.53993 63.546000 Cu 0.0151515 0.214033 0.75 582 63.546 6.65266e-22 -3.53993 63.546000 Cu 0.0757576 0.195095 0.75 583 63.546 7.1244e-17 -3.53993 63.546000 Cu 0.0151515 0.214033 0.25 584 63.546 6.64629e-22 -3.53993 63.546000 Cu 0.0757576 0.195095 0.25 591 63.546 7.12446e-17 -3.53993 63.546000 Cu 0.121212 0.212139 0.5 632 63.546 1.95343e-21 -3.53993 63.546000 Cu 0.121212 0.212139 1.64505e-16 633 63.546 1.95343e-21 -3.53993 63.546000 Cu 0.181818 0.193201 0.5 631 63.546 1.80604e-16 -3.53993 63.546000 Cu 0.227273 0.210245 0.75 635 63.546 4.0657e-21 -3.53993 63.546000 Cu 0.181818 0.193201 1 644 63.546 1.80604e-16 -3.53993 63.546000 Cu 0.227273 0.210245 0.25 645 63.546 4.0657e-21 -3.53993 63.546000 Cu 0.287879 0.191307 0.75 642 63.546 3.14254e-16 -3.53993 63.546000 Cu 0.287879 0.191307 0.25 646 63.546 3.14254e-16 -3.53993 63.546000 Cu 0.333333 0.208351 0.5 699 63.546 6.19072e-21 -3.53993 63.546000 Cu 0.333333 0.208351 7.98734e-18 712 63.546 6.19072e-21 -3.53993 63.546000 Cu 0.439394 0.206457 0.75 710 63.546 7.3734e-21 -3.53993 63.546000 Cu 0.439394 0.206457 0.25 714 63.546 7.3734e-21 -3.53993 63.546000 Cu 0.545455 0.204564 0.5 784 63.546 9.69419e-21 -3.53993 63.546000 Cu 0.545455 0.204564 1 785 63.546 9.69419e-21 -3.53993 63.546000 Cu 0.651515 0.20267 0.75 787 63.546 3.95626e-20 -3.53993 63.546000 Cu 0.651515 0.20267 0.25 797 63.546 3.95628e-20 -3.53993 63.546000 Cu 0.757576 0.200776 0.5 859 63.546 3.89586e-19 -3.53993 63.546000 Cu 0.757576 0.200776 0 872 63.546 3.89665e-19 -3.53993 63.546000 Cu 0.863636 0.198882 0.75 870 63.546 3.29854e-18 -3.53993 63.546000 Cu 0.863636 0.198882 0.25 874 63.546 3.29854e-18 -3.53993 63.546000 Cu 0.969697 0.196988 0.5 941 63.546 1.88503e-17 -3.53993 63.546000 Cu 0.969697 0.196988 1.17261e-17 942 63.546 1.88503e-17 -3.53993 63.546000 Cu 0.0606061 0.231077 0.5 625 63.546 1.95267e-25 -3.53993 63.546000 Cu 0.0606061 0.231077 1 636 63.546 1.95326e-25 -3.53993 63.546000 Cu 0.166667 0.229183 0.75 634 63.546 4.20543e-25 -3.53993 63.546000 Cu 0.166667 0.229183 0.25 638 63.546 4.20541e-25 -3.53993 63.546000 Cu 0.272727 0.22729 0.5 700 63.546 8.89242e-25 -3.53993 63.546000 Cu 0.272727 0.22729 1 701 63.546 8.89406e-25 -3.53993 63.546000 Cu 0.378788 0.225396 0.75 703 63.546 1.23698e-24 -3.53993 63.546000 Cu 0.378788 0.225396 0.25 713 63.546 1.23645e-24 -3.53993 63.546000 Cu 0.484848 0.223502 0.5 775 63.546 1.27546e-24 -3.53993 63.546000 Cu 0.484848 0.223502 0 788 63.546 1.27582e-24 -3.53993 63.546000 Cu 0.590909 0.221608 0.75 786 63.546 1.95354e-24 -3.53993 63.546000 Cu 0.590909 0.221608 0.25 790 63.546 1.95361e-24 -3.53993 63.546000 Cu 0.69697 0.219714 0.5 860 63.546 5.70149e-24 -3.53993 63.546000 Cu 0.69697 0.219714 0 861 63.546 5.58188e-24 -3.53993 63.546000 Cu 0.742424 0.236759 0.75 862 63.546 5.06528e-27 -3.53993 63.546000 Cu 0.80303 0.21782 0.75 863 63.546 3.14286e-23 -3.53993 63.546000 Cu 0.742424 0.236759 0.25 866 63.546 7.22912e-27 -3.53993 63.546000 Cu 0.80303 0.21782 0.25 873 63.546 3.14286e-23 -3.53993 63.546000 Cu 0.848485 0.234865 0.5 934 63.546 5.91882e-27 -3.53993 63.546000 Cu 0.848485 0.234865 1 935 63.546 6.93882e-27 -3.53993 63.546000 Cu 0.909091 0.215927 0.5 933 63.546 1.66966e-22 -3.53993 63.546000 Cu 0.954545 0.232971 0.75 937 63.546 5.41671e-26 -3.53993 63.546000 Cu 0.909091 0.215927 1 943 63.546 1.66966e-22 -3.53993 63.546000 Cu 0.954545 0.232971 0.25 944 63.546 6.52668e-26 -3.53993 63.546000 Cu 2.71863e-16 0.250015 0.5 626 63.546 3.27673e-27 -3.53993 63.546000 Cu 2.8944e-16 0.250015 4.04635e-16 627 63.546 3.16519e-27 -3.53993 63.546000 Cu 0.106061 0.248122 0.75 629 63.546 1.15174e-27 -3.53993 63.546000 Cu 0.106061 0.248122 0.25 637 63.546 1.16968e-27 -3.53993 63.546000 Cu 0.212121 0.246228 0.5 691 63.546 4.39396e-28 -3.53993 63.546000 Cu 0.212121 0.246228 1 704 63.546 4.03897e-28 -3.53993 63.546000 Cu 0.318182 0.244334 0.75 702 63.546 5.71135e-28 -3.53993 63.546000 Cu 0.318182 0.244334 0.25 706 63.546 5.49047e-28 -3.53993 63.546000 Cu 0.363636 0.261378 0.5 767 63.546 3.29349e-27 -3.53993 63.546000 Cu 0.424242 0.24244 0.5 776 63.546 1.01763e-27 -3.53993 63.546000 Cu 0.424242 0.24244 1 777 63.546 1.11072e-27 -3.53993 63.546000 Cu 0.363636 0.261378 0 780 63.546 3.13332e-27 -3.53993 63.546000 Cu 0.469697 0.259484 0.75 778 63.546 4.36477e-27 -3.53993 63.546000 Cu 0.530303 0.240546 0.75 779 63.546 1.45229e-27 -3.53993 63.546000 Cu 0.469697 0.259484 0.25 782 63.546 4.32513e-27 -3.53993 63.546000 Cu 0.530303 0.240546 0.25 789 63.546 1.38189e-27 -3.53993 63.546000 Cu 0.636364 0.238652 0.5 851 63.546 1.78283e-27 -3.53993 63.546000 Cu 0.575758 0.257591 0.5 852 63.546 1.02946e-27 -3.53993 63.546000 Cu 0.575758 0.257591 1 853 63.546 1.03183e-27 -3.53993 63.546000 Cu 0.681818 0.255697 0.75 855 63.546 1.6645e-27 -3.53993 63.546000 Cu 0.636364 0.238652 2.43019e-17 864 63.546 1.79435e-27 -3.53993 63.546000 Cu 0.681818 0.255697 0.25 865 63.546 1.79939e-27 -3.53993 63.546000 Cu 0.787879 0.253803 0.5 925 63.546 1.23299e-27 -3.53993 63.546000 Cu 0.787879 0.253803 1 938 63.546 1.35369e-27 -3.53993 63.546000 Cu 0.893939 0.251909 0.75 936 63.546 3.2154e-27 -3.53993 63.546000 Cu 0.893939 0.251909 0.25 940 63.546 2.85863e-27 -3.53993 63.546000 Cu 0.0454545 0.26706 0.75 628 63.546 6.80572e-26 -3.53993 63.546000 Cu 0.0454545 0.26706 0.25 630 63.546 6.78062e-26 -3.53993 63.546000 Cu 0.0909091 0.284104 0.5 684 63.546 1.64331e-22 -3.53993 63.546000 Cu 0.0909091 0.284104 1.69943e-19 696 63.546 1.65333e-22 -3.53993 63.546000 Cu 0.151515 0.265166 0.5 692 63.546 1.12144e-26 -3.53993 63.546000 Cu 0.151515 0.265166 1 693 63.546 1.32442e-26 -3.53993 63.546000 Cu 0.19697 0.28221 0.75 694 63.546 3.16091e-23 -3.53993 63.546000 Cu 0.257576 0.263272 0.75 695 63.546 1.21011e-27 -3.53993 63.546000 Cu 0.19697 0.28221 0.25 698 63.546 3.16065e-23 -3.53993 63.546000 Cu 0.257576 0.263272 0.25 705 63.546 1.20676e-27 -3.53993 63.546000 Cu 0.30303 0.280317 0.5 768 63.546 5.78192e-24 -3.53993 63.546000 Cu 0.30303 0.280317 1 769 63.546 5.77981e-24 -3.53993 63.546000 Cu 0.409091 0.278423 0.75 771 63.546 1.75053e-24 -3.53993 63.546000 Cu 0.409091 0.278423 0.25 781 63.546 1.75053e-24 -3.53993 63.546000 Cu 0.515152 0.276529 0.5 843 63.546 1.50992e-24 -3.53993 63.546000 Cu 0.515152 0.276529 2.43019e-17 856 63.546 1.50993e-24 -3.53993 63.546000 Cu 0.621212 0.274635 0.75 854 63.546 1.20021e-24 -3.53993 63.546000 Cu 0.621212 0.274635 0.25 858 63.546 1.20248e-24 -3.53993 63.546000 Cu 0.727273 0.272741 0.5 926 63.546 7.44624e-25 -3.53993 63.546000 Cu 0.727273 0.272741 1 927 63.546 7.44628e-25 -3.53993 63.546000 Cu 0.833333 0.270847 0.75 929 63.546 4.5257e-25 -3.53993 63.546000 Cu 0.833333 0.270847 0.25 939 63.546 4.73323e-25 -3.53993 63.546000 Cu 0.939394 0.268954 0.5 985 63.546 1.41985e-25 -3.53993 63.546000 Cu 0.939394 0.268954 1 993 63.546 1.50672e-25 -3.53993 63.546000 Cu 0.030303 0.303042 0.5 685 63.546 1.88143e-17 -3.53993 63.546000 Cu 0.030303 0.303042 3.39887e-19 686 63.546 1.88142e-17 -3.53993 63.546000 Cu 0.136364 0.301149 0.75 688 63.546 3.29391e-18 -3.53993 63.546000 Cu 0.136364 0.301149 0.25 697 63.546 3.29391e-18 -3.53993 63.546000 Cu 0.242424 0.299255 0.5 759 63.546 3.8883e-19 -3.53993 63.546000 Cu 0.242424 0.299255 7.81739e-17 772 63.546 3.88831e-19 -3.53993 63.546000 Cu 0.348485 0.297361 0.75 770 63.546 3.93343e-20 -3.53993 63.546000 Cu 0.348485 0.297361 0.25 774 63.546 3.93343e-20 -3.53993 63.546000 Cu 0.454545 0.295467 0.5 844 63.546 9.55503e-21 -3.53993 63.546000 Cu 0.454545 0.295467 1.14372e-16 845 63.546 9.55506e-21 -3.53993 63.546000 Cu 0.560606 0.293573 0.75 847 63.546 7.27223e-21 -3.53993 63.546000 Cu 0.560606 0.293573 0.25 857 63.546 7.27223e-21 -3.53993 63.546000 Cu 0.666667 0.291679 0.5 917 63.546 6.14015e-21 -3.53993 63.546000 Cu 0.712121 0.308724 0.75 921 63.546 3.12173e-16 -3.53993 63.546000 Cu 0.666667 0.291679 1 930 63.546 6.14015e-21 -3.53993 63.546000 Cu 0.712121 0.308724 0.25 931 63.546 3.12174e-16 -3.53993 63.546000 Cu 0.772727 0.289786 0.75 928 63.546 4.0547e-21 -3.53993 63.546000 Cu 0.772727 0.289786 0.25 932 63.546 4.04541e-21 -3.53993 63.546000 Cu 0.818182 0.30683 0.5 977 63.546 1.79813e-16 -3.53993 63.546000 Cu 0.818182 0.30683 1 990 63.546 1.79813e-16 -3.53993 63.546000 Cu 0.878788 0.287892 0.5 986 63.546 1.94522e-21 -3.53993 63.546000 Cu 0.878788 0.287892 1 987 63.546 1.941e-21 -3.53993 63.546000 Cu 0.924242 0.304936 0.75 988 63.546 7.10412e-17 -3.53993 63.546000 Cu 0.984848 0.285998 0.75 989 63.546 6.67344e-22 -3.53993 63.546000 Cu 0.924242 0.304936 0.25 992 63.546 7.10412e-17 -3.53993 63.546000 Cu 0.984848 0.285998 0.25 994 63.546 6.67344e-22 -3.53993 63.546000 Cu 0.0757576 0.320087 0.75 687 63.546 3.59766e-14 -3.53993 63.546000 Cu 0.0757576 0.320087 0.25 690 63.546 3.59766e-14 -3.53993 63.546000 Cu 0.181818 0.318193 0.5 760 63.546 6.5136e-15 -3.53993 63.546000 Cu 0.181818 0.318193 1.92036e-17 761 63.546 6.5136e-15 -3.53993 63.546000 Cu 0.287879 0.316299 0.75 763 63.546 1.2044e-15 -3.53993 63.546000 Cu 0.287879 0.316299 0.25 773 63.546 1.2044e-15 -3.53993 63.546000 Cu 0.393939 0.314405 0.5 835 63.546 4.60522e-16 -3.53993 63.546000 Cu 0.393939 0.314405 1 848 63.546 4.60522e-16 -3.53993 63.546000 Cu 0.439394 0.33145 0.75 839 63.546 1.08477e-12 -3.53993 63.546000 Cu 0.5 0.312512 0.75 846 63.546 3.92801e-16 -3.53993 63.546000 Cu 0.439394 0.33145 0.25 849 63.546 1.08477e-12 -3.53993 63.546000 Cu 0.5 0.312512 0.25 850 63.546 3.92802e-16 -3.53993 63.546000 Cu 0.545455 0.329556 0.5 909 63.546 1.14424e-12 -3.53993 63.546000 Cu 0.545455 0.329556 3.22892e-17 922 63.546 1.14424e-12 -3.53993 63.546000 Cu 0.606061 0.310618 0.5 918 63.546 3.88802e-16 -3.53993 63.546000 Cu 0.606061 0.310618 1.10463e-17 919 63.546 3.88802e-16 -3.53993 63.546000 Cu 0.651515 0.327662 0.75 920 63.546 1.12057e-12 -3.53993 63.546000 Cu 0.651515 0.327662 0.25 924 63.546 1.12057e-12 -3.53993 63.546000 Cu 0.757576 0.325768 0.5 978 63.546 8.23272e-13 -3.53993 63.546000 Cu 0.757576 0.325768 1 979 63.546 8.23272e-13 -3.53993 63.546000 Cu 0.863636 0.323874 0.75 981 63.546 4.22108e-13 -3.53993 63.546000 Cu 0.863636 0.323874 0.25 991 63.546 4.22108e-13 -3.53993 63.546000 Cu 0.969697 0.321981 0.5 1023 63.546 1.48207e-13 -3.53993 63.546000 Cu 0.969697 0.321981 0 1030 63.546 1.48207e-13 -3.53993 63.546000 Cu 0.0151515 0.339025 0.75 683 63.546 5.86354e-11 -3.53993 63.546000 Cu 0.0151515 0.339025 0.25 689 63.546 5.86354e-11 -3.53993 63.546000 Cu 0.121212 0.337131 0.5 751 63.546 1.51356e-11 -3.53993 63.546000 Cu 0.060606 0.356069 0.5 752 63.546 6.96388e-09 -3.53993 63.546000 Cu 0.060606 0.356069 0 753 63.546 6.96388e-09 -3.53993 63.546000 Cu 0.121212 0.337131 2.05801e-16 764 63.546 1.51356e-11 -3.53993 63.546000 Cu 0.166667 0.354176 0.75 755 63.546 2.38385e-09 -3.53993 63.546000 Cu 0.227273 0.335237 0.75 762 63.546 3.82821e-12 -3.53993 63.546000 Cu 0.166667 0.354176 0.25 765 63.546 2.38385e-09 -3.53993 63.546000 Cu 0.227273 0.335237 0.25 766 63.546 3.82821e-12 -3.53993 63.546000 Cu 0.272727 0.352282 0.5 827 63.546 9.56201e-10 -3.53993 63.546000 Cu 0.272727 0.352282 1 840 63.546 9.56201e-10 -3.53993 63.546000 Cu 0.333333 0.333344 0.5 836 63.546 1.46439e-12 -3.53993 63.546000 Cu 0.333333 0.333344 1.69943e-19 837 63.546 1.46439e-12 -3.53993 63.546000 Cu 0.378788 0.350388 0.75 838 63.546 5.54629e-10 -3.53993 63.546000 Cu 0.378788 0.350388 0.25 842 63.546 5.54629e-10 -3.53993 63.546000 Cu 0.484848 0.348494 0.5 910 63.546 5.28588e-10 -3.53993 63.546000 Cu 0.484848 0.348494 2.43019e-17 911 63.546 5.28588e-10 -3.53993 63.546000 Cu 0.590909 0.3466 0.75 913 63.546 6.02382e-10 -3.53993 63.546000 Cu 0.590909 0.3466 0.25 923 63.546 6.02382e-10 -3.53993 63.546000 Cu 0.69697 0.344707 0.5 969 63.546 5.63293e-10 -3.53993 63.546000 Cu 0.69697 0.344707 1 982 63.546 5.63293e-10 -3.53993 63.546000 Cu 0.80303 0.342813 0.75 980 63.546 3.77005e-10 -3.53993 63.546000 Cu 0.80303 0.342813 0.25 984 63.546 3.77005e-10 -3.53993 63.546000 Cu 0.909091 0.340919 0.5 1024 63.546 1.76065e-10 -3.53993 63.546000 Cu 0.909091 0.340919 0 1025 63.546 1.76065e-10 -3.53993 63.546000 Cu 0.10606 0.373114 0.75 754 63.546 3.33766e-07 -3.53993 63.546000 Cu 0.10606 0.373114 0.25 758 63.546 3.33766e-07 -3.53993 63.546000 Cu 0.212121 0.37122 0.5 828 63.546 1.69771e-07 -3.53993 63.546000 Cu 0.212121 0.37122 2.87204e-17 829 63.546 1.69771e-07 -3.53993 63.546000 Cu 0.318182 0.369326 0.75 831 63.546 8.4117e-08 -3.53993 63.546000 Cu 0.318182 0.369326 0.25 841 63.546 8.4117e-08 -3.53993 63.546000 Cu 0.424242 0.367433 0.5 901 63.546 5.57818e-08 -3.53993 63.546000 Cu 0.424242 0.367433 8.6841e-17 914 63.546 5.57818e-08 -3.53993 63.546000 Cu 0.530303 0.365539 0.75 912 63.546 6.44972e-08 -3.53993 63.546000 Cu 0.530303 0.365539 0.25 916 63.546 6.44972e-08 -3.53993 63.546000 Cu 0.636364 0.363645 0.5 970 63.546 7.72999e-08 -3.53993 63.546000 Cu 0.636364 0.363645 1 971 63.546 7.72999e-08 -3.53993 63.546000 Cu 0.681819 0.380691 0.75 972 63.546 2.36766e-06 -3.53993 63.546000 Cu 0.681819 0.380691 0.25 976 63.546 2.36766e-06 -3.53993 63.546000 Cu 0.742424 0.361751 0.75 973 63.546 6.8202e-08 -3.53993 63.546000 Cu 0.742424 0.361751 0.25 983 63.546 6.8202e-08 -3.53993 63.546000 Cu 0.848485 0.359857 0.5 1015 63.546 4.24693e-08 -3.53993 63.546000 Cu 0.787879 0.378797 0.5 1016 63.546 2.01651e-06 -3.53993 63.546000 Cu 0.787879 0.378797 1 1017 63.546 2.01651e-06 -3.53993 63.546000 Cu 0.848485 0.359857 0 1027 63.546 4.24693e-08 -3.53993 63.546000 Cu 1 0.375008 0.5 749 63.546 6.62957e-07 -3.53993 63.546000 Cu 1 0.375008 0 756 63.546 6.62957e-07 -3.53993 63.546000 Cu 0.893939 0.376903 0.75 1019 63.546 1.27697e-06 -3.53993 63.546000 Cu 0.954545 0.357963 0.75 1026 63.546 1.92684e-08 -3.53993 63.546000 Cu 0.893939 0.376903 0.25 1028 63.546 1.27697e-06 -3.53993 63.546000 Cu 0.954545 0.357963 0.25 1029 63.546 1.92684e-08 -3.53993 63.546000 Cu 0.0454517 0.392056 0.75 750 63.546 9.11905e-06 -3.53994 63.546000 Cu 0.0454517 0.392056 0.25 757 63.546 9.11905e-06 -3.53994 63.546000 Cu 0.151514 0.390161 0.5 819 63.546 7.68662e-06 -3.53994 63.546000 Cu 0.257575 0.388267 0.75 830 63.546 4.52423e-06 -3.53993 63.546000 Cu 0.151514 0.390161 0 832 63.546 7.68662e-06 -3.53994 63.546000 Cu 0.257575 0.388267 0.25 834 63.546 4.52423e-06 -3.53993 63.546000 Cu 0.363636 0.386372 0.5 902 63.546 1.78308e-06 -3.53993 63.546000 Cu 0.363636 0.386372 6.79773e-19 903 63.546 1.78308e-06 -3.53993 63.546000 Cu 0.409088 0.403423 0.75 904 63.546 6.87525e-06 -3.53994 63.546000 Cu 0.409088 0.403423 0.25 908 63.546 6.87525e-06 -3.53994 63.546000 Cu 0.469698 0.384478 0.75 905 63.546 1.23368e-06 -3.53993 63.546000 Cu 0.469698 0.384478 0.25 915 63.546 1.23368e-06 -3.53993 63.546000 Cu 0.515159 0.401529 0.5 962 63.546 4.97389e-06 -3.53994 63.546000 Cu 0.515159 0.401529 1.55328e-16 963 63.546 4.97389e-06 -3.53994 63.546000 Cu 0.575759 0.382585 0.5 961 63.546 1.90027e-06 -3.53993 63.546000 Cu 0.621224 0.399638 0.75 965 63.546 9.54256e-06 -3.53994 63.546000 Cu 0.575759 0.382585 1 974 63.546 1.90027e-06 -3.53993 63.546000 Cu 0.621224 0.399638 0.25 975 63.546 9.54256e-06 -3.53994 63.546000 Cu 0.727279 0.397744 0.5 1007 63.546 1.20652e-05 -3.53994 63.546000 Cu 0.833332 0.395849 0.75 1018 63.546 1.20039e-05 -3.53994 63.546000 Cu 0.727279 0.397744 1 1020 63.546 1.20652e-05 -3.53994 63.546000 Cu 0.833332 0.395849 0.25 1022 63.546 1.20039e-05 -3.53994 63.546000 Cu 0.93939 0.393952 1.29157e-17 451 63.546 1.05101e-05 -3.53994 63.546000 Cu 0.93939 0.393952 0.5 455 63.546 1.05101e-05 -3.53994 63.546000 Cu 0.0303345 0.428116 0.5 815 63.546 0.00031168 -3.53977 63.546000 Cu 0.0909049 0.409118 0.5 820 63.546 7.04134e-05 -3.53993 63.546000 Cu 0.0909049 0.409118 1.69943e-19 821 63.546 7.04134e-05 -3.53993 63.546000 Cu 0.136368 0.42622 0.75 822 63.546 0.000245393 -3.5398 63.546000 Cu 0.0303345 0.428116 1 824 63.546 0.00031168 -3.53977 63.546000 Cu 0.136368 0.42622 0.25 826 63.546 0.000245393 -3.5398 63.546000 Cu 0.19697 0.407221 0.75 823 63.546 6.72766e-05 -3.53993 63.546000 Cu 0.19697 0.407221 0.25 833 63.546 6.72766e-05 -3.53993 63.546000 Cu 0.242419 0.424318 0.5 894 63.546 0.000179417 -3.53983 63.546000 Cu 0.242419 0.424318 6.32189e-17 895 63.546 0.000179417 -3.53983 63.546000 Cu 0.303021 0.40532 0.5 893 63.546 4.08615e-05 -3.53993 63.546000 Cu 0.348394 0.422382 0.75 897 63.546 0.000313057 -3.53985 63.546000 Cu 0.303021 0.40532 4.92836e-17 906 63.546 4.08615e-05 -3.53993 63.546000 Cu 0.348394 0.422382 0.25 907 63.546 0.000313057 -3.53985 63.546000 Cu 0.454532 0.420476 0.5 953 63.546 6.49672e-05 -3.53995 63.546000 Cu 0.560656 0.418591 0.75 964 63.546 3.88753e-05 -3.53994 63.546000 Cu 0.454532 0.420476 6.96768e-18 966 63.546 6.49672e-05 -3.53995 63.546000 Cu 0.560656 0.418591 0.25 968 63.546 3.88753e-05 -3.53994 63.546000 Cu 0.666716 0.416708 0.5 1008 63.546 1.02318e-05 -3.53994 63.546000 Cu 0.666716 0.416708 1 1009 63.546 1.02318e-05 -3.53994 63.546000 Cu 0.772747 0.414815 0.75 1011 63.546 5.66464e-06 -3.53993 63.546000 Cu 0.772747 0.414815 0.25 1021 63.546 5.66464e-06 -3.53993 63.546000 Cu 0.984837 0.411016 0.25 148 63.546 4.75409e-05 -3.53994 63.546000 Cu 0.878777 0.412916 2.43019e-17 405 63.546 1.46035e-05 -3.53994 63.546000 Cu 0.984837 0.411016 0.75 408 63.546 4.75409e-05 -3.53994 63.546000 Cu 0.878777 0.412916 0.5 1039 63.546 1.46035e-05 -3.53994 63.546000 Cu 0.0759446 0.445314 0.75 817 63.546 0.00108203 -3.53893 63.546000 Cu 0.0759446 0.445314 0.25 825 63.546 0.00108203 -3.53893 63.546000 Cu 0.181759 0.443382 0.5 885 63.546 0.00113566 -3.53931 63.546000 Cu 0.181759 0.443382 1 898 63.546 0.00113566 -3.53931 63.546000 Cu 0.287759 0.441466 0.75 896 63.546 0.000675607 -3.53951 63.546000 Cu 0.287759 0.441466 0.25 900 63.546 0.000675607 -3.53951 63.546000 Cu 0.393575 0.439419 0.5 954 63.546 0.00214901 -3.5396 63.546000 Cu 0.393575 0.439419 5.18327e-17 955 63.546 0.00214901 -3.5396 63.546000 Cu 0.499991 0.437516 0.75 957 63.546 0.000230053 -3.53996 63.546000 Cu 0.499991 0.437516 0.25 967 63.546 0.000230053 -3.53996 63.546000 Cu 0.606269 0.43567 0.5 999 63.546 0.000407744 -3.53984 63.546000 Cu 0.712225 0.433784 0.75 1010 63.546 0.000173979 -3.53989 63.546000 Cu 0.606269 0.43567 1.69943e-19 1012 63.546 0.000407744 -3.53984 63.546000 Cu 0.712225 0.433784 0.25 1014 63.546 0.000173979 -3.53989 63.546000 Cu 0.757609 0.450893 1.69943e-19 491 63.546 0.00159901 -3.53952 63.546000 Cu 0.818198 0.431895 6.03299e-17 530 63.546 1.10589e-05 -3.53992 63.546000 Cu 0.757609 0.450893 0.5 1032 63.546 0.00159901 -3.53952 63.546000 Cu 0.818198 0.431895 0.5 1040 63.546 1.10589e-05 -3.53992 63.546000 Cu 0.969937 0.447145 1 50 63.546 0.000714119 -3.53952 63.546000 Cu 0.969937 0.447145 0.5 52 63.546 0.000714119 -3.53952 63.546000 Cu 0.924251 0.430002 0.25 149 63.546 0.00013477 -3.53988 63.546000 Cu 0.863652 0.448974 0.25 459 63.546 0.000436821 -3.53988 63.546000 Cu 0.924251 0.430002 0.75 492 63.546 0.00013477 -3.53988 63.546000 Cu 0.863652 0.448974 0.75 529 63.546 0.000436821 -3.53988 63.546000 Cu 0.0157538 0.464406 0.75 816 63.546 0.0051568 -3.53862 63.546000 Cu 0.0157538 0.464406 0.25 818 63.546 0.0051568 -3.53862 63.546000 Cu 0.121645 0.462676 0.5 886 63.546 0.00787228 -3.53558 63.546000 Cu 0.121645 0.462676 0 887 63.546 0.00787228 -3.53558 63.546000 Cu 0.226773 0.46061 0.75 889 63.546 0.00782683 -3.53703 63.546000 Cu 0.226773 0.46061 0.25 899 63.546 0.00782683 -3.53703 63.546000 Cu 0.332934 0.458654 0.5 946 63.546 0.00256711 -3.53871 63.546000 Cu 0.379189 0.475866 0.75 950 63.546 0.0284564 -3.53651 63.546000 Cu 0.332934 0.458654 1 958 63.546 0.00256711 -3.53871 63.546000 Cu 0.379189 0.475866 0.25 959 63.546 0.0284564 -3.53651 63.546000 Cu 0.438943 0.456478 0.75 956 63.546 0.00667065 -3.53918 63.546000 Cu 0.438943 0.456478 0.25 960 63.546 0.00667065 -3.53918 63.546000 Cu 0.484186 0.473356 0.5 995 63.546 0.0521473 -3.53661 63.546000 Cu 0.5456 0.454582 0.5 1000 63.546 0.00200925 -3.53991 63.546000 Cu 0.5456 0.454582 1.85238e-17 1001 63.546 0.00200925 -3.53991 63.546000 Cu 0.484186 0.473356 1 1004 63.546 0.0521473 -3.53661 63.546000 Cu 0.592139 0.471586 0.75 1002 63.546 0.0176024 -3.53615 63.546000 Cu 0.652007 0.452835 0.75 1003 63.546 0.00378392 -3.53886 63.546000 Cu 0.592139 0.471586 0.25 1006 63.546 0.0176024 -3.53615 63.546000 Cu 0.652007 0.452835 0.25 1013 63.546 0.00378392 -3.53886 63.546000 Cu 0.697678 0.470179 0.5 1033 63.546 0.0194217 -3.5381 63.546000 Cu 0.697678 0.470179 1 1034 63.546 0.0194217 -3.5381 63.546000 Cu 0.802786 0.468043 0.25 460 63.546 0.0102681 -3.53746 63.546000 Cu 0.802786 0.468043 0.75 1036 63.546 0.0102681 -3.53746 63.546000 Cu 0.909074 0.466068 0 49 63.546 0.00493062 -3.53969 63.546000 Cu 0.909074 0.466068 0.5 99 63.546 0.00493062 -3.53969 63.546000 Cu 0.0614641 0.481791 0.5 881 63.546 0.0295246 -3.53273 63.546000 Cu 0.105957 0.499724 0.75 884 63.546 5.39216 -3.52576 63.546000 Cu 0.0614641 0.481791 1 890 63.546 0.0295246 -3.53273 63.546000 Cu 0.105957 0.499724 0.25 891 63.546 5.39216 -3.52576 63.546000 Cu 0.16705 0.480406 0.75 888 63.546 0.0444817 -3.52673 63.546000 Cu 0.16705 0.480406 0.25 892 63.546 0.0444817 -3.52673 63.546000 Cu 0.21306 0.498418 0.5 945 63.546 5.82715 -3.42624 63.546000 Cu 0.271621 0.477861 0.5 947 63.546 0.0653228 -3.53074 63.546000 Cu 0.271621 0.477861 2.43019e-17 948 63.546 0.0653228 -3.53074 63.546000 Cu 0.21306 0.498418 5.03032e-17 951 63.546 5.82715 -3.42624 63.546000 Cu 0.318804 0.494346 0.75 949 63.546 0 -3.17697 63.546000 Cu 0.318804 0.494346 0.25 952 63.546 0 -3.17697 63.546000 Cu 0.427568 0.493054 0.5 996 63.546 0 -3.30766 63.546000 Cu 0.427568 0.493054 1 997 63.546 0 -3.30766 63.546000 Cu 0.531222 0.489804 0.75 998 63.546 7.45476 -3.35795 63.546000 Cu 0.531222 0.489804 0.25 1005 63.546 7.45476 -3.35795 63.546000 Cu 0.637302 0.488916 0.5 1031 63.546 0 -3.30756 63.546000 Cu 0.637302 0.488916 1.69943e-19 1037 63.546 0 -3.30756 63.546000 Cu 0.847405 0.484725 1 92 63.546 0 -3.18669 63.546000 Cu 0.847405 0.484725 0.5 98 63.546 0 -3.18669 63.546000 Cu 0.742836 0.48746 0.75 1035 63.546 0 -3.26639 63.546000 Cu 0.742836 0.48746 0.25 1038 63.546 0 -3.26639 63.546000 Cu 0.953647 0.483074 0.25 48 63.546 0 -3.42813 63.546000 Cu 0.953647 0.483074 0.75 91 63.546 0 -3.42813 63.546000 Cu 0.999106 0.499922 0.5 882 63.546 0 -3.31163 63.546000 Cu 0.999106 0.499922 1.92716e-16 883 63.546 0 -3.31163 63.546000 Cu 0.0626473 0.51804 0.5 147 63.546 0.0567349 -3.52939 63.546000 Cu 0.0626473 0.51804 3.26461e-16 155 63.546 0.0567349 -3.52939 63.546000 Cu 0.272317 0.52214 0.5 94 63.546 0 -3.25933 63.546000 Cu 0.272317 0.52214 5.00993e-16 95 63.546 0 -3.25933 63.546000 Cu 0.169828 0.518642 0.75 96 63.546 0.432324 -3.47781 63.546000 Cu 0.169828 0.518642 0.25 100 63.546 0.432324 -3.47781 63.546000 Cu 0.526294 0.509727 0.75 20 63.546 11.2376 -3.2458 63.546000 Cu 0.526294 0.509727 0.25 27 63.546 11.2376 -3.2458 63.546000 Cu 0.634684 0.511009 0.5 19 63.546 0 -3.30333 63.546000 Cu 0.634684 0.511009 6.05848e-16 26 63.546 0 -3.30333 63.546000 Cu 0.847531 0.515297 0.5 4 63.546 0 -3.18462 63.546000 Cu 0.847531 0.515297 4.43552e-16 5 63.546 0 -3.18462 63.546000 Cu 0.74199 0.51256 0.75 6 63.546 0 -3.26265 63.546000 Cu 0.74199 0.51256 0.25 8 63.546 0 -3.26265 63.546000 Cu 0.954312 0.516794 0.75 1 63.546 0 -3.42715 63.546000 Cu 0.954312 0.516794 0.25 2 63.546 0 -3.42715 63.546000 Cu 0.122508 0.536835 0.5 151 63.546 0.0419087 -3.52575 63.546000 Cu 0.122508 0.536835 4.16871e-16 152 63.546 0.0419087 -3.52575 63.546000 Cu 0.0164482 0.535408 0.75 153 63.546 0.00549096 -3.5382 63.546000 Cu 0.0164482 0.535408 0.25 156 63.546 0.00549096 -3.5382 63.546000 Cu 0.226584 0.539085 0.75 97 63.546 0.02716 -3.53302 63.546000 Cu 0.226584 0.539085 0.25 107 63.546 0.02716 -3.53302 63.546000 Cu 0.376987 0.52481 0.75 51 63.546 0 -3.18705 63.546000 Cu 0.376987 0.52481 0.25 59 63.546 0 -3.18705 63.546000 Cu 0.332079 0.541453 0.5 93 63.546 0.0112968 -3.53775 63.546000 Cu 0.332079 0.541453 5.89533e-16 106 63.546 0.0112968 -3.53775 63.546000 Cu 0.482909 0.526546 0.5 47 63.546 0 -3.42804 63.546000 Cu 0.545433 0.545295 0.5 54 63.546 0.00281501 -3.53984 63.546000 Cu 0.545433 0.545295 4.69893e-16 55 63.546 0.00281501 -3.53984 63.546000 Cu 0.438702 0.543482 0.75 56 63.546 0.00374149 -3.5394 63.546000 Cu 0.482909 0.526546 6.69577e-16 58 63.546 0 -3.42804 63.546000 Cu 0.438702 0.543482 0.25 60 63.546 0.00374149 -3.5394 63.546000 Cu 0.696812 0.529741 0.5 22 63.546 0.0148191 -3.53888 63.546000 Cu 0.696812 0.529741 6.17744e-16 23 63.546 0.0148191 -3.53888 63.546000 Cu 0.590248 0.528088 0.75 24 63.546 0.00952306 -3.53944 63.546000 Cu 0.651648 0.547067 0.75 25 63.546 0.00269877 -3.53921 63.546000 Cu 0.590248 0.528088 0.25 28 63.546 0.00952306 -3.53944 63.546000 Cu 0.651648 0.547067 0.25 35 63.546 0.00269877 -3.53921 63.546000 Cu 0.802601 0.531929 0.75 7 63.546 0.0113916 -3.53746 63.546000 Cu 0.802601 0.531929 0.25 14 63.546 0.0113916 -3.53746 63.546000 Cu 0.909512 0.533868 0.5 3 63.546 0.00678995 -3.53954 63.546000 Cu 0.909512 0.533868 2.12769e-16 13 63.546 0.00678995 -3.53954 63.546000 Cu 0.0764001 0.554434 0.75 154 63.546 0.00519642 -3.53653 63.546000 Cu 0.0764001 0.554434 0.25 163 63.546 0.00519642 -3.53653 63.546000 Cu 0.181611 0.556419 0.5 150 63.546 0.00391507 -3.53784 63.546000 Cu 0.181611 0.556419 4.91986e-16 162 63.546 0.00391507 -3.53784 63.546000 Cu 0.393546 0.560559 0.5 102 63.546 0.00131767 -3.53972 63.546000 Cu 0.393546 0.560559 4.76351e-16 103 63.546 0.00131767 -3.53972 63.546000 Cu 0.287264 0.55853 0.75 104 63.546 0.00277592 -3.53887 63.546000 Cu 0.287264 0.55853 0.25 108 63.546 0.00277592 -3.53887 63.546000 Cu 0.500022 0.56243 0.75 57 63.546 0.000478239 -3.53992 63.546000 Cu 0.500022 0.56243 0.25 67 63.546 0.000478239 -3.53992 63.546000 Cu 0.712111 0.566182 0.75 32 63.546 0.000260787 -3.53982 63.546000 Cu 0.712111 0.566182 0.25 36 63.546 0.000260787 -3.53982 63.546000 Cu 0.606182 0.564275 0.5 53 63.546 0.000454215 -3.53976 63.546000 Cu 0.606182 0.564275 7.60666e-16 66 63.546 0.000454215 -3.53976 63.546000 Cu 0.757426 0.549068 0.5 21 63.546 0.0018382 -3.5393 63.546000 Cu 0.81821 0.568086 0.5 30 63.546 0.000144181 -3.53992 63.546000 Cu 0.81821 0.568086 1.76741e-16 31 63.546 0.000144181 -3.53992 63.546000 Cu 0.757426 0.549068 4.7873e-16 34 63.546 0.0018382 -3.5393 63.546000 Cu 0.970422 0.552725 0.5 9 63.546 0.00142708 -3.53902 63.546000 Cu 0.970422 0.552725 4.15002e-16 10 63.546 0.00142708 -3.53902 63.546000 Cu 0.863803 0.550989 0.75 11 63.546 0.00133446 -3.53978 63.546000 Cu 0.924457 0.569935 0.75 12 63.546 0.000367947 -3.53967 63.546000 Cu 0.863803 0.550989 0.25 15 63.546 0.00133446 -3.53978 63.546000 Cu 0.924457 0.569935 0.25 17 63.546 0.000367947 -3.53967 63.546000 Cu 0.136417 0.573669 0.75 160 63.546 0.000849885 -3.53936 63.546000 Cu 0.136417 0.573669 0.25 164 63.546 0.000849885 -3.53936 63.546000 Cu 0.0305675 0.57177 0.5 215 63.546 0.000921349 -3.53912 63.546000 Cu 0.0909575 0.590836 0.5 217 63.546 0.000234593 -3.53982 63.546000 Cu 0.0909575 0.590836 5.73559e-16 218 63.546 0.000234593 -3.53982 63.546000 Cu 0.0305675 0.57177 1.88807e-16 220 63.546 0.000921349 -3.53912 63.546000 Cu 0.242298 0.575623 0.5 158 63.546 0.000585076 -3.53962 63.546000 Cu 0.242298 0.575623 5.61833e-16 159 63.546 0.000585076 -3.53962 63.546000 Cu 0.196983 0.592736 0.75 161 63.546 0.000125101 -3.53987 63.546000 Cu 0.196983 0.592736 0.25 171 63.546 0.000125101 -3.53987 63.546000 Cu 0.348336 0.577578 0.75 105 63.546 0.000249494 -3.53984 63.546000 Cu 0.348336 0.577578 0.25 115 63.546 0.000249494 -3.53984 63.546000 Cu 0.30301 0.594646 0.5 157 63.546 4.98808e-05 -3.53991 63.546000 Cu 0.30301 0.594646 4.52729e-16 170 63.546 4.98808e-05 -3.53991 63.546000 Cu 0.560617 0.581386 0.75 64 63.546 5.66044e-05 -3.53993 63.546000 Cu 0.560617 0.581386 0.25 68 63.546 5.66044e-05 -3.53993 63.546000 Cu 0.454493 0.579496 0.5 101 63.546 7.94235e-05 -3.53996 63.546000 Cu 0.454493 0.579496 4.13642e-16 114 63.546 7.94235e-05 -3.53996 63.546000 Cu 0.666672 0.583276 0.5 62 63.546 2.3861e-05 -3.53993 63.546000 Cu 0.666672 0.583276 5.78997e-16 63 63.546 2.3861e-05 -3.53993 63.546000 Cu 0.772731 0.585176 0.75 33 63.546 1.71805e-05 -3.53994 63.546000 Cu 0.772731 0.585176 0.25 42 63.546 1.71805e-05 -3.53994 63.546000 Cu 0.984914 0.588948 0.75 16 63.546 0.000231239 -3.53982 63.546000 Cu 0.984914 0.588948 0.25 18 63.546 0.000231239 -3.53982 63.546000 Cu 0.878825 0.587066 0.5 29 63.546 8.5624e-05 -3.53991 63.546000 Cu 0.878825 0.587066 3.56201e-16 41 63.546 8.5624e-05 -3.53991 63.546000 Cu 0.0454664 0.607933 0.75 219 63.546 6.2627e-05 -3.53993 63.546000 Cu 0.0454664 0.607933 0.25 227 63.546 6.2627e-05 -3.53993 63.546000 Cu 0.257578 0.611722 0.75 168 63.546 3.08183e-05 -3.53994 63.546000 Cu 0.257578 0.611722 0.25 172 63.546 3.08183e-05 -3.53994 63.546000 Cu 0.151525 0.609827 0.5 216 63.546 5.14774e-05 -3.53993 63.546000 Cu 0.151525 0.609827 4.1942e-16 226 63.546 5.14774e-05 -3.53993 63.546000 Cu 0.409064 0.596555 0.75 112 63.546 9.64257e-06 -3.53994 63.546000 Cu 0.409064 0.596555 0.25 116 63.546 9.64257e-06 -3.53994 63.546000 Cu 0.363633 0.61362 0.5 166 63.546 1.4446e-05 -3.53994 63.546000 Cu 0.363633 0.61362 4.74652e-16 167 63.546 1.4446e-05 -3.53994 63.546000 Cu 0.515136 0.598458 0.5 110 63.546 6.65163e-06 -3.53995 63.546000 Cu 0.515136 0.598458 2.6987e-16 111 63.546 6.65163e-06 -3.53995 63.546000 Cu 0.469692 0.615517 0.75 113 63.546 7.15705e-06 -3.53994 63.546000 Cu 0.469692 0.615517 0.25 123 63.546 7.15705e-06 -3.53994 63.546000 Cu 0.621207 0.600355 0.75 65 63.546 1.68116e-05 -3.53994 63.546000 Cu 0.621207 0.600355 0.25 75 63.546 1.68116e-05 -3.53994 63.546000 Cu 0.575755 0.617413 0.5 109 63.546 5.19383e-06 -3.53994 63.546000 Cu 0.575755 0.617413 3.95628e-16 122 63.546 5.19383e-06 -3.53994 63.546000 Cu 0.833337 0.604148 0.75 39 63.546 2.85814e-05 -3.53994 63.546000 Cu 0.833337 0.604148 0.25 43 63.546 2.85814e-05 -3.53994 63.546000 Cu 0.727271 0.602253 0.5 61 63.546 2.11299e-05 -3.53994 63.546000 Cu 0.727271 0.602253 3.24592e-16 74 63.546 2.11299e-05 -3.53994 63.546000 Cu 0.939403 0.606041 0.5 37 63.546 5.04429e-05 -3.53994 63.546000 Cu 0.939403 0.606041 4.30296e-16 38 63.546 5.04429e-05 -3.53994 63.546000 Cu 0.106062 0.626884 0.75 224 63.546 5.1458e-06 -3.53993 63.546000 Cu 0.106062 0.626884 0.25 228 63.546 5.1458e-06 -3.53993 63.546000 Cu 1.34245e-06 0.624991 0.5 279 63.546 4.69316e-06 -3.53993 63.546000 Cu 1.34245e-06 0.624991 4.22309e-16 284 63.546 4.69316e-06 -3.53993 63.546000 Cu 0.212122 0.628778 0.5 222 63.546 4.29046e-06 -3.53993 63.546000 Cu 0.212122 0.628778 5.07961e-16 223 63.546 4.29046e-06 -3.53993 63.546000 Cu 0.424242 0.632567 0.5 165 63.546 1.33226e-06 -3.53993 63.546000 Cu 0.318182 0.630672 0.75 169 63.546 2.66908e-06 -3.53993 63.546000 Cu 0.424242 0.632567 5.03882e-16 178 63.546 1.33226e-06 -3.53993 63.546000 Cu 0.318182 0.630672 0.25 179 63.546 2.66908e-06 -3.53993 63.546000 Cu 0.530303 0.634461 0.75 120 63.546 5.96605e-07 -3.53993 63.546000 Cu 0.530303 0.634461 0.25 124 63.546 5.96605e-07 -3.53993 63.546000 Cu 0.681817 0.619308 0.75 72 63.546 4.236e-06 -3.53993 63.546000 Cu 0.681817 0.619308 0.25 76 63.546 4.236e-06 -3.53993 63.546000 Cu 0.636363 0.636355 0.5 118 63.546 2.70301e-07 -3.53993 63.546000 Cu 0.636363 0.636355 3.14395e-16 119 63.546 2.70301e-07 -3.53993 63.546000 Cu 0.848485 0.640143 0.5 69 63.546 9.38989e-08 -3.53993 63.546000 Cu 0.787879 0.621203 0.5 70 63.546 3.5381e-06 -3.53993 63.546000 Cu 0.787879 0.621203 6.72466e-16 71 63.546 3.5381e-06 -3.53993 63.546000 Cu 0.742424 0.638249 0.75 73 63.546 1.36776e-07 -3.53993 63.546000 Cu 0.848485 0.640143 4.29447e-16 82 63.546 9.38989e-08 -3.53993 63.546000 Cu 0.742424 0.638249 0.25 83 63.546 1.36776e-07 -3.53993 63.546000 Cu 0.89394 0.623097 0.75 40 63.546 3.82655e-06 -3.53993 63.546000 Cu 0.954546 0.642037 0.75 44 63.546 9.51286e-08 -3.53993 63.546000 Cu 0.89394 0.623097 0.25 45 63.546 3.82655e-06 -3.53993 63.546000 Cu 0.954546 0.642037 0.25 46 63.546 9.51286e-08 -3.53993 63.546000 Cu 0.121212 0.662869 0.5 280 63.546 7.50435e-10 -3.53993 63.546000 Cu 0.0606062 0.64393 0.5 281 63.546 1.12995e-07 -3.53993 63.546000 Cu 0.0606062 0.64393 4.33355e-16 282 63.546 1.12995e-07 -3.53993 63.546000 Cu 0.0151515 0.660975 0.75 283 63.546 6.67046e-10 -3.53993 63.546000 Cu 0.121212 0.662869 4.16191e-16 290 63.546 7.50435e-10 -3.53993 63.546000 Cu 0.0151515 0.660975 0.25 291 63.546 6.67046e-10 -3.53993 63.546000 Cu 0.272727 0.647718 0.5 221 63.546 8.55754e-08 -3.53993 63.546000 Cu 0.166667 0.645824 0.75 225 63.546 1.13949e-07 -3.53993 63.546000 Cu 0.227273 0.664763 0.75 232 63.546 6.59107e-10 -3.53993 63.546000 Cu 0.272727 0.647718 3.38187e-16 234 63.546 8.55754e-08 -3.53993 63.546000 Cu 0.166667 0.645824 0.25 235 63.546 1.13949e-07 -3.53993 63.546000 Cu 0.227273 0.664763 0.25 236 63.546 6.59107e-10 -3.53993 63.546000 Cu 0.378788 0.649612 0.75 176 63.546 4.73875e-08 -3.53993 63.546000 Cu 0.378788 0.649612 0.25 180 63.546 4.73875e-08 -3.53993 63.546000 Cu 0.333333 0.666656 0.5 230 63.546 4.16643e-10 -3.53993 63.546000 Cu 0.333333 0.666656 4.37944e-16 231 63.546 4.16643e-10 -3.53993 63.546000 Cu 0.484848 0.651506 0.5 174 63.546 1.99319e-08 -3.53993 63.546000 Cu 0.484848 0.651506 4.94875e-16 175 63.546 1.99319e-08 -3.53993 63.546000 Cu 0.69697 0.655293 0.5 117 63.546 2.17418e-09 -3.53993 63.546000 Cu 0.590909 0.6534 0.75 121 63.546 6.80521e-09 -3.53993 63.546000 Cu 0.69697 0.655293 3.77274e-16 130 63.546 2.17418e-09 -3.53993 63.546000 Cu 0.590909 0.6534 0.25 131 63.546 6.80521e-09 -3.53993 63.546000 Cu 0.80303 0.657187 0.75 80 63.546 8.69715e-10 -3.53993 63.546000 Cu 0.80303 0.657187 0.25 84 63.546 8.69715e-10 -3.53993 63.546000 Cu 0.909091 0.659081 0.5 78 63.546 6.04356e-10 -3.53993 63.546000 Cu 0.909091 0.659081 2.61713e-16 79 63.546 6.04356e-10 -3.53993 63.546000 Cu 0.0757576 0.679913 0.75 288 63.546 1.22631e-12 -3.53993 63.546000 Cu 0.0757576 0.679913 0.25 292 63.546 1.22631e-12 -3.53993 63.546000 Cu 0.181818 0.681807 0.5 286 63.546 1.21833e-12 -3.53993 63.546000 Cu 0.181818 0.681807 3.39887e-16 287 63.546 1.21833e-12 -3.53993 63.546000 Cu 0.393939 0.685595 0.5 229 63.546 4.45701e-13 -3.53993 63.546000 Cu 0.287879 0.683701 0.75 233 63.546 8.83958e-13 -3.53993 63.546000 Cu 0.393939 0.685595 2.84655e-16 242 63.546 4.45701e-13 -3.53993 63.546000 Cu 0.287879 0.683701 0.25 243 63.546 8.83958e-13 -3.53993 63.546000 Cu 0.545455 0.670444 0.5 173 63.546 6.06542e-11 -3.53993 63.546000 Cu 0.439394 0.66855 0.75 177 63.546 1.87051e-10 -3.53993 63.546000 Cu 0.5 0.687488 0.75 184 63.546 1.54305e-13 -3.53993 63.546000 Cu 0.545455 0.670444 5.29204e-16 186 63.546 6.06542e-11 -3.53993 63.546000 Cu 0.439394 0.66855 0.25 187 63.546 1.87051e-10 -3.53993 63.546000 Cu 0.5 0.687488 0.25 188 63.546 1.54305e-13 -3.53993 63.546000 Cu 0.651515 0.672338 0.75 128 63.546 1.51229e-11 -3.53993 63.546000 Cu 0.651515 0.672338 0.25 132 63.546 1.51229e-11 -3.53993 63.546000 Cu 0.606061 0.689382 0.5 182 63.546 3.6927e-14 -3.53993 63.546000 Cu 0.606061 0.689382 3.86111e-16 183 63.546 3.6927e-14 -3.53993 63.546000 Cu 0.757576 0.674232 0.5 126 63.546 3.5599e-12 -3.53993 63.546000 Cu 0.757576 0.674232 5.02183e-16 127 63.546 3.5599e-12 -3.53993 63.546000 Cu 0.969697 0.678019 0.5 77 63.546 1.0722e-12 -3.53993 63.546000 Cu 0.863636 0.676126 0.75 81 63.546 1.30844e-12 -3.53993 63.546000 Cu 0.969697 0.678019 6.35588e-17 87 63.546 1.0722e-12 -3.53993 63.546000 Cu 0.863636 0.676126 0.25 88 63.546 1.30844e-12 -3.53993 63.546000 Cu 0.136364 0.698851 0.75 289 63.546 3.94124e-16 -3.53993 63.546000 Cu 0.136364 0.698851 0.25 299 63.546 3.94124e-16 -3.53993 63.546000 Cu 0.030303 0.696958 0.5 348 63.546 3.71767e-16 -3.53993 63.546000 Cu 0.030303 0.696958 5.32602e-16 349 63.546 3.71767e-16 -3.53993 63.546000 Cu 0.242424 0.700745 0.5 285 63.546 3.24236e-16 -3.53993 63.546000 Cu 0.242424 0.700745 4.69214e-16 298 63.546 3.24236e-16 -3.53993 63.546000 Cu 0.348485 0.702639 0.75 240 63.546 1.87182e-16 -3.53993 63.546000 Cu 0.348485 0.702639 0.25 244 63.546 1.87182e-16 -3.53993 63.546000 Cu 0.560606 0.706427 0.75 185 63.546 1.92902e-17 -3.53993 63.546000 Cu 0.560606 0.706427 0.25 195 63.546 1.92902e-17 -3.53993 63.546000 Cu 0.454545 0.704533 0.5 238 63.546 7.34942e-17 -3.53993 63.546000 Cu 0.454545 0.704533 2.4064e-16 239 63.546 7.34942e-17 -3.53993 63.546000 Cu 0.712121 0.691276 0.75 129 63.546 6.46994e-15 -3.53993 63.546000 Cu 0.712121 0.691276 0.25 139 63.546 6.46994e-15 -3.53993 63.546000 Cu 0.666667 0.708321 0.5 181 63.546 3.33953e-18 -3.53993 63.546000 Cu 0.666667 0.708321 3.13206e-16 194 63.546 3.33943e-18 -3.53993 63.546000 Cu 0.818182 0.69317 0.5 125 63.546 1.09441e-15 -3.53993 63.546000 Cu 0.772727 0.710214 0.75 136 63.546 3.86684e-19 -3.53993 63.546000 Cu 0.818182 0.69317 3.26631e-16 138 63.546 1.09441e-15 -3.53993 63.546000 Cu 0.772727 0.710214 0.25 140 63.546 3.86684e-19 -3.53993 63.546000 Cu 0.924242 0.695064 0.75 85 63.546 3.98159e-16 -3.53993 63.546000 Cu 0.984848 0.714002 0.75 86 63.546 9.32205e-21 -3.53993 63.546000 Cu 0.924242 0.695064 0.25 89 63.546 3.98159e-16 -3.53993 63.546000 Cu 0.984848 0.714002 0.25 90 63.546 9.32205e-21 -3.53993 63.546000 Cu 0.878788 0.712108 0.5 134 63.546 3.77676e-20 -3.53993 63.546000 Cu 0.878788 0.712108 6.03809e-16 135 63.546 3.77629e-20 -3.53993 63.546000 Cu 0.0909091 0.715896 0.5 347 63.546 7.54958e-21 -3.53993 63.546000 Cu 0.0454545 0.73294 0.75 353 63.546 1.29696e-24 -3.53993 63.546000 Cu 0.0909091 0.715896 2.55085e-16 355 63.546 7.54956e-21 -3.53993 63.546000 Cu 0.0454545 0.73294 0.25 356 63.546 1.29711e-24 -3.53993 63.546000 Cu 0.19697 0.71779 0.75 296 63.546 6.50226e-21 -3.53993 63.546000 Cu 0.257576 0.736728 0.75 297 63.546 6.69229e-25 -3.53993 63.546000 Cu 0.19697 0.71779 0.25 300 63.546 6.50228e-21 -3.53993 63.546000 Cu 0.257576 0.736728 0.25 307 63.546 6.68824e-25 -3.53993 63.546000 Cu 0.151515 0.734834 0.5 351 63.546 1.38284e-24 -3.53993 63.546000 Cu 0.151515 0.734834 4.5069e-16 352 63.546 1.38318e-24 -3.53993 63.546000 Cu 0.409091 0.721577 0.75 241 63.546 2.04029e-21 -3.53993 63.546000 Cu 0.409091 0.721577 0.25 251 63.546 2.04029e-21 -3.53993 63.546000 Cu 0.30303 0.719683 0.5 294 63.546 4.29096e-21 -3.53993 63.546000 Cu 0.30303 0.719683 2.7055e-16 295 63.546 4.29096e-21 -3.53993 63.546000 Cu 0.515152 0.723471 0.5 237 63.546 6.98673e-22 -3.53993 63.546000 Cu 0.515152 0.723471 3.2952e-16 250 63.546 6.98673e-22 -3.53993 63.546000 Cu 0.621212 0.725365 0.75 192 63.546 1.66975e-22 -3.53993 63.546000 Cu 0.621212 0.725365 0.25 196 63.546 1.66957e-22 -3.53993 63.546000 Cu 0.833333 0.729153 0.75 137 63.546 5.73625e-24 -3.53993 63.546000 Cu 0.833333 0.729153 0.25 144 63.546 5.73625e-24 -3.53993 63.546000 Cu 0.727273 0.727259 0.5 190 63.546 3.11964e-23 -3.53993 63.546000 Cu 0.727273 0.727259 3.57731e-16 191 63.546 3.06495e-23 -3.53993 63.546000 Cu 0.939394 0.731046 0.5 133 63.546 1.39572e-24 -3.53993 63.546000 Cu 0.939394 0.731046 4.90796e-16 143 63.546 1.50356e-24 -3.53993 63.546000 Cu 0.106061 0.751878 0.75 354 63.546 1.43431e-26 -3.53993 63.546000 Cu 0.106061 0.751878 0.25 363 63.546 1.43241e-26 -3.53993 63.546000 Cu 2.2432e-16 0.749985 0.5 410 63.546 2.49154e-26 -3.53993 63.546000 Cu 2.18294e-16 0.749985 4.15002e-16 411 63.546 2.23011e-26 -3.53993 63.546000 Cu 0.212121 0.753772 0.5 350 63.546 8.08504e-27 -3.53993 63.546000 Cu 0.212121 0.753772 3.63339e-16 362 63.546 7.97112e-27 -3.53993 63.546000 Cu 0.363636 0.738622 0.5 293 63.546 4.66868e-25 -3.53993 63.546000 Cu 0.424242 0.75756 0.5 302 63.546 8.88455e-26 -3.53993 63.546000 Cu 0.424242 0.75756 1.77081e-16 303 63.546 8.8826e-26 -3.53993 63.546000 Cu 0.318182 0.755666 0.75 304 63.546 1.68777e-26 -3.53993 63.546000 Cu 0.363636 0.738622 4.07864e-16 306 63.546 4.66741e-25 -3.53993 63.546000 Cu 0.318182 0.755666 0.25 308 63.546 1.76494e-26 -3.53993 63.546000 Cu 0.469697 0.740516 0.75 248 63.546 2.51311e-25 -3.53993 63.546000 Cu 0.530303 0.759454 0.75 249 63.546 2.5966e-25 -3.53993 63.546000 Cu 0.469697 0.740516 0.25 252 63.546 2.51723e-25 -3.53993 63.546000 Cu 0.530303 0.759454 0.25 259 63.546 2.59764e-25 -3.53993 63.546000 Cu 0.681818 0.744303 0.75 193 63.546 2.96556e-26 -3.53993 63.546000 Cu 0.681818 0.744303 0.25 203 63.546 3.01741e-26 -3.53993 63.546000 Cu 0.636364 0.761348 0.5 245 63.546 3.93396e-25 -3.53993 63.546000 Cu 0.575758 0.742409 0.5 246 63.546 3.62513e-26 -3.53993 63.546000 Cu 0.575758 0.742409 3.61979e-16 247 63.546 3.6251e-26 -3.53993 63.546000 Cu 0.636364 0.761348 4.2078e-16 258 63.546 3.93401e-25 -3.53993 63.546000 Cu 0.787879 0.746197 0.5 189 63.546 2.8627e-26 -3.53993 63.546000 Cu 0.787879 0.746197 3.86281e-16 202 63.546 3.18589e-26 -3.53993 63.546000 Cu 0.893939 0.748091 0.75 141 63.546 1.43904e-26 -3.53993 63.546000 Cu 0.893939 0.748091 0.25 145 63.546 1.43894e-26 -3.53993 63.546000 Cu 0.0606061 0.768923 0.5 409 63.546 2.00418e-24 -3.53993 63.546000 Cu 0.0606061 0.768923 4.42362e-16 417 63.546 2.00419e-24 -3.53993 63.546000 Cu 0.272727 0.77271 0.5 358 63.546 3.14569e-23 -3.53993 63.546000 Cu 0.272727 0.77271 2.91623e-16 359 63.546 3.14569e-23 -3.53993 63.546000 Cu 0.166667 0.770817 0.75 360 63.546 5.46947e-24 -3.53993 63.546000 Cu 0.166667 0.770817 0.25 364 63.546 5.46946e-24 -3.53993 63.546000 Cu 0.378788 0.774604 0.75 305 63.546 1.73559e-22 -3.53993 63.546000 Cu 0.378788 0.774604 0.25 315 63.546 1.73539e-22 -3.53993 63.546000 Cu 0.484848 0.776498 0.5 301 63.546 6.89533e-22 -3.53993 63.546000 Cu 0.484848 0.776498 3.56711e-16 314 63.546 6.89524e-22 -3.53993 63.546000 Cu 0.69697 0.780286 0.5 254 63.546 4.29414e-21 -3.53993 63.546000 Cu 0.69697 0.780286 1.94585e-16 255 63.546 4.29414e-21 -3.53993 63.546000 Cu 0.590909 0.778392 0.75 256 63.546 2.04322e-21 -3.53993 63.546000 Cu 0.590909 0.778392 0.25 260 63.546 2.0432e-21 -3.53993 63.546000 Cu 0.848485 0.765135 0.5 198 63.546 1.1919e-24 -3.53993 63.546000 Cu 0.848485 0.765135 3.15415e-16 199 63.546 1.26865e-24 -3.53993 63.546000 Cu 0.742424 0.763241 0.75 200 63.546 1.06508e-24 -3.53993 63.546000 Cu 0.80303 0.78218 0.75 201 63.546 6.5391e-21 -3.53993 63.546000 Cu 0.742424 0.763241 0.25 204 63.546 1.06442e-24 -3.53993 63.546000 Cu 0.80303 0.78218 0.25 210 63.546 6.5391e-21 -3.53993 63.546000 Cu 0.954545 0.767029 0.75 142 63.546 1.25876e-24 -3.53993 63.546000 Cu 0.954545 0.767029 0.25 146 63.546 1.25875e-24 -3.53993 63.546000 Cu 0.909091 0.784073 0.5 197 63.546 7.62338e-21 -3.53993 63.546000 Cu 0.909091 0.784073 6.86911e-16 209 63.546 7.62338e-21 -3.53993 63.546000 Cu 0.121212 0.787861 0.5 413 63.546 3.79321e-20 -3.53993 63.546000 Cu 0.121212 0.787861 3.57051e-16 414 63.546 3.7932e-20 -3.53993 63.546000 Cu 0.0151515 0.785967 0.75 415 63.546 9.42274e-21 -3.53993 63.546000 Cu 0.0757576 0.804905 0.75 416 63.546 4.03873e-16 -3.53993 63.546000 Cu 0.0151515 0.785967 0.25 418 63.546 9.42266e-21 -3.53993 63.546000 Cu 0.0757576 0.804905 0.25 425 63.546 4.03873e-16 -3.53993 63.546000 Cu 0.227273 0.789755 0.75 361 63.546 3.87281e-19 -3.53993 63.546000 Cu 0.227273 0.789755 0.25 371 63.546 3.8728e-19 -3.53993 63.546000 Cu 0.181818 0.806799 0.5 412 63.546 1.10321e-15 -3.53993 63.546000 Cu 0.181818 0.806799 3.9104e-16 424 63.546 1.10321e-15 -3.53993 63.546000 Cu 0.333333 0.791649 0.5 357 63.546 3.34311e-18 -3.53993 63.546000 Cu 0.287879 0.808693 0.75 368 63.546 6.49131e-15 -3.53993 63.546000 Cu 0.333333 0.791649 3.28161e-16 370 63.546 3.34311e-18 -3.53993 63.546000 Cu 0.287879 0.808693 0.25 372 63.546 6.49131e-15 -3.53993 63.546000 Cu 0.545455 0.795436 0.5 310 63.546 7.36495e-17 -3.53993 63.546000 Cu 0.545455 0.795436 4.34715e-16 311 63.546 7.36495e-17 -3.53993 63.546000 Cu 0.439394 0.793543 0.75 312 63.546 1.9317e-17 -3.53993 63.546000 Cu 0.439394 0.793543 0.25 316 63.546 1.9317e-17 -3.53993 63.546000 Cu 0.651515 0.79733 0.75 257 63.546 1.87801e-16 -3.53993 63.546000 Cu 0.651515 0.79733 0.25 267 63.546 1.87801e-16 -3.53993 63.546000 Cu 0.757576 0.799224 0.5 253 63.546 3.25942e-16 -3.53993 63.546000 Cu 0.757576 0.799224 3.49064e-16 266 63.546 3.25942e-16 -3.53993 63.546000 Cu 0.969697 0.803012 0.5 205 63.546 3.76394e-16 -3.53993 63.546000 Cu 0.969697 0.803012 6.49014e-16 206 63.546 3.76394e-16 -3.53993 63.546000 Cu 0.863636 0.801118 0.75 207 63.546 3.97401e-16 -3.53993 63.546000 Cu 0.863636 0.801118 0.25 211 63.546 3.97401e-16 -3.53993 63.546000 Cu 0.136364 0.823844 0.75 422 63.546 1.32861e-12 -3.53993 63.546000 Cu 0.136364 0.823844 0.25 426 63.546 1.32861e-12 -3.53993 63.546000 Cu 0.030303 0.82195 0.5 461 63.546 1.08931e-12 -3.53993 63.546000 Cu 0.030303 0.82195 5.01503e-16 466 63.546 1.08931e-12 -3.53993 63.546000 Cu 0.242424 0.825738 0.5 420 63.546 3.59069e-12 -3.53993 63.546000 Cu 0.242424 0.825738 3.8866e-16 421 63.546 3.59069e-12 -3.53993 63.546000 Cu 0.393939 0.810587 0.5 366 63.546 3.70038e-14 -3.53993 63.546000 Cu 0.393939 0.810587 3.907e-16 367 63.546 3.70038e-14 -3.53993 63.546000 Cu 0.348485 0.827631 0.75 369 63.546 1.51937e-11 -3.53993 63.546000 Cu 0.348485 0.827631 0.25 379 63.546 1.51937e-11 -3.53993 63.546000 Cu 0.5 0.812481 0.75 313 63.546 1.54635e-13 -3.53993 63.546000 Cu 0.560606 0.831419 0.75 320 63.546 1.8768e-10 -3.53993 63.546000 Cu 0.5 0.812481 0.25 323 63.546 1.54635e-13 -3.53993 63.546000 Cu 0.560606 0.831419 0.25 324 63.546 1.8768e-10 -3.53993 63.546000 Cu 0.454545 0.829525 0.5 365 63.546 6.08622e-11 -3.53993 63.546000 Cu 0.454545 0.829525 3.58241e-16 378 63.546 6.08622e-11 -3.53993 63.546000 Cu 0.712121 0.816268 0.75 264 63.546 8.87903e-13 -3.53993 63.546000 Cu 0.712121 0.816268 0.25 268 63.546 8.87903e-13 -3.53993 63.546000 Cu 0.606061 0.814375 0.5 309 63.546 4.46999e-13 -3.53993 63.546000 Cu 0.666667 0.833313 0.5 318 63.546 4.18399e-10 -3.53993 63.546000 Cu 0.666667 0.833313 6.41026e-16 319 63.546 4.18399e-10 -3.53993 63.546000 Cu 0.606061 0.814375 4.67174e-16 322 63.546 4.46999e-13 -3.53993 63.546000 Cu 0.818182 0.818162 0.5 262 63.546 1.22701e-12 -3.53993 63.546000 Cu 0.818182 0.818162 6.587e-16 263 63.546 1.22701e-12 -3.53993 63.546000 Cu 0.924242 0.820056 0.75 208 63.546 1.24012e-12 -3.53993 63.546000 Cu 0.924242 0.820056 0.25 213 63.546 1.24012e-12 -3.53993 63.546000 Cu 0.0909091 0.840888 0.5 463 63.546 6.16163e-10 -3.53993 63.546000 Cu 0.0909091 0.840888 5.71519e-16 464 63.546 6.16163e-10 -3.53993 63.546000 Cu 0.19697 0.842782 0.75 423 63.546 8.83844e-10 -3.53993 63.546000 Cu 0.19697 0.842782 0.25 433 63.546 8.83844e-10 -3.53993 63.546000 Cu 0.409091 0.84657 0.75 376 63.546 6.85584e-09 -3.53993 63.546000 Cu 0.409091 0.84657 0.25 380 63.546 6.85584e-09 -3.53993 63.546000 Cu 0.30303 0.844676 0.5 419 63.546 2.19706e-09 -3.53993 63.546000 Cu 0.30303 0.844676 4.14662e-16 432 63.546 2.19706e-09 -3.53993 63.546000 Cu 0.515152 0.848463 0.5 374 63.546 2.00498e-08 -3.53993 63.546000 Cu 0.515152 0.848463 6.36438e-16 375 63.546 2.00498e-08 -3.53993 63.546000 Cu 0.621212 0.850357 0.75 321 63.546 4.76413e-08 -3.53993 63.546000 Cu 0.621212 0.850357 0.25 331 63.546 4.76413e-08 -3.53993 63.546000 Cu 0.772727 0.835207 0.75 265 63.546 6.63217e-10 -3.53993 63.546000 Cu 0.833333 0.854145 0.75 271 63.546 1.1495e-07 -3.53993 63.546000 Cu 0.772727 0.835207 0.25 274 63.546 6.63217e-10 -3.53993 63.546000 Cu 0.833333 0.854145 0.25 275 63.546 1.1495e-07 -3.53993 63.546000 Cu 0.727273 0.852251 0.5 317 63.546 8.60984e-08 -3.53993 63.546000 Cu 0.727273 0.852251 6.99147e-16 330 63.546 8.60984e-08 -3.53993 63.546000 Cu 0.984848 0.838994 0.75 212 63.546 6.77308e-10 -3.53993 63.546000 Cu 0.984848 0.838994 0.25 214 63.546 6.77308e-10 -3.53993 63.546000 Cu 0.878788 0.8371 0.5 261 63.546 7.57878e-10 -3.53993 63.546000 Cu 0.939394 0.856039 0.5 269 63.546 1.14577e-07 -3.53993 63.546000 Cu 0.939394 0.856039 4.70743e-16 270 63.546 1.14577e-07 -3.53993 63.546000 Cu 0.878788 0.8371 7.21749e-16 273 63.546 7.57878e-10 -3.53993 63.546000 Cu 0.0454545 0.857933 0.75 465 63.546 9.71206e-08 -3.53993 63.546000 Cu 0.10606 0.876872 0.75 470 63.546 3.93577e-06 -3.53993 63.546000 Cu 0.0454545 0.857933 0.25 473 63.546 9.71206e-08 -3.53993 63.546000 Cu 0.10606 0.876872 0.25 474 63.546 3.93577e-06 -3.53993 63.546000 Cu 0.257576 0.86172 0.75 430 63.546 1.39486e-07 -3.53993 63.546000 Cu 0.257576 0.86172 0.25 434 63.546 1.39486e-07 -3.53993 63.546000 Cu 0.151515 0.859826 0.5 462 63.546 9.60997e-08 -3.53993 63.546000 Cu 0.212121 0.878766 0.5 468 63.546 3.65013e-06 -3.53993 63.546000 Cu 0.212121 0.878766 7.09683e-16 469 63.546 3.65013e-06 -3.53993 63.546000 Cu 0.151515 0.859826 5.25805e-16 472 63.546 9.60997e-08 -3.53993 63.546000 Cu 0.363637 0.863614 0.5 428 63.546 2.74795e-07 -3.53993 63.546000 Cu 0.363637 0.863614 7.52339e-16 429 63.546 2.74795e-07 -3.53993 63.546000 Cu 0.318183 0.880661 0.75 431 63.546 4.36959e-06 -3.53993 63.546000 Cu 0.318183 0.880661 0.25 441 63.546 4.36959e-06 -3.53993 63.546000 Cu 0.469697 0.865508 0.75 377 63.546 6.05124e-07 -3.53993 63.546000 Cu 0.469697 0.865508 0.25 387 63.546 6.05124e-07 -3.53993 63.546000 Cu 0.681818 0.869297 0.75 328 63.546 2.69165e-06 -3.53993 63.546000 Cu 0.681818 0.869297 0.25 332 63.546 2.69165e-06 -3.53993 63.546000 Cu 0.575758 0.867403 0.5 373 63.546 1.34687e-06 -3.53993 63.546000 Cu 0.575758 0.867403 7.99583e-16 386 63.546 1.34687e-06 -3.53993 63.546000 Cu 0.787878 0.871191 0.5 326 63.546 4.32709e-06 -3.53993 63.546000 Cu 0.787878 0.871191 3.89e-16 327 63.546 4.32709e-06 -3.53993 63.546000 Cu 0.999999 0.874979 0.5 497 63.546 4.78861e-06 -3.53993 63.546000 Cu 0.893938 0.873085 0.75 272 63.546 5.20926e-06 -3.53993 63.546000 Cu 0.893938 0.873085 0.25 277 63.546 5.20926e-06 -3.53993 63.546000 Cu 0.999999 0.874979 4.41683e-16 502 63.546 4.78861e-06 -3.53993 63.546000 Cu 0.0605965 0.893928 0.5 499 63.546 5.19119e-05 -3.53994 63.546000 Cu 0.0605965 0.893928 5.73899e-16 500 63.546 5.19119e-05 -3.53994 63.546000 Cu 0.272729 0.897717 0.5 467 63.546 2.21883e-05 -3.53994 63.546000 Cu 0.166663 0.895821 0.75 471 63.546 2.99027e-05 -3.53994 63.546000 Cu 0.272729 0.897717 6.54792e-16 480 63.546 2.21883e-05 -3.53994 63.546000 Cu 0.166663 0.895821 0.25 481 63.546 2.99027e-05 -3.53994 63.546000 Cu 0.424245 0.882556 0.5 427 63.546 5.384e-06 -3.53994 63.546000 Cu 0.378793 0.899614 0.75 438 63.546 1.7796e-05 -3.53994 63.546000 Cu 0.424245 0.882556 6.61929e-16 440 63.546 5.384e-06 -3.53994 63.546000 Cu 0.378793 0.899614 0.25 442 63.546 1.7796e-05 -3.53994 63.546000 Cu 0.530308 0.884452 0.75 384 63.546 7.41188e-06 -3.53994 63.546000 Cu 0.530308 0.884452 0.25 388 63.546 7.41188e-06 -3.53994 63.546000 Cu 0.484864 0.901512 0.5 436 63.546 7.31781e-06 -3.53995 63.546000 Cu 0.484864 0.901512 5.91403e-16 437 63.546 7.31781e-06 -3.53995 63.546000 Cu 0.636367 0.88635 0.5 382 63.546 1.47472e-05 -3.53994 63.546000 Cu 0.636367 0.88635 3.13715e-16 383 63.546 1.47472e-05 -3.53994 63.546000 Cu 0.590936 0.903415 0.75 385 63.546 9.38489e-06 -3.53994 63.546000 Cu 0.590936 0.903415 0.25 395 63.546 9.38489e-06 -3.53994 63.546000 Cu 0.848475 0.890143 0.5 325 63.546 5.2039e-05 -3.53993 63.546000 Cu 0.742422 0.888247 0.75 329 63.546 3.11588e-05 -3.53994 63.546000 Cu 0.848475 0.890143 4.74312e-16 338 63.546 5.2039e-05 -3.53993 63.546000 Cu 0.742422 0.888247 0.25 339 63.546 3.11588e-05 -3.53994 63.546000 Cu 0.954534 0.892036 0.75 276 63.546 6.37493e-05 -3.53993 63.546000 Cu 0.954534 0.892036 0.25 278 63.546 6.37493e-05 -3.53993 63.546000 Cu 0.121175 0.912904 0.5 498 63.546 8.93819e-05 -3.5399 63.546000 Cu 0.0150863 0.911022 0.75 501 63.546 0.000235578 -3.53981 63.546000 Cu 0.121175 0.912904 5.13909e-16 508 63.546 8.93819e-05 -3.5399 63.546000 Cu 0.0150863 0.911022 0.25 509 63.546 0.000235578 -3.53981 63.546000 Cu 0.227269 0.914794 0.75 478 63.546 1.803e-05 -3.53994 63.546000 Cu 0.227269 0.914794 0.25 482 63.546 1.803e-05 -3.53994 63.546000 Cu 0.333329 0.916694 0.5 476 63.546 2.42943e-05 -3.53993 63.546000 Cu 0.333329 0.916694 4.97254e-16 477 63.546 2.42943e-05 -3.53993 63.546000 Cu 0.545505 0.920475 0.5 435 63.546 7.70534e-05 -3.53996 63.546000 Cu 0.439383 0.918584 0.75 439 63.546 5.60123e-05 -3.53993 63.546000 Cu 0.545505 0.920475 4.57827e-16 448 63.546 7.70534e-05 -3.53996 63.546000 Cu 0.439383 0.918584 0.25 449 63.546 5.60123e-05 -3.53993 63.546000 Cu 0.696989 0.905324 0.5 381 63.546 4.88367e-05 -3.53991 63.546000 Cu 0.651661 0.922392 0.75 392 63.546 0.000240304 -3.53985 63.546000 Cu 0.696989 0.905324 2.79217e-16 394 63.546 4.88367e-05 -3.53991 63.546000 Cu 0.651661 0.922392 0.25 396 63.546 0.000240304 -3.53985 63.546000 Cu 0.803017 0.907233 0.75 336 63.546 0.000126184 -3.53987 63.546000 Cu 0.803017 0.907233 0.25 340 63.546 0.000126184 -3.53987 63.546000 Cu 0.757703 0.924347 0.5 390 63.546 0.000585638 -3.53962 63.546000 Cu 0.757703 0.924347 2.34352e-16 391 63.546 0.000585638 -3.53962 63.546000 Cu 0.969434 0.928202 0.5 333 63.546 0.000925921 -3.53911 63.546000 Cu 0.909043 0.909133 0.5 334 63.546 0.000237646 -3.53982 63.546000 Cu 0.909043 0.909133 4.52559e-16 335 63.546 0.000237646 -3.53982 63.546000 Cu 0.863587 0.926301 0.75 337 63.546 0.000856339 -3.53935 63.546000 Cu 0.969434 0.928202 4.7975e-16 343 63.546 0.000925921 -3.53911 63.546000 Cu 0.863587 0.926301 0.25 344 63.546 0.000856339 -3.53935 63.546000 Cu 0.0755401 0.930037 0.75 506 63.546 0.000377489 -3.53965 63.546000 Cu 0.136188 0.948985 0.75 507 63.546 0.00131106 -3.53977 63.546000 Cu 0.0755401 0.930037 0.25 510 63.546 0.000377489 -3.53965 63.546000 Cu 0.136188 0.948985 0.25 517 63.546 0.00131106 -3.53977 63.546000 Cu 0.0295699 0.947251 0.5 522 63.546 0.00148586 -3.53897 63.546000 Cu 0.0295699 0.947251 3.39547e-16 523 63.546 0.00148586 -3.53897 63.546000 Cu 0.242578 0.950903 0.5 503 63.546 0.00188812 -3.53929 63.546000 Cu 0.181786 0.931886 0.5 504 63.546 0.000138485 -3.53992 63.546000 Cu 0.181786 0.931886 4.16871e-16 505 63.546 0.000138485 -3.53992 63.546000 Cu 0.242578 0.950903 3.80333e-16 516 63.546 0.00188812 -3.53929 63.546000 Cu 0.393822 0.935697 0.5 475 63.546 0.000439075 -3.53976 63.546000 Cu 0.287892 0.933789 0.75 479 63.546 0.000264974 -3.53982 63.546000 Cu 0.393822 0.935697 2.78197e-16 488 63.546 0.000439075 -3.53976 63.546000 Cu 0.287892 0.933789 0.25 489 63.546 0.000264974 -3.53982 63.546000 Cu 0.499973 0.937543 0.75 446 63.546 0.000479074 -3.53991 63.546000 Cu 0.499973 0.937543 0.25 450 63.546 0.000479074 -3.53991 63.546000 Cu 0.712735 0.94144 0.75 393 63.546 0.00278635 -3.53887 63.546000 Cu 0.712735 0.94144 0.25 403 63.546 0.00278635 -3.53887 63.546000 Cu 0.606443 0.939414 0.5 444 63.546 0.00127068 -3.53973 63.546000 Cu 0.606443 0.939414 4.8009e-16 445 63.546 0.00127068 -3.53973 63.546000 Cu 0.818399 0.943551 0.5 389 63.546 0.00396031 -3.53782 63.546000 Cu 0.818399 0.943551 3.94099e-16 402 63.546 0.00396031 -3.53782 63.546000 Cu 0.923609 0.945539 0.75 341 63.546 0.00516208 -3.5365 63.546000 Cu 0.923609 0.945539 0.25 345 63.546 0.00516208 -3.5365 63.546000 Cu 0.0904723 0.966109 0.5 521 63.546 0.0068401 -3.53953 63.546000 Cu 0.0904723 0.966109 3.2935e-16 527 63.546 0.0068401 -3.53953 63.546000 Cu 0.197398 0.968042 0.75 514 63.546 0.0114448 -3.53749 63.546000 Cu 0.197398 0.968042 0.25 518 63.546 0.0114448 -3.53749 63.546000 Cu 0.34836 0.952906 0.75 486 63.546 0.00259727 -3.5392 63.546000 Cu 0.409754 0.971896 0.75 487 63.546 0.00960763 -3.53943 63.546000 Cu 0.34836 0.952906 0.25 490 63.546 0.00259727 -3.5392 63.546000 Cu 0.409754 0.971896 0.25 495 63.546 0.00960763 -3.53943 63.546000 Cu 0.3032 0.970231 0.5 512 63.546 0.014296 -3.53889 63.546000 Cu 0.3032 0.970231 3.9036e-16 513 63.546 0.014296 -3.53889 63.546000 Cu 0.561281 0.956493 0.75 447 63.546 0.00368163 -3.53944 63.546000 Cu 0.561281 0.956493 0.25 457 63.546 0.00368163 -3.53944 63.546000 Cu 0.517064 0.97344 0.5 483 63.546 0 -3.42808 63.546000 Cu 0.454561 0.954682 0.5 484 63.546 0.00278764 -3.53982 63.546000 Cu 0.454561 0.954682 3.15415e-16 485 63.546 0.00278764 -3.53982 63.546000 Cu 0.517064 0.97344 4.60716e-16 494 63.546 0 -3.42808 63.546000 Cu 0.667916 0.958516 0.5 443 63.546 0.0112699 -3.53778 63.546000 Cu 0.623021 0.975161 0.75 454 63.546 0 -3.187 63.546000 Cu 0.667916 0.958516 3.72006e-16 456 63.546 0.0112699 -3.53778 63.546000 Cu 0.623021 0.975161 0.25 458 63.546 0 -3.187 63.546000 Cu 0.773435 0.960883 0.75 400 63.546 0.0275334 -3.53297 63.546000 Cu 0.773435 0.960883 0.25 404 63.546 0.0275334 -3.53297 63.546000 Cu 0.98354 0.964576 0.75 342 63.546 0.0055382 -3.53811 63.546000 Cu 0.98354 0.964576 0.25 346 63.546 0.0055382 -3.53811 63.546000 Cu 0.877511 0.963141 0.5 398 63.546 0.0414522 -3.52574 63.546000 Cu 0.877511 0.963141 3.53312e-16 399 63.546 0.0414522 -3.52574 63.546000 Cu 0.0456573 0.983194 0.75 526 63.546 0 -3.42714 63.546000 Cu 0.0456573 0.983194 0.25 528 63.546 0 -3.42714 63.546000 Cu 0.258008 0.987404 0.75 515 63.546 0 -3.26175 63.546000 Cu 0.258008 0.987404 0.25 520 63.546 0 -3.26175 63.546000 Cu 0.152471 0.984675 0.5 524 63.546 0 -3.18459 63.546000 Cu 0.152471 0.984675 3.23572e-16 525 63.546 0 -3.18459 63.546000 Cu 0.365292 0.988978 0.5 511 63.546 0 -3.30313 63.546000 Cu 0.365292 0.988978 3.92229e-16 519 63.546 0 -3.30313 63.546000 Cu 0.473657 0.990261 0.75 493 63.546 11.2451 -3.24528 63.546000 Cu 0.473657 0.990261 0.25 496 63.546 11.2451 -3.24528 63.546000 Cu 0.8302 0.981334 0.75 401 63.546 0.438377 -3.47611 63.546000 Cu 0.8302 0.981334 0.25 407 63.546 0.438377 -3.47611 63.546000 Cu 0.727708 0.977823 0.5 452 63.546 0 -3.25833 63.546000 Cu 0.727708 0.977823 3.3071e-16 453 63.546 0 -3.25833 63.546000 Cu 0.937349 0.981954 0.5 397 63.546 0.055372 -3.52939 63.546000 Cu 0.937349 0.981954 1.71303e-16 406 63.546 0.055372 -3.52939