Number of particles = 1288 A = 1 Angstrom (basic length-scale) H0(1,1) = 32.5177 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.0286 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 5.10892 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 0.0169967 0.0416455 0.25 911 63.546 0.00274259 -3.53688 63.546000 Cu 0.0663991 0.0186657 0.25 912 63.546 6.2461 -3.53357 63.546000 Cu 0.0169967 0.0416455 0.75 915 63.546 0.00274259 -3.53688 63.546000 Cu 0.0663991 0.0186657 0.75 916 63.546 6.2461 -3.53357 63.546000 Cu 0.134231 0.0188206 4.66879e-19 987 63.546 6.41766 -3.52452 63.546000 Cu 0.0846458 0.0419604 2.12218e-19 988 63.546 0.00242181 -3.53491 63.546000 Cu 0.0846458 0.0419604 0.5 989 63.546 0.00242181 -3.53491 63.546000 Cu 0.134231 0.0188206 0.5 995 63.546 6.41766 -3.52452 63.546000 Cu 0.201887 0.0192921 0.25 653 63.546 6.37387 -3.51105 63.546000 Cu 0.201887 0.0192921 0.75 655 63.546 6.37387 -3.51105 63.546000 Cu 0.219151 0.0433766 3.27112e-16 657 63.546 0.0462871 -3.53715 63.546000 Cu 0.26886 0.0210234 7.77396e-16 662 63.546 6.0663 -3.48607 63.546000 Cu 0.26886 0.0210234 0.5 663 63.546 6.0663 -3.48607 63.546000 Cu 0.219151 0.0433766 0.5 666 63.546 0.0462871 -3.53715 63.546000 Cu 0.152069 0.0423712 0.25 991 63.546 0.00745008 -3.53198 63.546000 Cu 0.152069 0.0423712 0.75 996 63.546 0.00745008 -3.53198 63.546000 Cu 0.334716 0.0252577 0.25 665 63.546 3.94599 -3.48735 63.546000 Cu 0.386747 0.00709631 0.25 669 63.546 5.4553 -3.39687 63.546000 Cu 0.334716 0.0252577 0.75 671 63.546 3.94599 -3.48735 63.546000 Cu 0.386747 0.00709631 0.75 672 63.546 5.4553 -3.39687 63.546000 Cu 0.405553 0.0293236 1 683 63.546 0.256657 -3.4839 63.546000 Cu 0.405553 0.0293236 0.5 695 63.546 0.256657 -3.4839 63.546000 Cu 0.285877 0.0459917 0.25 664 63.546 0.0410558 -3.52835 63.546000 Cu 0.285877 0.0459917 0.75 668 63.546 0.0410558 -3.52835 63.546000 Cu 0.454933 0.00736812 1 691 63.546 0.110081 -3.54012 63.546000 Cu 0.454933 0.00736812 0.5 692 63.546 0.110081 -3.54012 63.546000 Cu 0.473744 0.0299968 0.25 693 63.546 0.00668619 -3.53341 63.546000 Cu 0.523384 0.00750365 0.25 694 63.546 0.151094 -3.54689 63.546000 Cu 0.473744 0.0299968 0.75 697 63.546 0.00668619 -3.53341 63.546000 Cu 0.523384 0.00750365 0.75 698 63.546 0.151094 -3.54689 63.546000 Cu 0.54158 0.0304297 1 726 63.546 0.00451255 -3.52894 63.546000 Cu 0.54158 0.0304297 0.5 727 63.546 0.00451255 -3.52894 63.546000 Cu 0.592528 0.0075402 3.46891e-16 725 63.546 0.306168 -3.55132 63.546000 Cu 0.609168 0.030804 0.25 729 63.546 0.0219325 -3.51139 63.546000 Cu 0.662364 0.0072192 0.25 733 63.546 0.724548 -3.51929 63.546000 Cu 0.592528 0.0075402 0.5 734 63.546 0.306168 -3.55132 63.546000 Cu 0.609168 0.030804 0.75 735 63.546 0.0219325 -3.51139 63.546000 Cu 0.662364 0.0072192 0.75 736 63.546 0.724548 -3.51929 63.546000 Cu 0.676409 0.0310168 1.18375e-15 771 63.546 0.350415 -3.48962 63.546000 Cu 0.676409 0.0310168 0.5 783 63.546 0.350415 -3.48962 63.546000 Cu 0.732282 0.00557533 1 779 63.546 6.37893 -3.54969 63.546000 Cu 0.732282 0.00557533 0.5 780 63.546 6.37893 -3.54969 63.546000 Cu 0.7417 0.0348266 0.25 781 63.546 0.817011 -3.47961 63.546000 Cu 0.79341 0.0165626 0.25 782 63.546 8.30177 -3.3667 63.546000 Cu 0.7417 0.0348266 0.75 785 63.546 0.817011 -3.47961 63.546000 Cu 0.79341 0.0165626 0.75 786 63.546 8.30177 -3.3667 63.546000 Cu 0.812284 0.0392135 1 836 63.546 0.150396 -3.50862 63.546000 Cu 0.812284 0.0392135 0.5 837 63.546 0.150396 -3.50862 63.546000 Cu 0.998543 0.0185503 1 909 63.546 6.16423 -3.53884 63.546000 Cu 0.998543 0.0185503 0.5 910 63.546 6.16423 -3.53884 63.546000 Cu 0.86285 0.0182657 1.21316e-15 835 63.546 6.14663 -3.53689 63.546000 Cu 0.881134 0.0408283 0.25 839 63.546 0.0372252 -3.52163 63.546000 Cu 0.930743 0.0184571 0.25 843 63.546 6.10442 -3.54235 63.546000 Cu 0.86285 0.0182657 0.5 844 63.546 6.14663 -3.53689 63.546000 Cu 0.881134 0.0408283 0.75 845 63.546 0.0372252 -3.52163 63.546000 Cu 0.930743 0.0184571 0.75 846 63.546 6.10442 -3.54235 63.546000 Cu 0.94917 0.0413329 1.21316e-15 901 63.546 0.00560296 -3.5363 63.546000 Cu 0.94917 0.0413329 0.5 913 63.546 0.00560296 -3.5363 63.546000 Cu 0.0353945 0.0646221 7.95604e-16 979 63.546 0.00128523 -3.53515 63.546000 Cu 0.0536842 0.0876505 0.25 983 63.546 0.00101845 -3.53715 63.546000 Cu 0.102908 0.065177 0.25 990 63.546 0.00194807 -3.53451 63.546000 Cu 0.0353945 0.0646221 0.5 992 63.546 0.00128523 -3.53515 63.546000 Cu 0.0536842 0.0876505 0.75 993 63.546 0.00101845 -3.53715 63.546000 Cu 0.102908 0.065177 0.75 994 63.546 0.00194807 -3.53451 63.546000 Cu 0.121162 0.0884642 7.76717e-17 1063 63.546 0.00220362 -3.53774 63.546000 Cu 0.121162 0.0884642 0.5 1073 63.546 0.00220362 -3.53774 63.546000 Cu 0.188409 0.0895756 0.25 658 63.546 0.0069358 -3.53848 63.546000 Cu 0.237146 0.067539 0.25 659 63.546 0.0169837 -3.53627 63.546000 Cu 0.188409 0.0895756 0.75 660 63.546 0.0069358 -3.53848 63.546000 Cu 0.237146 0.067539 0.75 667 63.546 0.0169837 -3.53627 63.546000 Cu 0.255814 0.0912959 1 676 63.546 0.00606804 -3.53893 63.546000 Cu 0.255814 0.0912959 0.5 677 63.546 0.00606804 -3.53893 63.546000 Cu 0.170142 0.0659436 1.53603e-16 1071 63.546 0.0119036 -3.5356 63.546000 Cu 0.170142 0.0659436 0.5 1072 63.546 0.0119036 -3.5356 63.546000 Cu 0.304787 0.0699161 1 675 63.546 0.00686783 -3.53683 63.546000 Cu 0.323665 0.0934716 0.25 679 63.546 0.00222288 -3.53883 63.546000 Cu 0.354187 0.0490987 1 684 63.546 0.0228833 -3.54408 63.546000 Cu 0.354187 0.0490987 0.5 685 63.546 0.0228833 -3.54408 63.546000 Cu 0.373192 0.0724565 0.25 686 63.546 0.00562373 -3.54082 63.546000 Cu 0.304787 0.0699161 0.5 688 63.546 0.00686783 -3.53683 63.546000 Cu 0.323665 0.0934716 0.75 689 63.546 0.00222288 -3.53883 63.546000 Cu 0.373192 0.0724565 0.75 690 63.546 0.00562373 -3.54082 63.546000 Cu 0.423707 0.0518549 0.25 687 63.546 0.0734569 -3.51823 63.546000 Cu 0.423707 0.0518549 0.75 696 63.546 0.0734569 -3.51823 63.546000 Cu 0.49179 0.0528174 4.8305e-16 717 63.546 0.00455568 -3.53644 63.546000 Cu 0.441969 0.074624 1.7339e-15 718 63.546 0.024758 -3.52905 63.546000 Cu 0.441969 0.074624 0.5 719 63.546 0.024758 -3.52905 63.546000 Cu 0.509931 0.0757599 0.25 721 63.546 0.00277568 -3.53678 63.546000 Cu 0.559439 0.0535335 0.25 728 63.546 0.00265879 -3.53347 63.546000 Cu 0.49179 0.0528174 0.5 730 63.546 0.00455568 -3.53644 63.546000 Cu 0.509931 0.0757599 0.75 731 63.546 0.00277568 -3.53678 63.546000 Cu 0.559439 0.0535335 0.75 732 63.546 0.00265879 -3.53347 63.546000 Cu 0.577556 0.0767106 6.94037e-16 763 63.546 0.00364182 -3.5375 63.546000 Cu 0.62677 0.0542174 1 772 63.546 0.0274664 -3.53131 63.546000 Cu 0.62677 0.0542174 0.5 773 63.546 0.0274664 -3.53131 63.546000 Cu 0.64476 0.0779556 0.25 774 63.546 0.00964135 -3.53804 63.546000 Cu 0.693274 0.0559738 0.25 775 63.546 0.061752 -3.53073 63.546000 Cu 0.577556 0.0767106 0.5 776 63.546 0.00364182 -3.5375 63.546000 Cu 0.64476 0.0779556 0.75 778 63.546 0.00964135 -3.53804 63.546000 Cu 0.693274 0.0559738 0.75 784 63.546 0.061752 -3.53073 63.546000 Cu 0.712221 0.079873 3.46891e-16 828 63.546 0.0127979 -3.53852 63.546000 Cu 0.712221 0.079873 0.5 829 63.546 0.0127979 -3.53852 63.546000 Cu 0.761234 0.0589017 1 827 63.546 0.0309978 -3.54294 63.546000 Cu 0.780549 0.0823555 0.25 831 63.546 0.00651125 -3.54119 63.546000 Cu 0.830874 0.061894 0.25 838 63.546 0.0435514 -3.52371 63.546000 Cu 0.761234 0.0589017 0.5 840 63.546 0.0309978 -3.54294 63.546000 Cu 0.780549 0.0823555 0.75 841 63.546 0.00651125 -3.54119 63.546000 Cu 0.830874 0.061894 0.75 842 63.546 0.0435514 -3.52371 63.546000 Cu 0.849547 0.0846651 1.04046e-15 893 63.546 0.0158399 -3.53203 63.546000 Cu 0.849547 0.0846651 0.5 906 63.546 0.0158399 -3.53203 63.546000 Cu 0.899585 0.0633789 1 902 63.546 0.016518 -3.52952 63.546000 Cu 0.899585 0.0633789 0.5 903 63.546 0.016518 -3.52952 63.546000 Cu 0.917991 0.0860725 0.25 904 63.546 0.00822728 -3.53461 63.546000 Cu 0.967641 0.0640898 0.25 905 63.546 0.00277737 -3.53527 63.546000 Cu 0.917991 0.0860725 0.75 908 63.546 0.00822728 -3.53461 63.546000 Cu 0.967641 0.0640898 0.75 914 63.546 0.00277737 -3.53527 63.546000 Cu 0.98599 0.08693 1 980 63.546 0.00176547 -3.53721 63.546000 Cu 0.98599 0.08693 0.5 981 63.546 0.00176547 -3.53721 63.546000 Cu 0.00427658 0.109841 0.25 982 63.546 0.00094607 -3.53745 63.546000 Cu 0.00427658 0.109841 0.75 986 63.546 0.00094607 -3.53745 63.546000 Cu 0.0225392 0.132813 1 1055 63.546 0.000439396 -3.53844 63.546000 Cu 0.0719477 0.110737 0 1064 63.546 0.000836342 -3.53839 63.546000 Cu 0.0719477 0.110737 0.5 1065 63.546 0.000836342 -3.53839 63.546000 Cu 0.0902489 0.133877 0.25 1066 63.546 0.000528837 -3.53936 63.546000 Cu 0.0225392 0.132813 0.5 1068 63.546 0.000439396 -3.53844 63.546000 Cu 0.0902489 0.133877 0.75 1070 63.546 0.000528837 -3.53936 63.546000 Cu 0.139439 0.111777 0.25 1067 63.546 0.00144321 -3.53864 63.546000 Cu 0.139439 0.111777 0.75 1074 63.546 0.00144321 -3.53864 63.546000 Cu 0.206875 0.11309 1 673 63.546 0.00391104 -3.53992 63.546000 Cu 0.225378 0.136522 0.25 674 63.546 0.00197653 -3.54035 63.546000 Cu 0.274486 0.114853 0.25 678 63.546 0.00217904 -3.54004 63.546000 Cu 0.206875 0.11309 0.5 680 63.546 0.00391104 -3.53992 63.546000 Cu 0.225378 0.136522 0.75 681 63.546 0.00197653 -3.54035 63.546000 Cu 0.274486 0.114853 0.75 682 63.546 0.00217904 -3.54004 63.546000 Cu 0.157821 0.135072 2.21428e-16 1135 63.546 0.00114956 -3.53951 63.546000 Cu 0.157821 0.135072 0.5 1136 63.546 0.00114956 -3.53951 63.546000 Cu 0.293125 0.138276 7.22262e-16 701 63.546 0.00077881 -3.54019 63.546000 Cu 0.391953 0.0956663 3.74479e-16 709 63.546 0.00235725 -3.5399 63.546000 Cu 0.342402 0.116854 1 710 63.546 0.000815069 -3.53969 63.546000 Cu 0.342402 0.116854 0.5 711 63.546 0.000815069 -3.53969 63.546000 Cu 0.36106 0.140155 0.25 712 63.546 0.000311284 -3.53986 63.546000 Cu 0.410571 0.118833 0.25 713 63.546 0.00143292 -3.53956 63.546000 Cu 0.293125 0.138276 0.5 714 63.546 0.00077881 -3.54019 63.546000 Cu 0.36106 0.140155 0.75 716 63.546 0.000311284 -3.53986 63.546000 Cu 0.391953 0.0956663 0.5 722 63.546 0.00235725 -3.5399 63.546000 Cu 0.410571 0.118833 0.75 723 63.546 0.00143292 -3.53956 63.546000 Cu 0.46033 0.0975298 0.25 720 63.546 0.00877328 -3.53408 63.546000 Cu 0.46033 0.0975298 0.75 724 63.546 0.00877328 -3.53408 63.546000 Cu 0.478763 0.120529 1 755 63.546 0.00282333 -3.53714 63.546000 Cu 0.429126 0.141979 4.99942e-16 756 63.546 0.000639531 -3.53954 63.546000 Cu 0.429126 0.141979 0.5 757 63.546 0.000639531 -3.53954 63.546000 Cu 0.528256 0.098783 1 764 63.546 0.00136056 -3.5385 63.546000 Cu 0.528256 0.098783 0.5 765 63.546 0.00136056 -3.5385 63.546000 Cu 0.546627 0.121908 0.25 766 63.546 0.000450204 -3.53924 63.546000 Cu 0.478763 0.120529 0.5 768 63.546 0.00282333 -3.53714 63.546000 Cu 0.546627 0.121908 0.75 770 63.546 0.000450204 -3.53924 63.546000 Cu 0.59586 0.100001 0.25 767 63.546 0.00150808 -3.53909 63.546000 Cu 0.59586 0.100001 0.75 777 63.546 0.00150808 -3.53909 63.546000 Cu 0.663389 0.101478 3.47061e-16 819 63.546 0.00409866 -3.5399 63.546000 Cu 0.61435 0.123282 1.83356e-17 820 63.546 0.000932436 -3.54017 63.546000 Cu 0.61435 0.123282 0.5 821 63.546 0.000932436 -3.54017 63.546000 Cu 0.682064 0.124881 0.25 823 63.546 0.00169422 -3.54045 63.546000 Cu 0.663389 0.101478 0.5 832 63.546 0.00409866 -3.5399 63.546000 Cu 0.682064 0.124881 0.75 833 63.546 0.00169422 -3.54045 63.546000 Cu 0.731183 0.103399 0.25 830 63.546 0.00404729 -3.54048 63.546000 Cu 0.731183 0.103399 0.75 834 63.546 0.00404729 -3.54048 63.546000 Cu 0.749994 0.126739 1 885 63.546 0.00125629 -3.54055 63.546000 Cu 0.799547 0.105566 1 894 63.546 0.00202998 -3.54024 63.546000 Cu 0.799547 0.105566 0.5 895 63.546 0.00202998 -3.54024 63.546000 Cu 0.818227 0.128687 0.25 896 63.546 0.000979164 -3.5397 63.546000 Cu 0.749994 0.126739 0.5 898 63.546 0.00125629 -3.54055 63.546000 Cu 0.818227 0.128687 0.75 900 63.546 0.000979164 -3.5397 63.546000 Cu 0.868111 0.107521 0.25 897 63.546 0.00705528 -3.53544 63.546000 Cu 0.868111 0.107521 0.75 907 63.546 0.00705528 -3.53544 63.546000 Cu 0.936356 0.108878 1.50505e-16 971 63.546 0.00425503 -3.53644 63.546000 Cu 0.886567 0.130434 5.84108e-16 972 63.546 0.00356303 -3.53731 63.546000 Cu 0.886567 0.130434 0.5 973 63.546 0.00356303 -3.53731 63.546000 Cu 0.954679 0.131758 0.25 975 63.546 0.00211222 -3.53729 63.546000 Cu 0.936356 0.108878 0.5 984 63.546 0.00425503 -3.53644 63.546000 Cu 0.954679 0.131758 0.75 985 63.546 0.00211222 -3.53729 63.546000 Cu 0.040866 0.155845 0.25 1059 63.546 0.000208416 -3.5392 63.546000 Cu 0.040866 0.155845 0.75 1069 63.546 0.000208416 -3.5392 63.546000 Cu 0.108612 0.157033 5.44338e-16 1127 63.546 0.000462731 -3.5394 63.546000 Cu 0.0592506 0.178907 1 1128 63.546 0.00015809 -3.53963 63.546000 Cu 0.0592506 0.178907 0.5 1129 63.546 0.00015809 -3.53963 63.546000 Cu 0.127048 0.180193 0.25 1131 63.546 0.000473769 -3.54003 63.546000 Cu 0.108612 0.157033 0.5 1138 63.546 0.000462731 -3.5394 63.546000 Cu 0.127048 0.180193 0.75 1139 63.546 0.000473769 -3.54003 63.546000 Cu 0.194774 0.181636 1 699 63.546 0.000252729 -3.54004 63.546000 Cu 0.243941 0.159883 5.2057e-16 702 63.546 0.000983609 -3.54018 63.546000 Cu 0.243941 0.159883 0.5 703 63.546 0.000983609 -3.54018 63.546000 Cu 0.2625 0.183194 0.25 704 63.546 0.000513177 -3.54034 63.546000 Cu 0.194774 0.181636 0.5 706 63.546 0.000252729 -3.54004 63.546000 Cu 0.2625 0.183194 0.75 708 63.546 0.000513177 -3.54034 63.546000 Cu 0.176279 0.158364 0.25 1137 63.546 0.000632741 -3.54027 63.546000 Cu 0.176279 0.158364 0.75 1140 63.546 0.000632741 -3.54027 63.546000 Cu 0.311736 0.16161 0.25 705 63.546 0.000318663 -3.53988 63.546000 Cu 0.311736 0.16161 0.75 715 63.546 0.000318663 -3.53988 63.546000 Cu 0.379664 0.163413 1 747 63.546 0.00018943 -3.54015 63.546000 Cu 0.330339 0.184901 5.2023e-16 748 63.546 0.000123006 -3.54032 63.546000 Cu 0.330339 0.184901 0.5 749 63.546 0.000123006 -3.54032 63.546000 Cu 0.398282 0.186631 0.25 751 63.546 9.52498e-05 -3.53965 63.546000 Cu 0.379664 0.163413 0.5 760 63.546 0.00018943 -3.54015 63.546000 Cu 0.398282 0.186631 0.75 761 63.546 9.52498e-05 -3.53965 63.546000 Cu 0.447691 0.16514 0.25 758 63.546 0.00029175 -3.53945 63.546000 Cu 0.497184 0.143615 0.25 759 63.546 0.00101598 -3.53886 63.546000 Cu 0.447691 0.16514 0.75 762 63.546 0.00029175 -3.53945 63.546000 Cu 0.497184 0.143615 0.75 769 63.546 0.00101598 -3.53886 63.546000 Cu 0.466243 0.188296 1 803 63.546 0.000110085 -3.53886 63.546000 Cu 0.515658 0.166742 1 812 63.546 0.000388563 -3.53882 63.546000 Cu 0.515658 0.166742 0.5 813 63.546 0.000388563 -3.53882 63.546000 Cu 0.534207 0.189889 0.25 814 63.546 0.000163251 -3.5394 63.546000 Cu 0.466243 0.188296 0.5 816 63.546 0.000110085 -3.53886 63.546000 Cu 0.534207 0.189889 0.75 818 63.546 0.000163251 -3.5394 63.546000 Cu 0.56507 0.145056 8.36138e-16 811 63.546 0.000180657 -3.53932 63.546000 Cu 0.56507 0.145056 0.5 824 63.546 0.000180657 -3.53932 63.546000 Cu 0.58351 0.168237 0.25 815 63.546 0.000143548 -3.53976 63.546000 Cu 0.632825 0.146547 0.25 822 63.546 0.000437061 -3.53989 63.546000 Cu 0.58351 0.168237 0.75 825 63.546 0.000143548 -3.53976 63.546000 Cu 0.632825 0.146547 0.75 826 63.546 0.000437061 -3.53989 63.546000 Cu 0.651369 0.16979 3.39548e-19 877 63.546 0.000233245 -3.54054 63.546000 Cu 0.700636 0.148191 1 886 63.546 0.000676033 -3.54051 63.546000 Cu 0.700636 0.148191 0.5 887 63.546 0.000676033 -3.54051 63.546000 Cu 0.651369 0.16979 0.5 890 63.546 0.000233245 -3.54054 63.546000 Cu 0.719242 0.171448 0.25 888 63.546 0.000277712 -3.54036 63.546000 Cu 0.768634 0.149982 0.25 889 63.546 0.000398622 -3.54076 63.546000 Cu 0.719242 0.171448 0.75 892 63.546 0.000277712 -3.54036 63.546000 Cu 0.768634 0.149982 0.75 899 63.546 0.000398622 -3.54076 63.546000 Cu 0.8368 0.151779 3.46679e-16 963 63.546 0.000650362 -3.53973 63.546000 Cu 0.787217 0.173176 8.88343e-17 964 63.546 0.000264923 -3.54036 63.546000 Cu 0.787217 0.173176 0.5 965 63.546 0.000264923 -3.54036 63.546000 Cu 0.8368 0.151779 0.5 976 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0.5 1097 63.546 0.000391612 -3.54008 63.546000 Cu 0.683115 0.375681 0.25 1098 63.546 0.00128576 -3.54019 63.546000 Cu 0.61502 0.373692 0.5 1100 63.546 0.000824212 -3.53935 63.546000 Cu 0.683115 0.375681 0.75 1102 63.546 0.00128576 -3.54019 63.546000 Cu 0.732342 0.354165 0.25 1099 63.546 0.00114305 -3.54032 63.546000 Cu 0.732342 0.354165 0.75 1109 63.546 0.00114305 -3.54032 63.546000 Cu 0.800059 0.355776 1 1157 63.546 0.00137532 -3.53999 63.546000 Cu 0.750921 0.377567 5.20485e-16 1158 63.546 0.00275371 -3.53997 63.546000 Cu 0.750921 0.377567 0.5 1159 63.546 0.00275371 -3.53997 63.546000 Cu 0.818431 0.37913 0.25 1161 63.546 0.00206935 -3.53923 63.546000 Cu 0.849292 0.333905 1.73679e-16 1166 63.546 0.000560052 -3.53987 63.546000 Cu 0.849292 0.333905 0.5 1167 63.546 0.000560052 -3.53987 63.546000 Cu 0.800059 0.355776 0.5 1170 63.546 0.00137532 -3.53999 63.546000 Cu 0.818431 0.37913 0.75 1171 63.546 0.00206935 -3.53923 63.546000 Cu 0.867667 0.357119 0.25 1168 63.546 0.000622913 -3.53943 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63.546 0.00494477 -3.53585 63.546000 Cu 0.107564 0.406411 1 1282 63.546 0.012223 -3.53208 63.546000 Cu 0.107564 0.406411 0.5 1283 63.546 0.012223 -3.53208 63.546000 Cu 0.0575013 0.428116 4.5839e-16 1273 63.546 0.00418884 -3.53624 63.546000 Cu 0.0575013 0.428116 0.5 1286 63.546 0.00418884 -3.53624 63.546000 Cu 0.176204 0.408272 0.75 607 63.546 0.00275053 -3.53994 63.546000 Cu 0.157688 0.385225 0.5 615 63.546 0.00168153 -3.53971 63.546000 Cu 0.22603 0.387174 0.25 850 63.546 0.000990102 -3.54031 63.546000 Cu 0.22603 0.387174 0.75 852 63.546 0.000990102 -3.54031 63.546000 Cu 0.244692 0.410453 6.93909e-16 917 63.546 0.00285584 -3.54 63.546000 Cu 0.244692 0.410453 0.5 928 63.546 0.00285584 -3.54 63.546000 Cu 0.157688 0.385225 1 1281 63.546 0.00168153 -3.53971 63.546000 Cu 0.176204 0.408272 0.25 1285 63.546 0.00275053 -3.53994 63.546000 Cu 0.294078 0.389125 1.83356e-17 924 63.546 0.00183163 -3.5406 63.546000 Cu 0.294078 0.389125 0.5 925 63.546 0.00183163 -3.5406 63.546000 Cu 0.312677 0.412543 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0.565292 0.394946 0.5 1089 63.546 0.00476537 -3.53616 63.546000 Cu 0.583634 0.417935 0.25 1090 63.546 0.0127452 -3.53308 63.546000 Cu 0.633621 0.396918 0.25 1091 63.546 0.00181929 -3.53966 63.546000 Cu 0.583634 0.417935 0.75 1094 63.546 0.0127452 -3.53308 63.546000 Cu 0.633621 0.396918 0.75 1101 63.546 0.00181929 -3.53966 63.546000 Cu 0.701754 0.399123 1.51821e-16 1149 63.546 0.00408452 -3.54001 63.546000 Cu 0.652276 0.420236 1 1150 63.546 0.00549516 -3.54056 63.546000 Cu 0.652276 0.420236 0.5 1151 63.546 0.00549516 -3.54056 63.546000 Cu 0.701754 0.399123 0.5 1162 63.546 0.00408452 -3.54001 63.546000 Cu 0.72041 0.422793 0.25 1153 63.546 0.0140449 -3.53833 63.546000 Cu 0.76937 0.4011 0.25 1160 63.546 0.00623953 -3.53894 63.546000 Cu 0.72041 0.422793 0.75 1163 63.546 0.0140449 -3.53833 63.546000 Cu 0.76937 0.4011 0.75 1164 63.546 0.00623953 -3.53894 63.546000 Cu 0.787668 0.424791 1 1199 63.546 0.013007 -3.53627 63.546000 Cu 0.836669 0.402539 1.73382e-16 1208 63.546 0.00303129 -3.53808 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579 63.546 0.0116195 -3.53586 63.546000 Cu 0.0938922 0.473448 1 580 63.546 0.0116195 -3.53586 63.546000 Cu 0.00759502 0.450328 3.84114e-17 1274 63.546 0.00197227 -3.53737 63.546000 Cu 0.00759502 0.450328 0.5 1275 63.546 0.00197227 -3.53737 63.546000 Cu 0.0259304 0.473148 0.25 1276 63.546 0.00660842 -3.53634 63.546000 Cu 0.075553 0.450847 0.25 1277 63.546 0.00619143 -3.53642 63.546000 Cu 0.0259304 0.473148 0.75 1280 63.546 0.00660842 -3.53634 63.546000 Cu 0.12574 0.429137 0.25 1284 63.546 0.0324783 -3.52566 63.546000 Cu 0.075553 0.450847 0.75 1287 63.546 0.00619143 -3.53642 63.546000 Cu 0.12574 0.429137 0.75 1288 63.546 0.0324783 -3.52566 63.546000 Cu 0.143918 0.451718 0.5 3 63.546 0.0920012 -3.51391 63.546000 Cu 0.143918 0.451718 1.01143e-16 581 63.546 0.0920012 -3.51391 63.546000 Cu 0.194874 0.431355 1.83356e-17 918 63.546 0.0068477 -3.54121 63.546000 Cu 0.194874 0.431355 0.5 919 63.546 0.0068477 -3.54121 63.546000 Cu 0.213951 0.454597 0.25 920 63.546 0.0301499 -3.54471 63.546000 Cu 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-3.53438 63.546000 Cu 0.465759 0.438456 1.9367e-16 1080 63.546 0.00254329 -3.53527 63.546000 Cu 0.465759 0.438456 0.5 1081 63.546 0.00254329 -3.53527 63.546000 Cu 0.483787 0.461456 0.25 1082 63.546 0.00581554 -3.53626 63.546000 Cu 0.53357 0.439319 0.25 1083 63.546 0.0135378 -3.53123 63.546000 Cu 0.483787 0.461456 0.75 1086 63.546 0.00581554 -3.53626 63.546000 Cu 0.53357 0.439319 0.75 1093 63.546 0.0135378 -3.53123 63.546000 Cu 0.551626 0.462065 1 1143 63.546 0.0322764 -3.52394 63.546000 Cu 0.551626 0.462065 0.5 1144 63.546 0.0322764 -3.52394 63.546000 Cu 0.601952 0.440855 1 1142 63.546 0.0375888 -3.52568 63.546000 Cu 0.620184 0.463681 0.25 1146 63.546 0.135653 -3.51003 63.546000 Cu 0.671142 0.443788 0.25 1152 63.546 0.0235188 -3.5419 63.546000 Cu 0.601952 0.440855 0.5 1154 63.546 0.0375888 -3.52568 63.546000 Cu 0.620184 0.463681 0.75 1155 63.546 0.135653 -3.51003 63.546000 Cu 0.671142 0.443788 0.75 1156 63.546 0.0235188 -3.5419 63.546000 Cu 0.690243 0.467928 2.4647e-16 1195 63.546 0.959641 -3.46757 63.546000 Cu 0.690243 0.467928 0.5 1204 63.546 0.959641 -3.46757 63.546000 Cu 0.738989 0.446877 4.39248e-16 1200 63.546 0.0738254 -3.52878 63.546000 Cu 0.738989 0.446877 0.5 1201 63.546 0.0738254 -3.52878 63.546000 Cu 0.755384 0.472176 0.25 1202 63.546 0.436892 -3.48236 63.546000 Cu 0.805305 0.448758 0.25 1203 63.546 0.0367091 -3.52741 63.546000 Cu 0.755384 0.472176 0.75 1206 63.546 0.436892 -3.48236 63.546000 Cu 0.805305 0.448758 0.75 1213 63.546 0.0367091 -3.52741 63.546000 Cu 0.822641 0.472316 1.83356e-17 1239 63.546 0.0224349 -3.50622 63.546000 Cu 0.822641 0.472316 0.5 1240 63.546 0.0224349 -3.50622 63.546000 Cu 0.872504 0.449357 1 1238 63.546 0.00150908 -3.53014 63.546000 Cu 0.890233 0.472633 0.25 1242 63.546 0.00482307 -3.52594 63.546000 Cu 0.93992 0.449871 0.25 1248 63.546 0.00115619 -3.53487 63.546000 Cu 0.872504 0.449357 0.5 1250 63.546 0.00150908 -3.53014 63.546000 Cu 0.890233 0.472633 0.75 1251 63.546 0.00482307 -3.52594 63.546000 Cu 0.93992 0.449871 0.75 1252 63.546 0.00115619 -3.53487 63.546000 Cu 0.95804 0.472899 4.16159e-16 1269 63.546 0.00466972 -3.53255 63.546000 Cu 0.95804 0.472899 0.5 1278 63.546 0.00466972 -3.53255 63.546000 Cu 0.11332 0.495903 0.75 5 63.546 0.0729584 -3.5294 63.546000 Cu 0.0456375 0.495828 0.5 12 63.546 0.0553271 -3.53748 63.546000 Cu 0.137161 0.518306 1.83356e-17 133 63.546 6.12425 -3.53688 63.546000 Cu 0.0693548 0.518581 0.25 134 63.546 6.10148 -3.54242 63.546000 Cu 0.137161 0.518306 0.5 140 63.546 6.12425 -3.53688 63.546000 Cu 0.0693548 0.518581 0.75 141 63.546 6.10148 -3.54242 63.546000 Cu 0.11332 0.495903 0.25 265 63.546 0.0729584 -3.5294 63.546000 Cu 0.0456375 0.495828 1 584 63.546 0.0553271 -3.53748 63.546000 Cu 0.00160174 0.518684 1 194 63.546 6.1593 -3.53892 63.546000 Cu 0.00160174 0.518684 0.5 195 63.546 6.1593 -3.53892 63.546000 Cu 0.267376 0.505446 1 86 63.546 6.49276 -3.55133 63.546000 Cu 0.267376 0.505446 0.5 87 63.546 6.49276 -3.55133 63.546000 Cu 0.206508 0.516621 0.25 88 63.546 8.3298 -3.36399 63.546000 Cu 0.206508 0.516621 0.75 90 63.546 8.3298 -3.36399 63.546000 Cu 0.233566 0.478381 1 997 63.546 4.02924 -3.48482 63.546000 Cu 0.180957 0.496127 1.34474e-15 998 63.546 5.79738 -3.37223 63.546000 Cu 0.180957 0.496127 0.5 999 63.546 5.79738 -3.37223 63.546000 Cu 0.233566 0.478381 0.5 1005 63.546 4.02924 -3.48482 63.546000 Cu 0.407308 0.507473 2.71214e-16 47 63.546 0.316717 -3.55134 63.546000 Cu 0.337358 0.507168 0.25 48 63.546 0.771781 -3.52003 63.546000 Cu 0.407308 0.507473 0.5 54 63.546 0.316717 -3.55134 63.546000 Cu 0.337358 0.507168 0.75 55 63.546 0.771781 -3.52003 63.546000 Cu 0.299259 0.482542 0.25 1003 63.546 6.18444 -3.48614 63.546000 Cu 0.299259 0.482542 0.75 1006 63.546 6.18444 -3.48614 63.546000 Cu 0.36622 0.483976 1.73212e-16 1076 63.546 6.46818 -3.5133 63.546000 Cu 0.36622 0.483976 0.5 1077 63.546 6.46818 -3.5133 63.546000 Cu 0.544922 0.507372 1.83356e-17 22 63.546 0.118355 -3.53941 63.546000 Cu 0.544922 0.507372 0.5 23 63.546 0.118355 -3.53941 63.546000 Cu 0.476523 0.507465 0.25 24 63.546 0.15368 -3.54656 63.546000 Cu 0.476523 0.507465 0.75 26 63.546 0.15368 -3.54656 63.546000 Cu 0.433827 0.484372 0.25 1078 63.546 6.3301 -3.52958 63.546000 Cu 0.433827 0.484372 0.75 1085 63.546 6.3301 -3.52958 63.546000 Cu 0.501657 0.484552 1.69774e-19 1141 63.546 6.19668 -3.539 63.546000 Cu 0.501657 0.484552 0.5 1147 63.546 6.19668 -3.539 63.546000 Cu 0.569618 0.484798 0.25 1145 63.546 6.20915 -3.53933 63.546000 Cu 0.569618 0.484798 0.75 1148 63.546 6.20915 -3.53933 63.546000 Cu 0.61304 0.507126 0.25 6 63.546 5.62441 -3.39177 63.546000 Cu 0.61304 0.507126 0.75 13 63.546 5.62441 -3.39177 63.546000 Cu 0.639048 0.486462 8.66655e-16 1196 63.546 8.56543 -3.37394 63.546000 Cu 0.639048 0.486462 0.5 1197 63.546 8.56543 -3.37394 63.546000 Cu 0.69919 0.498169 0.25 1198 63.546 6.84134 -3.53726 63.546000 Cu 0.69919 0.498169 0.75 1205 63.546 6.84134 -3.53726 63.546000 Cu 0.798233 0.519376 0.25 2 63.546 6.40108 -3.51191 63.546000 Cu 0.798233 0.519376 0.75 4 63.546 6.40108 -3.51191 63.546000 Cu 0.769197 0.496151 1 1237 63.546 0.800924 -3.5127 63.546000 Cu 0.839252 0.495703 0.25 1241 63.546 0.325577 -3.55011 63.546000 Cu 0.769197 0.496151 0.5 1243 63.546 0.800924 -3.5127 63.546000 Cu 0.839252 0.495703 0.75 1244 63.546 0.325577 -3.55011 63.546000 Cu 0.731173 0.520964 1.89086e-16 8 63.546 6.12993 -3.48575 63.546000 Cu 0.731173 0.520964 0.5 9 63.546 6.12993 -3.48575 63.546000 Cu 0.933739 0.518768 0.25 196 63.546 6.23601 -3.53423 63.546000 Cu 0.933739 0.518768 0.75 198 63.546 6.23601 -3.53423 63.546000 Cu 0.865905 0.518921 1 263 63.546 6.40632 -3.52584 63.546000 Cu 0.865905 0.518921 0.5 271 63.546 6.40632 -3.52584 63.546000 Cu 0.908738 0.495688 1 1270 63.546 0.136479 -3.54748 63.546000 Cu 0.908738 0.495688 0.5 1271 63.546 0.136479 -3.54748 63.546000 Cu 0.977479 0.495754 0.25 1272 63.546 0.0721218 -3.54297 63.546000 Cu 0.977479 0.495754 0.75 1279 63.546 0.0721218 -3.54297 63.546000 Cu 0.118784 0.54087 0.25 138 63.546 0.0338508 -3.52237 63.546000 Cu 0.118784 0.54087 0.75 142 63.546 0.0338508 -3.52237 63.546000 Cu 0.0507406 0.541446 1.83356e-17 193 63.546 0.0070596 -3.53636 63.546000 Cu 0.100237 0.563421 1 200 63.546 0.0148002 -3.52953 63.546000 Cu 0.100237 0.563421 0.5 201 63.546 0.0148002 -3.52953 63.546000 Cu 0.0321583 0.564188 0.25 202 63.546 0.00394242 -3.53528 63.546000 Cu 0.0507406 0.541446 0.5 204 63.546 0.0070596 -3.53636 63.546000 Cu 0.0321583 0.564188 0.75 206 63.546 0.00394242 -3.53528 63.546000 Cu 0.25821 0.534813 0.25 89 63.546 0.852487 -3.47775 63.546000 Cu 0.25821 0.534813 0.75 97 63.546 0.852487 -3.47775 63.546000 Cu 0.238574 0.558911 1 135 63.546 0.0314256 -3.54266 63.546000 Cu 0.187622 0.539239 1 136 63.546 0.152675 -3.50742 63.546000 Cu 0.187622 0.539239 0.5 137 63.546 0.152675 -3.50742 63.546000 Cu 0.16892 0.561917 0.25 139 63.546 0.04349 -3.52349 63.546000 Cu 0.238574 0.558911 0.5 148 63.546 0.0314256 -3.54266 63.546000 Cu 0.16892 0.561917 0.75 149 63.546 0.04349 -3.52349 63.546000 Cu 0.390699 0.530729 0.25 52 63.546 0.0244062 -3.51076 63.546000 Cu 0.390699 0.530729 0.75 56 63.546 0.0244062 -3.51076 63.546000 Cu 0.323498 0.530982 1.27331e-19 85 63.546 0.361296 -3.48839 63.546000 Cu 0.372987 0.554142 1 92 63.546 0.0281768 -3.53154 63.546000 Cu 0.372987 0.554142 0.5 93 63.546 0.0281768 -3.53154 63.546000 Cu 0.306524 0.555935 0.25 94 63.546 0.0617964 -3.52997 63.546000 Cu 0.323498 0.530982 0.5 96 63.546 0.361296 -3.48839 63.546000 Cu 0.306524 0.555935 0.75 98 63.546 0.0617964 -3.52997 63.546000 Cu 0.52608 0.529991 0.25 25 63.546 0.00692534 -3.53338 63.546000 Cu 0.52608 0.529991 0.75 33 63.546 0.00692534 -3.53338 63.546000 Cu 0.507926 0.552788 1 49 63.546 0.00508077 -3.53621 63.546000 Cu 0.458254 0.530365 1 50 63.546 0.00447479 -3.52835 63.546000 Cu 0.458254 0.530365 0.5 51 63.546 0.00447479 -3.52835 63.546000 Cu 0.440282 0.553446 0.25 53 63.546 0.0023831 -3.53342 63.546000 Cu 0.507926 0.552788 0.5 62 63.546 0.00508077 -3.53621 63.546000 Cu 0.440282 0.553446 0.75 63 63.546 0.0023831 -3.53342 63.546000 Cu 0.576013 0.551858 0.25 30 63.546 0.0794949 -3.51717 63.546000 Cu 0.576013 0.551858 0.75 34 63.546 0.0794949 -3.51717 63.546000 Cu 0.665291 0.525179 0.25 10 63.546 3.98978 -3.4861 63.546000 Cu 0.713996 0.545956 0.25 11 63.546 0.0426177 -3.52813 63.546000 Cu 0.665291 0.525179 0.75 14 63.546 3.98978 -3.4861 63.546000 Cu 0.713996 0.545956 0.75 18 63.546 0.0426177 -3.52813 63.546000 Cu 0.594277 0.529342 1 21 63.546 0.275286 -3.48268 63.546000 Cu 0.69491 0.569893 4.04105e-16 27 63.546 0.00709069 -3.53671 63.546000 Cu 0.645648 0.549063 9.46066e-17 28 63.546 0.0253424 -3.54427 63.546000 Cu 0.645648 0.549063 0.5 29 63.546 0.0253424 -3.54427 63.546000 Cu 0.594277 0.529342 0.5 32 63.546 0.275286 -3.48268 63.546000 Cu 0.69491 0.569893 0.5 40 63.546 0.00709069 -3.53671 63.546000 Cu 0.780743 0.5434 1 7 63.546 0.0455979 -3.53688 63.546000 Cu 0.762574 0.567534 0.25 15 63.546 0.0169639 -3.53638 63.546000 Cu 0.780743 0.5434 0.5 17 63.546 0.0455979 -3.53688 63.546000 Cu 0.762574 0.567534 0.75 19 63.546 0.0169639 -3.53638 63.546000 Cu 0.847872 0.542446 0.25 269 63.546 0.00675269 -3.53261 63.546000 Cu 0.847872 0.542446 0.75 272 63.546 0.00675269 -3.53261 63.546000 Cu 0.829612 0.565977 1 346 63.546 0.0112611 -3.53576 63.546000 Cu 0.829612 0.565977 0.5 347 63.546 0.0112611 -3.53576 63.546000 Cu 0.982971 0.541747 0.25 197 63.546 0.00270618 -3.53642 63.546000 Cu 0.982971 0.541747 0.75 205 63.546 0.00270618 -3.53642 63.546000 Cu 0.964405 0.564702 1 266 63.546 0.00124529 -3.53609 63.546000 Cu 0.915342 0.542048 4.24435e-20 267 63.546 0.00245228 -3.53532 63.546000 Cu 0.915342 0.542048 0.5 268 63.546 0.00245228 -3.53532 63.546000 Cu 0.896879 0.565223 0.25 270 63.546 0.00181438 -3.53411 63.546000 Cu 0.964405 0.564702 0.5 278 63.546 0.00124529 -3.53609 63.546000 Cu 0.896879 0.565223 0.75 279 63.546 0.00181438 -3.53411 63.546000 Cu 0.0816851 0.586094 0.25 203 63.546 0.00715591 -3.5346 63.546000 Cu 0.131419 0.607497 0.25 210 63.546 0.00570842 -3.5351 63.546000 Cu 0.0816851 0.586094 0.75 213 63.546 0.00715591 -3.5346 63.546000 Cu 0.131419 0.607497 0.75 214 63.546 0.00570842 -3.5351 63.546000 Cu 0.0630858 0.608887 1 273 63.546 0.00395431 -3.53738 63.546000 Cu 0.0136339 0.587006 1 274 63.546 0.00260558 -3.53752 63.546000 Cu 0.0136339 0.587006 0.5 275 63.546 0.00260558 -3.53752 63.546000 Cu 0.0630858 0.608887 0.5 286 63.546 0.00395431 -3.53738 63.546000 Cu 0.219162 0.582355 0.25 146 63.546 0.00693288 -3.54081 63.546000 Cu 0.268361 0.603396 0.25 147 63.546 0.00344341 -3.54042 63.546000 Cu 0.219162 0.582355 0.75 150 63.546 0.00693288 -3.54081 63.546000 Cu 0.268361 0.603396 0.75 157 63.546 0.00344341 -3.54042 63.546000 Cu 0.15016 0.584676 1 199 63.546 0.015606 -3.53116 63.546000 Cu 0.200028 0.605565 3.60049e-16 208 63.546 0.00246084 -3.53982 63.546000 Cu 0.200028 0.605565 0.5 209 63.546 0.00246084 -3.53982 63.546000 Cu 0.15016 0.584676 0.5 212 63.546 0.015606 -3.53116 63.546000 Cu 0.287476 0.579845 1 144 63.546 0.012629 -3.53811 63.546000 Cu 0.287476 0.579845 0.5 145 63.546 0.012629 -3.53811 63.546000 Cu 0.422068 0.576619 4.91072e-17 91 63.546 0.0041364 -3.53791 63.546000 Cu 0.354905 0.577893 0.25 95 63.546 0.00995213 -3.53744 63.546000 Cu 0.403636 0.599928 0.25 102 63.546 0.00175357 -3.53936 63.546000 Cu 0.422068 0.576619 0.5 104 63.546 0.0041364 -3.53791 63.546000 Cu 0.354905 0.577893 0.75 105 63.546 0.00995213 -3.53744 63.546000 Cu 0.403636 0.599928 0.75 106 63.546 0.00175357 -3.53936 63.546000 Cu 0.336149 0.601418 1 143 63.546 0.00497845 -3.53942 63.546000 Cu 0.336149 0.601418 0.5 156 63.546 0.00497845 -3.53942 63.546000 Cu 0.557644 0.574601 1.73297e-16 58 63.546 0.0266101 -3.52833 63.546000 Cu 0.557644 0.574601 0.5 59 63.546 0.0266101 -3.52833 63.546000 Cu 0.489657 0.575704 0.25 60 63.546 0.00311777 -3.53679 63.546000 Cu 0.539095 0.597486 0.25 61 63.546 0.00921769 -3.53397 63.546000 Cu 0.489657 0.575704 0.75 64 63.546 0.00311777 -3.53679 63.546000 Cu 0.539095 0.597486 0.75 71 63.546 0.00921769 -3.53397 63.546000 Cu 0.47119 0.598725 1.45709e-16 100 63.546 0.00152747 -3.538 63.546000 Cu 0.47119 0.598725 0.5 101 63.546 0.00152747 -3.538 63.546000 Cu 0.626458 0.572424 0.25 31 63.546 0.00585871 -3.54069 63.546000 Cu 0.675868 0.593449 0.25 38 63.546 0.00219713 -3.53888 63.546000 Cu 0.626458 0.572424 0.75 41 63.546 0.00585871 -3.54069 63.546000 Cu 0.675868 0.593449 0.75 42 63.546 0.00219713 -3.53888 63.546000 Cu 0.607541 0.595634 1 57 63.546 0.00249996 -3.54005 63.546000 Cu 0.656906 0.616827 1.73721e-16 66 63.546 0.000871853 -3.53941 63.546000 Cu 0.656906 0.616827 0.5 67 63.546 0.000871853 -3.53941 63.546000 Cu 0.588678 0.618783 0.25 68 63.546 0.00121138 -3.53958 63.546000 Cu 0.607541 0.595634 0.5 70 63.546 0.00249996 -3.54005 63.546000 Cu 0.588678 0.618783 0.75 72 63.546 0.00121138 -3.53958 63.546000 Cu 0.811176 0.589573 0.25 16 63.546 0.00636784 -3.53841 63.546000 Cu 0.811176 0.589573 0.75 20 63.546 0.00636784 -3.53841 63.546000 Cu 0.792495 0.613068 1 35 63.546 0.00364513 -3.5398 63.546000 Cu 0.743753 0.591281 5.90941e-16 36 63.546 0.00612502 -3.53886 63.546000 Cu 0.743753 0.591281 0.5 37 63.546 0.00612502 -3.53886 63.546000 Cu 0.724859 0.614825 0.25 39 63.546 0.00223246 -3.54003 63.546000 Cu 0.792495 0.613068 0.5 44 63.546 0.00364513 -3.5398 63.546000 Cu 0.724859 0.614825 0.75 45 63.546 0.00223246 -3.54003 63.546000 Cu 0.859946 0.611745 0.25 351 63.546 0.00211764 -3.5389 63.546000 Cu 0.859946 0.611745 0.75 354 63.546 0.00211764 -3.5389 63.546000 Cu 0.945911 0.587713 0.25 276 63.546 0.000983937 -3.53767 63.546000 Cu 0.995094 0.609902 0.25 277 63.546 0.0015773 -3.53789 63.546000 Cu 0.945911 0.587713 0.75 280 63.546 0.000983937 -3.53767 63.546000 Cu 0.995094 0.609902 0.75 287 63.546 0.0015773 -3.53789 63.546000 Cu 0.878441 0.588453 4.325e-17 345 63.546 0.00285571 -3.53732 63.546000 Cu 0.927409 0.61077 5.20528e-16 349 63.546 0.000831504 -3.53812 63.546000 Cu 0.927409 0.61077 0.5 350 63.546 0.000831504 -3.53812 63.546000 Cu 0.878441 0.588453 0.5 353 63.546 0.00285571 -3.53732 63.546000 Cu 0.112668 0.630393 1 282 63.546 0.0024057 -3.5376 63.546000 Cu 0.112668 0.630393 0.5 283 63.546 0.0024057 -3.5376 63.546000 Cu 0.0444774 0.631766 0.25 284 63.546 0.00230151 -3.53796 63.546000 Cu 0.0939732 0.653342 0.25 285 63.546 0.00111818 -3.53832 63.546000 Cu 0.0444774 0.631766 0.75 288 63.546 0.00230151 -3.53796 63.546000 Cu 0.0939732 0.653342 0.75 295 63.546 0.00111818 -3.53832 63.546000 Cu 0.025939 0.654721 5.19806e-16 356 63.546 0.00132166 -3.53843 63.546000 Cu 0.025939 0.654721 0.5 357 63.546 0.00132166 -3.53843 63.546000 Cu 0.249293 0.626747 1.47746e-16 207 63.546 0.00101697 -3.54027 63.546000 Cu 0.181065 0.628672 0.25 211 63.546 0.00108915 -3.53938 63.546000 Cu 0.230382 0.649987 0.25 218 63.546 0.000394879 -3.54012 63.546000 Cu 0.249293 0.626747 0.5 220 63.546 0.00101697 -3.54027 63.546000 Cu 0.181065 0.628672 0.75 221 63.546 0.00108915 -3.53938 63.546000 Cu 0.230382 0.649987 0.75 222 63.546 0.000394879 -3.54012 63.546000 Cu 0.162204 0.651742 1 281 63.546 0.000530897 -3.5398 63.546000 Cu 0.162204 0.651742 0.5 294 63.546 0.000530897 -3.5398 63.546000 Cu 0.384929 0.623243 1.27331e-19 152 63.546 0.00078743 -3.54041 63.546000 Cu 0.384929 0.623243 0.5 153 63.546 0.00078743 -3.54041 63.546000 Cu 0.317247 0.624846 0.25 154 63.546 0.00226359 -3.54063 63.546000 Cu 0.366166 0.64653 0.25 155 63.546 0.000450848 -3.54016 63.546000 Cu 0.317247 0.624846 0.75 158 63.546 0.00226359 -3.54063 63.546000 Cu 0.366166 0.64653 0.75 165 63.546 0.000450848 -3.54016 63.546000 Cu 0.298377 0.648186 4.02025e-16 216 63.546 0.000858716 -3.54046 63.546000 Cu 0.298377 0.648186 0.5 217 63.546 0.000858716 -3.54046 63.546000 Cu 0.433938 0.645018 1 151 63.546 0.000244919 -3.53967 63.546000 Cu 0.433938 0.645018 0.5 164 63.546 0.000244919 -3.53967 63.546000 Cu 0.520473 0.620481 1.83356e-17 99 63.546 0.00311988 -3.537 63.546000 Cu 0.452609 0.621842 0.25 103 63.546 0.00054779 -3.53909 63.546000 Cu 0.569906 0.641929 1.83356e-17 108 63.546 0.000653931 -3.53966 63.546000 Cu 0.569906 0.641929 0.5 109 63.546 0.000653931 -3.53966 63.546000 Cu 0.501805 0.643562 0.25 110 63.546 0.00107534 -3.53876 63.546000 Cu 0.551188 0.665078 0.25 111 63.546 0.00034513 -3.53965 63.546000 Cu 0.520473 0.620481 0.5 112 63.546 0.00311988 -3.537 63.546000 Cu 0.452609 0.621842 0.75 113 63.546 0.00054779 -3.53909 63.546000 Cu 0.501805 0.643562 0.75 114 63.546 0.00107534 -3.53876 63.546000 Cu 0.551188 0.665078 0.75 121 63.546 0.00034513 -3.53965 63.546000 Cu 0.705996 0.63824 1 65 63.546 0.00078014 -3.53989 63.546000 Cu 0.63802 0.640104 0.25 69 63.546 0.000290583 -3.53952 63.546000 Cu 0.687227 0.661557 0.25 76 63.546 0.00032653 -3.53974 63.546000 Cu 0.705996 0.63824 0.5 78 63.546 0.00078014 -3.53989 63.546000 Cu 0.63802 0.640104 0.75 79 63.546 0.000290583 -3.53952 63.546000 Cu 0.687227 0.661557 0.75 80 63.546 0.00032653 -3.53974 63.546000 Cu 0.619253 0.66334 1 107 63.546 0.0001294 -3.54009 63.546000 Cu 0.619253 0.66334 0.5 120 63.546 0.0001294 -3.54009 63.546000 Cu 0.773763 0.636491 0.25 43 63.546 0.00185799 -3.54015 63.546000 Cu 0.773763 0.636491 0.75 46 63.546 0.00185799 -3.54015 63.546000 Cu 0.755048 0.659835 2.62216e-16 74 63.546 0.000984318 -3.5402 63.546000 Cu 0.755048 0.659835 0.5 75 63.546 0.000984318 -3.5402 63.546000 Cu 0.841341 0.635034 1 422 63.546 0.00167404 -3.53987 63.546000 Cu 0.841341 0.635034 0.5 423 63.546 0.00167404 -3.53987 63.546000 Cu 0.822749 0.658319 0.25 424 63.546 0.000973884 -3.54026 63.546000 Cu 0.822749 0.658319 0.75 431 63.546 0.000973884 -3.54026 63.546000 Cu 0.976594 0.632864 3.91754e-17 348 63.546 0.000756001 -3.53848 63.546000 Cu 0.908907 0.633887 0.25 352 63.546 0.00051901 -3.53925 63.546000 Cu 0.958082 0.655891 0.25 358 63.546 0.000393312 -3.53907 63.546000 Cu 0.976594 0.632864 0.5 360 63.546 0.000756001 -3.53848 63.546000 Cu 0.908907 0.633887 0.75 361 63.546 0.00051901 -3.53925 63.546000 Cu 0.958082 0.655891 0.75 362 63.546 0.000393312 -3.53907 63.546000 Cu 0.890378 0.657033 2.33355e-16 421 63.546 0.000466355 -3.5395 63.546000 Cu 0.890378 0.657033 0.5 430 63.546 0.000466355 -3.5395 63.546000 Cu 0.0754405 0.676345 1.83356e-17 355 63.546 0.000566914 -3.53885 63.546000 Cu 0.00744442 0.677717 0.25 359 63.546 0.000725155 -3.53871 63.546000 Cu 0.125062 0.697888 5.09322e-19 364 63.546 0.000183461 -3.53958 63.546000 Cu 0.125062 0.697888 0.5 365 63.546 0.000183461 -3.53958 63.546000 Cu 0.0570196 0.699367 0.25 366 63.546 0.00023973 -3.53922 63.546000 Cu 0.0754405 0.676345 0.5 368 63.546 0.000566914 -3.53885 63.546000 Cu 0.00744442 0.677717 0.75 369 63.546 0.000725155 -3.53871 63.546000 Cu 0.0570196 0.699367 0.75 370 63.546 0.00023973 -3.53922 63.546000 Cu 0.14352 0.67481 0.25 292 63.546 0.000334517 -3.53983 63.546000 Cu 0.14352 0.67481 0.75 296 63.546 0.000334517 -3.53983 63.546000 Cu 0.279645 0.67144 0.25 219 63.546 0.000380041 -3.54017 63.546000 Cu 0.279645 0.67144 0.75 229 63.546 0.000380041 -3.54017 63.546000 Cu 0.261082 0.694654 2.57632e-17 289 63.546 0.000121975 -3.54069 63.546000 Cu 0.211628 0.673162 1 290 63.546 0.000256839 -3.54027 63.546000 Cu 0.211628 0.673162 0.5 291 63.546 0.000256839 -3.54027 63.546000 Cu 0.193079 0.69631 0.25 293 63.546 0.000161936 -3.53997 63.546000 Cu 0.261082 0.694654 0.5 302 63.546 0.000121975 -3.54069 63.546000 Cu 0.193079 0.69631 0.75 303 63.546 0.000161936 -3.53997 63.546000 Cu 0.415338 0.66821 0.25 162 63.546 0.000177841 -3.53999 63.546000 Cu 0.415338 0.66821 0.75 166 63.546 0.000177841 -3.53999 63.546000 Cu 0.347513 0.669793 3.63571e-16 215 63.546 0.000189491 -3.54019 63.546000 Cu 0.396877 0.691422 1 224 63.546 2.58198e-05 -3.54026 63.546000 Cu 0.396877 0.691422 0.5 225 63.546 2.58198e-05 -3.54026 63.546000 Cu 0.328994 0.693023 0.25 226 63.546 4.14936e-05 -3.54022 63.546000 Cu 0.347513 0.669793 0.5 228 63.546 0.000189491 -3.54019 63.546000 Cu 0.328994 0.693023 0.75 230 63.546 4.14936e-05 -3.54022 63.546000 Cu 0.483197 0.66669 1 160 63.546 0.000389936 -3.53889 63.546000 Cu 0.483197 0.66669 0.5 161 63.546 0.000389936 -3.53889 63.546000 Cu 0.532616 0.688238 1 159 63.546 0.000177649 -3.53919 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