Number of particles = 1048 A = 1 Angstrom (basic length-scale) H0(1,1) = 28.3764 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 80.25 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 4.919 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 0.0367199 0.00897207 0.75 572 63.546 3.34486 -3.2291 63.546000 Cu 0.0367199 0.00897207 0.25 573 63.546 3.34486 -3.2291 63.546000 Cu 0.0225731 0.0360316 5.39213e-16 574 63.546 0.0154672 -3.26264 63.546000 Cu 0.100253 0.0227926 3.59711e-16 575 63.546 0.0153371 -3.26566 63.546000 Cu 0.0225731 0.0360316 0.5 578 63.546 0.0154672 -3.26264 63.546000 Cu 0.100253 0.0227926 0.5 581 63.546 0.0153371 -3.26566 63.546000 Cu 0.0859146 0.0498774 0.75 606 63.546 0.00919954 -3.27618 63.546000 Cu 0.0859146 0.0498774 0.25 607 63.546 0.00919954 -3.27618 63.546000 Cu 0.178746 0.0109008 8.23102e-16 579 63.546 3.38207 -3.22973 63.546000 Cu 0.178746 0.0109008 0.5 582 63.546 3.38207 -3.22973 63.546000 Cu 0.163777 0.0369695 0.75 605 63.546 0.0205868 -3.27025 63.546000 Cu 0.243265 0.0240229 0.75 614 63.546 0.0280938 -3.269 63.546000 Cu 0.243265 0.0240229 0.25 615 63.546 0.0280938 -3.269 63.546000 Cu 0.163777 0.0369695 0.25 618 63.546 0.0205868 -3.27025 63.546000 Cu 0.322464 0.0126745 0.75 613 63.546 3.41394 -3.22783 63.546000 Cu 0.307689 0.0379761 1.24347e-15 617 63.546 0.0129446 -3.26588 63.546000 Cu 0.387734 0.0257105 1 621 63.546 5.92061 -3.24761 63.546000 Cu 0.322464 0.0126745 0.25 623 63.546 3.41394 -3.22783 63.546000 Cu 0.307689 0.0379761 0.5 624 63.546 0.0129446 -3.26588 63.546000 Cu 0.387734 0.0257105 0.5 625 63.546 5.92061 -3.24761 63.546000 Cu 0.53672 0.00897207 0.75 669 63.546 3.34486 -3.2291 63.546000 Cu 0.460437 0.021295 0.75 670 63.546 5.55675 -3.26462 63.546000 Cu 0.460437 0.021295 0.25 671 63.546 5.55675 -3.26462 63.546000 Cu 0.522573 0.0360316 3.88276e-16 673 63.546 0.0154672 -3.26264 63.546000 Cu 0.53672 0.00897207 0.25 678 63.546 3.34486 -3.2291 63.546000 Cu 0.522573 0.0360316 0.5 679 63.546 0.0154672 -3.26264 63.546000 Cu 0.445978 0.04909 3.60063e-16 672 63.546 5.64577 -3.27595 63.546000 Cu 0.445978 0.04909 0.5 676 63.546 5.64577 -3.27595 63.546000 Cu 0.678746 0.0109008 8.57663e-16 535 63.546 3.38207 -3.22973 63.546000 Cu 0.678746 0.0109008 0.5 536 63.546 3.38207 -3.22973 63.546000 Cu 0.663777 0.0369695 0.75 538 63.546 0.0205868 -3.27025 63.546000 Cu 0.663777 0.0369695 0.25 539 63.546 0.0205868 -3.27025 63.546000 Cu 0.600253 0.0227926 8.18518e-16 677 63.546 0.0153371 -3.26566 63.546000 Cu 0.600253 0.0227926 0.5 680 63.546 0.0153371 -3.26566 63.546000 Cu 0.585915 0.0498774 0.75 725 63.546 0.00919954 -3.27618 63.546000 Cu 0.585915 0.0498774 0.25 733 63.546 0.00919954 -3.27618 63.546000 Cu 0.743265 0.0240229 0.75 537 63.546 0.0280938 -3.269 63.546000 Cu 0.822464 0.0126745 0.75 543 63.546 3.41394 -3.22783 63.546000 Cu 0.822464 0.0126745 0.25 544 63.546 3.41394 -3.22783 63.546000 Cu 0.807689 0.0379761 2.86816e-15 545 63.546 0.0129446 -3.26588 63.546000 Cu 0.743265 0.0240229 0.25 547 63.546 0.0280938 -3.269 63.546000 Cu 0.807689 0.0379761 0.5 549 63.546 0.0129446 -3.26588 63.546000 Cu 0.887734 0.0257105 7.4446e-16 546 63.546 5.92061 -3.24761 63.546000 Cu 0.887734 0.0257105 0.5 551 63.546 5.92061 -3.24761 63.546000 Cu 0.960437 0.021295 0.75 563 63.546 5.55675 -3.26462 63.546000 Cu 0.960437 0.021295 0.25 576 63.546 5.55675 -3.26462 63.546000 Cu 0.945978 0.04909 1 567 63.546 5.64577 -3.27595 63.546000 Cu 0.945978 0.04909 0.5 577 63.546 5.64577 -3.27595 63.546000 Cu 0.00866921 0.0634498 0.75 597 63.546 0.0180071 -3.26778 63.546000 Cu 0.0730556 0.0769485 5.38508e-16 608 63.546 0.0110052 -3.27587 63.546000 Cu 0.00866921 0.0634498 0.25 610 63.546 0.0180071 -3.26778 63.546000 Cu 0.0730556 0.0769485 0.5 612 63.546 0.0110052 -3.27587 63.546000 Cu 0.138534 0.0900845 0.75 654 63.546 0.0107608 -3.27708 63.546000 Cu 0.138534 0.0900845 0.25 655 63.546 0.0107608 -3.27708 63.546000 Cu 0.228337 0.0502063 1 616 63.546 0.0150284 -3.2808 63.546000 Cu 0.228337 0.0502063 0.5 620 63.546 0.0150284 -3.2808 63.546000 Cu 0.150224 0.063443 7.17658e-16 609 63.546 0.0122254 -3.27585 63.546000 Cu 0.150224 0.063443 0.5 619 63.546 0.0122254 -3.27585 63.546000 Cu 0.21546 0.0764718 0.75 653 63.546 0.0141989 -3.27843 63.546000 Cu 0.21546 0.0764718 0.25 666 63.546 0.0141989 -3.27843 63.546000 Cu 0.281479 0.0892005 1 664 63.546 0.0297191 -3.27343 63.546000 Cu 0.281479 0.0892005 0.5 668 63.546 0.0297191 -3.27343 63.546000 Cu 0.373093 0.0510386 0.75 661 63.546 5.25105 -3.24394 63.546000 Cu 0.373093 0.0510386 0.25 674 63.546 5.25105 -3.24394 63.546000 Cu 0.293392 0.0634566 0.75 662 63.546 0.0227239 -3.27185 63.546000 Cu 0.293392 0.0634566 0.25 663 63.546 0.0227239 -3.27185 63.546000 Cu 0.359315 0.0759884 1.13767e-15 665 63.546 4.62943 -3.22218 63.546000 Cu 0.359315 0.0759884 0.5 675 63.546 4.62943 -3.22218 63.546000 Cu 0.431923 0.0770543 0.75 717 63.546 4.71289 -3.27772 63.546000 Cu 0.508669 0.0634498 0.75 726 63.546 0.0180071 -3.26778 63.546000 Cu 0.508669 0.0634498 0.25 727 63.546 0.0180071 -3.26778 63.546000 Cu 0.496265 0.0908784 1.07737e-15 728 63.546 0.0245139 -3.26941 63.546000 Cu 0.431923 0.0770543 0.25 730 63.546 4.71289 -3.27772 63.546000 Cu 0.496265 0.0908784 0.5 732 63.546 0.0245139 -3.26941 63.546000 Cu 0.650224 0.063443 1 540 63.546 0.0122254 -3.27585 63.546000 Cu 0.650224 0.063443 0.5 542 63.546 0.0122254 -3.27585 63.546000 Cu 0.638534 0.0900845 0.75 553 63.546 0.0107608 -3.27708 63.546000 Cu 0.638534 0.0900845 0.25 560 63.546 0.0107608 -3.27708 63.546000 Cu 0.573056 0.0769485 1.41063e-18 729 63.546 0.0110052 -3.27587 63.546000 Cu 0.573056 0.0769485 0.5 734 63.546 0.0110052 -3.27587 63.546000 Cu 0.728337 0.0502063 4.10141e-16 541 63.546 0.0150284 -3.2808 63.546000 Cu 0.728337 0.0502063 0.5 548 63.546 0.0150284 -3.2808 63.546000 Cu 0.793392 0.0634566 0.75 555 63.546 0.0227239 -3.27185 63.546000 Cu 0.71546 0.0764718 0.75 556 63.546 0.0141989 -3.27843 63.546000 Cu 0.71546 0.0764718 0.25 557 63.546 0.0141989 -3.27843 63.546000 Cu 0.781479 0.0892005 1 559 63.546 0.0297191 -3.27343 63.546000 Cu 0.793392 0.0634566 0.25 568 63.546 0.0227239 -3.27185 63.546000 Cu 0.781479 0.0892005 0.5 569 63.546 0.0297191 -3.27343 63.546000 Cu 0.873093 0.0510386 0.75 564 63.546 5.25105 -3.24394 63.546000 Cu 0.873093 0.0510386 0.25 565 63.546 5.25105 -3.24394 63.546000 Cu 0.996265 0.0908784 5.09943e-16 601 63.546 0.0245139 -3.26941 63.546000 Cu 0.996265 0.0908784 0.5 611 63.546 0.0245139 -3.26941 63.546000 Cu 0.859315 0.0759884 2.51022e-15 566 63.546 4.62943 -3.22218 63.546000 Cu 0.859315 0.0759884 0.5 570 63.546 4.62943 -3.22218 63.546000 Cu 0.931923 0.0770543 0.75 598 63.546 4.71289 -3.27772 63.546000 Cu 0.931923 0.0770543 0.25 599 63.546 4.71289 -3.27772 63.546000 Cu 0.0621364 0.103955 0.75 645 63.546 0.0115961 -3.27676 63.546000 Cu 0.0533658 0.130977 3.95682e-16 649 63.546 0.00529572 -3.27667 63.546000 Cu 0.128908 0.116773 2.4686e-18 656 63.546 0.00752919 -3.27768 63.546000 Cu 0.0621364 0.103955 0.25 658 63.546 0.0115961 -3.27676 63.546000 Cu 0.0533658 0.130977 0.5 659 63.546 0.00529572 -3.27667 63.546000 Cu 0.128908 0.116773 0.5 660 63.546 0.00752919 -3.27768 63.546000 Cu 0.120939 0.143479 0.75 701 63.546 0.0036223 -3.27738 63.546000 Cu 0.120939 0.143479 0.25 714 63.546 0.0036223 -3.27738 63.546000 Cu 0.204922 0.102837 1.07737e-15 657 63.546 0.0120262 -3.27813 63.546000 Cu 0.204922 0.102837 0.5 667 63.546 0.0120262 -3.27813 63.546000 Cu 0.272326 0.115136 0.75 709 63.546 0.0268573 -3.27566 63.546000 Cu 0.196449 0.129249 0.75 710 63.546 0.00792922 -3.27795 63.546000 Cu 0.196449 0.129249 0.25 711 63.546 0.00792922 -3.27795 63.546000 Cu 0.264921 0.141159 8.97513e-16 713 63.546 0.019488 -3.2767 63.546000 Cu 0.272326 0.115136 0.25 722 63.546 0.0268573 -3.27566 63.546000 Cu 0.264921 0.141159 0.5 723 63.546 0.019488 -3.2767 63.546000 Cu 0.348784 0.10097 0.75 718 63.546 1.39163 -3.22155 63.546000 Cu 0.348784 0.10097 0.25 719 63.546 1.39163 -3.22155 63.546000 Cu 0.341101 0.126236 1.76329e-18 720 63.546 0.436959 -3.24096 63.546000 Cu 0.420451 0.105374 1.31365e-15 721 63.546 1.27425 -3.27761 63.546000 Cu 0.341101 0.126236 0.5 724 63.546 0.436959 -3.24096 63.546000 Cu 0.420451 0.105374 0.5 731 63.546 1.27425 -3.27761 63.546000 Cu 0.411455 0.133452 0.75 774 63.546 0.42398 -3.28017 63.546000 Cu 0.411455 0.133452 0.25 775 63.546 0.42398 -3.28017 63.546000 Cu 0.486439 0.118323 0.75 773 63.546 0.0116991 -3.2714 63.546000 Cu 0.478361 0.145675 3.85455e-16 777 63.546 0.00423897 -3.27364 63.546000 Cu 0.553366 0.130977 1.07737e-15 783 63.546 0.00529572 -3.27667 63.546000 Cu 0.486439 0.118323 0.25 784 63.546 0.0116991 -3.2714 63.546000 Cu 0.478361 0.145675 0.5 785 63.546 0.00423897 -3.27364 63.546000 Cu 0.553366 0.130977 0.5 786 63.546 0.00529572 -3.27667 63.546000 Cu 0.562136 0.103955 0.75 781 63.546 0.0115961 -3.27676 63.546000 Cu 0.562136 0.103955 0.25 782 63.546 0.0115961 -3.27676 63.546000 Cu 0.628908 0.116773 1 554 63.546 0.00752919 -3.27768 63.546000 Cu 0.628908 0.116773 0.5 561 63.546 0.00752919 -3.27768 63.546000 Cu 0.696449 0.129249 0.75 583 63.546 0.00792922 -3.27795 63.546000 Cu 0.620939 0.143479 0.75 584 63.546 0.0036223 -3.27738 63.546000 Cu 0.620939 0.143479 0.25 585 63.546 0.0036223 -3.27738 63.546000 Cu 0.696449 0.129249 0.25 594 63.546 0.00792922 -3.27795 63.546000 Cu 0.704922 0.102837 1.25617e-15 558 63.546 0.0120262 -3.27813 63.546000 Cu 0.704922 0.102837 0.5 562 63.546 0.0120262 -3.27813 63.546000 Cu 0.848784 0.10097 0.75 589 63.546 1.39163 -3.22155 63.546000 Cu 0.848784 0.10097 0.25 602 63.546 1.39163 -3.22155 63.546000 Cu 0.772326 0.115136 0.75 590 63.546 0.0268573 -3.27566 63.546000 Cu 0.772326 0.115136 0.25 591 63.546 0.0268573 -3.27566 63.546000 Cu 0.764921 0.141159 5.38508e-16 592 63.546 0.019488 -3.2767 63.546000 Cu 0.841101 0.126236 1 593 63.546 0.436959 -3.24096 63.546000 Cu 0.764921 0.141159 0.5 596 63.546 0.019488 -3.2767 63.546000 Cu 0.841101 0.126236 0.5 603 63.546 0.436959 -3.24096 63.546000 Cu 0.920451 0.105374 7.18363e-16 600 63.546 1.27425 -3.27761 63.546000 Cu 0.920451 0.105374 0.5 604 63.546 1.27425 -3.27761 63.546000 Cu 0.911455 0.133452 0.75 637 63.546 0.42398 -3.28017 63.546000 Cu 0.986439 0.118323 0.75 646 63.546 0.0116991 -3.2714 63.546000 Cu 0.986439 0.118323 0.25 647 63.546 0.0116991 -3.2714 63.546000 Cu 0.978361 0.145675 1.07737e-15 648 63.546 0.00423897 -3.27364 63.546000 Cu 0.911455 0.133452 0.25 650 63.546 0.42398 -3.28017 63.546000 Cu 0.978361 0.145675 0.5 652 63.546 0.00423897 -3.27364 63.546000 Cu 0.0458436 0.157966 0.75 702 63.546 0.00179407 -3.27693 63.546000 Cu 0.0458436 0.157966 0.25 703 63.546 0.00179407 -3.27693 63.546000 Cu 0.0387272 0.184883 1.05797e-18 704 63.546 0.000844594 -3.27746 63.546000 Cu 0.113804 0.170181 5.14527e-16 705 63.546 0.00168159 -3.27749 63.546000 Cu 0.0387272 0.184883 0.5 708 63.546 0.000844594 -3.27746 63.546000 Cu 0.113804 0.170181 0.5 715 63.546 0.00168159 -3.27749 63.546000 Cu 0.106884 0.196859 0.75 758 63.546 0.000901624 -3.27784 63.546000 Cu 0.106884 0.196859 0.25 759 63.546 0.000901624 -3.27784 63.546000 Cu 0.189148 0.155665 1.07772e-15 712 63.546 0.00509209 -3.27786 63.546000 Cu 0.189148 0.155665 0.5 716 63.546 0.00509209 -3.27786 63.546000 Cu 0.182226 0.18212 0.75 757 63.546 0.00386119 -3.27789 63.546000 Cu 0.257979 0.167289 0.75 766 63.546 0.0125544 -3.27669 63.546000 Cu 0.257979 0.167289 0.25 767 63.546 0.0125544 -3.27669 63.546000 Cu 0.251077 0.19355 5.39566e-16 768 63.546 0.00585032 -3.27692 63.546000 Cu 0.182226 0.18212 0.25 770 63.546 0.00386119 -3.27789 63.546000 Cu 0.251077 0.19355 0.5 772 63.546 0.00585032 -3.27692 63.546000 Cu 0.334186 0.15193 0.75 765 63.546 0.103069 -3.26024 63.546000 Cu 0.327142 0.178023 1 769 63.546 0.0200522 -3.2712 63.546000 Cu 0.403479 0.160996 1.23501e-15 776 63.546 0.127387 -3.28173 63.546000 Cu 0.334186 0.15193 0.25 778 63.546 0.103069 -3.26024 63.546000 Cu 0.327142 0.178023 0.5 779 63.546 0.0200522 -3.2712 63.546000 Cu 0.403479 0.160996 0.5 780 63.546 0.127387 -3.28173 63.546000 Cu 0.395893 0.188194 0.75 821 63.546 0.035999 -3.28119 63.546000 Cu 0.395893 0.188194 0.25 834 63.546 0.035999 -3.28119 63.546000 Cu 0.545844 0.157966 0.75 829 63.546 0.00179407 -3.27693 63.546000 Cu 0.470946 0.172845 0.75 830 63.546 0.00245666 -3.27597 63.546000 Cu 0.470946 0.172845 0.25 831 63.546 0.00245666 -3.27597 63.546000 Cu 0.538727 0.184883 1 833 63.546 0.000844594 -3.27746 63.546000 Cu 0.545844 0.157966 0.25 837 63.546 0.00179407 -3.27693 63.546000 Cu 0.538727 0.184883 0.5 838 63.546 0.000844594 -3.27746 63.546000 Cu 0.46373 0.199854 5.64252e-18 832 63.546 0.0015605 -3.27735 63.546000 Cu 0.46373 0.199854 0.5 836 63.546 0.0015605 -3.27735 63.546000 Cu 0.613804 0.170181 7.79373e-16 586 63.546 0.00168159 -3.27749 63.546000 Cu 0.689148 0.155665 8.62953e-16 587 63.546 0.00509209 -3.27786 63.546000 Cu 0.613804 0.170181 0.5 588 63.546 0.00168159 -3.27749 63.546000 Cu 0.689148 0.155665 0.5 595 63.546 0.00509209 -3.27786 63.546000 Cu 0.606884 0.196859 0.75 627 63.546 0.000901624 -3.27784 63.546000 Cu 0.682226 0.18212 0.75 630 63.546 0.00386119 -3.27789 63.546000 Cu 0.682226 0.18212 0.25 631 63.546 0.00386119 -3.27789 63.546000 Cu 0.606884 0.196859 0.25 634 63.546 0.000901624 -3.27784 63.546000 Cu 0.757979 0.167289 0.75 629 63.546 0.0125544 -3.27669 63.546000 Cu 0.751077 0.19355 3.24445e-17 633 63.546 0.00585032 -3.27692 63.546000 Cu 0.834186 0.15193 0.75 638 63.546 0.103069 -3.26024 63.546000 Cu 0.834186 0.15193 0.25 639 63.546 0.103069 -3.26024 63.546000 Cu 0.827142 0.178023 5.39566e-16 640 63.546 0.0200522 -3.2712 63.546000 Cu 0.757979 0.167289 0.25 642 63.546 0.0125544 -3.27669 63.546000 Cu 0.751077 0.19355 0.5 643 63.546 0.00585032 -3.27692 63.546000 Cu 0.827142 0.178023 0.5 644 63.546 0.0200522 -3.2712 63.546000 Cu 0.903479 0.160996 6.91209e-17 641 63.546 0.127387 -3.28173 63.546000 Cu 0.903479 0.160996 0.5 651 63.546 0.127387 -3.28173 63.546000 Cu 0.970946 0.172845 0.75 693 63.546 0.00245666 -3.27597 63.546000 Cu 0.895893 0.188194 0.75 694 63.546 0.035999 -3.28119 63.546000 Cu 0.895893 0.188194 0.25 695 63.546 0.035999 -3.28119 63.546000 Cu 0.970946 0.172845 0.25 706 63.546 0.00245666 -3.27597 63.546000 Cu 0.96373 0.199854 3.10339e-16 697 63.546 0.0015605 -3.27735 63.546000 Cu 0.96373 0.199854 0.5 707 63.546 0.0015605 -3.27735 63.546000 Cu 0.0317072 0.21172 0.75 749 63.546 0.00040737 -3.27791 63.546000 Cu 0.0246593 0.2385 5.01479e-16 753 63.546 0.000187549 -3.27798 63.546000 Cu 0.0999492 0.223529 5.39566e-16 760 63.546 0.000695347 -3.2781 63.546000 Cu 0.0317072 0.21172 0.25 762 63.546 0.00040737 -3.27791 63.546000 Cu 0.0246593 0.2385 0.5 763 63.546 0.000187549 -3.27798 63.546000 Cu 0.0999492 0.223529 0.5 764 63.546 0.000695347 -3.2781 63.546000 Cu 0.175362 0.208617 6.6617e-16 761 63.546 0.00278414 -3.27785 63.546000 Cu 0.175362 0.208617 0.5 771 63.546 0.00278414 -3.27785 63.546000 Cu 0.244125 0.219942 0.75 813 63.546 0.00223187 -3.27742 63.546000 Cu 0.168462 0.235133 0.75 814 63.546 0.00136621 -3.27778 63.546000 Cu 0.168462 0.235133 0.25 815 63.546 0.00136621 -3.27778 63.546000 Cu 0.237085 0.246438 4.26715e-16 817 63.546 0.000849679 -3.2778 63.546000 Cu 0.244125 0.219942 0.25 826 63.546 0.00223187 -3.27742 63.546000 Cu 0.237085 0.246438 0.5 827 63.546 0.000849679 -3.2778 63.546000 Cu 0.320003 0.204412 0.75 822 63.546 0.00370662 -3.2759 63.546000 Cu 0.320003 0.204412 0.25 823 63.546 0.00370662 -3.2759 63.546000 Cu 0.312863 0.230948 1.80208e-16 824 63.546 0.000860273 -3.27747 63.546000 Cu 0.388528 0.21518 8.98571e-16 825 63.546 0.0106027 -3.28005 63.546000 Cu 0.312863 0.230948 0.5 828 63.546 0.000860273 -3.27747 63.546000 Cu 0.388528 0.21518 0.5 835 63.546 0.0106027 -3.28005 63.546000 Cu 0.381254 0.242033 0.75 878 63.546 0.00329359 -3.27914 63.546000 Cu 0.381254 0.242033 0.25 879 63.546 0.00329359 -3.27914 63.546000 Cu 0.456533 0.226761 0.75 877 63.546 0.000843223 -3.27791 63.546000 Cu 0.531707 0.21172 0.75 885 63.546 0.00040737 -3.27791 63.546000 Cu 0.531707 0.21172 0.25 886 63.546 0.00040737 -3.27791 63.546000 Cu 0.524659 0.2385 1.01318e-15 887 63.546 0.000187549 -3.27798 63.546000 Cu 0.456533 0.226761 0.25 888 63.546 0.000843223 -3.27791 63.546000 Cu 0.524659 0.2385 0.5 890 63.546 0.000187549 -3.27798 63.546000 Cu 0.599949 0.223529 1.41063e-18 628 63.546 0.000695347 -3.2781 63.546000 Cu 0.675362 0.208617 7.87837e-16 632 63.546 0.00278414 -3.27785 63.546000 Cu 0.599949 0.223529 0.5 635 63.546 0.000695347 -3.2781 63.546000 Cu 0.675362 0.208617 0.5 636 63.546 0.00278414 -3.27785 63.546000 Cu 0.668462 0.235133 0.75 681 63.546 0.00136621 -3.27778 63.546000 Cu 0.668462 0.235133 0.25 690 63.546 0.00136621 -3.27778 63.546000 Cu 0.820003 0.204412 0.75 685 63.546 0.00370662 -3.2759 63.546000 Cu 0.744125 0.219942 0.75 686 63.546 0.00223187 -3.27742 63.546000 Cu 0.744125 0.219942 0.25 687 63.546 0.00223187 -3.27742 63.546000 Cu 0.737085 0.246438 2.27817e-16 688 63.546 0.000849679 -3.2778 63.546000 Cu 0.812863 0.230948 1.09324e-16 689 63.546 0.000860273 -3.27747 63.546000 Cu 0.737085 0.246438 0.5 692 63.546 0.000849679 -3.2778 63.546000 Cu 0.820003 0.204412 0.25 698 63.546 0.00370662 -3.2759 63.546000 Cu 0.812863 0.230948 0.5 699 63.546 0.000860273 -3.27747 63.546000 Cu 0.888528 0.21518 1.43602e-15 696 63.546 0.0106027 -3.28005 63.546000 Cu 0.888528 0.21518 0.5 700 63.546 0.0106027 -3.28005 63.546000 Cu 0.881254 0.242033 0.75 741 63.546 0.00329359 -3.27914 63.546000 Cu 0.956533 0.226761 0.75 750 63.546 0.000843223 -3.27791 63.546000 Cu 0.956533 0.226761 0.25 751 63.546 0.000843223 -3.27791 63.546000 Cu 0.881254 0.242033 0.25 754 63.546 0.00329359 -3.27914 63.546000 Cu 0.0929683 0.250187 0.75 805 63.546 0.00048698 -3.27818 63.546000 Cu 0.0176802 0.265234 0.75 806 63.546 9.53314e-05 -3.27808 63.546000 Cu 0.0176802 0.265234 0.25 807 63.546 9.53314e-05 -3.27808 63.546000 Cu 0.0108022 0.291962 1.79855e-16 808 63.546 3.12044e-05 -3.27828 63.546000 Cu 0.08606 0.276857 9.21141e-16 809 63.546 0.00044731 -3.27836 63.546000 Cu 0.0108022 0.291962 0.5 812 63.546 3.12044e-05 -3.27828 63.546000 Cu 0.0929683 0.250187 0.25 818 63.546 0.00048698 -3.27818 63.546000 Cu 0.08606 0.276857 0.5 819 63.546 0.00044731 -3.27836 63.546000 Cu 0.161474 0.261702 3.59711e-16 816 63.546 0.000727221 -3.27807 63.546000 Cu 0.161474 0.261702 0.5 820 63.546 0.000727221 -3.27807 63.546000 Cu 0.154601 0.288313 0.75 861 63.546 0.000357092 -3.27832 63.546000 Cu 0.230102 0.27301 0.75 870 63.546 0.000307956 -3.27823 63.546000 Cu 0.230102 0.27301 0.25 871 63.546 0.000307956 -3.27823 63.546000 Cu 0.223216 0.299617 8.98218e-16 872 63.546 7.38271e-05 -3.2781 63.546000 Cu 0.154601 0.288313 0.25 874 63.546 0.000357092 -3.27832 63.546000 Cu 0.223216 0.299617 0.5 876 63.546 7.38271e-05 -3.2781 63.546000 Cu 0.305715 0.257563 0.75 869 63.546 0.000377624 -3.27815 63.546000 Cu 0.29874 0.284217 3.31851e-16 873 63.546 0.000247598 -3.27842 63.546000 Cu 0.374142 0.268811 1.25652e-15 880 63.546 0.00131114 -3.27877 63.546000 Cu 0.305715 0.257563 0.25 882 63.546 0.000377624 -3.27815 63.546000 Cu 0.29874 0.284217 0.5 883 63.546 0.000247598 -3.27842 63.546000 Cu 0.374142 0.268811 0.5 884 63.546 0.00131114 -3.27877 63.546000 Cu 0.367225 0.295546 0.75 925 63.546 0.000794162 -3.27852 63.546000 Cu 0.367225 0.295546 0.25 938 63.546 0.000794162 -3.27852 63.546000 Cu 0.44943 0.253568 1.05797e-18 881 63.546 0.000470605 -3.27816 63.546000 Cu 0.44943 0.253568 0.5 889 63.546 0.000470605 -3.27816 63.546000 Cu 0.51768 0.265234 0.75 933 63.546 9.53314e-05 -3.27808 63.546000 Cu 0.442464 0.280342 0.75 934 63.546 0.000183322 -3.27842 63.546000 Cu 0.442464 0.280342 0.25 935 63.546 0.000183322 -3.27842 63.546000 Cu 0.510802 0.291962 1.80913e-16 937 63.546 3.12044e-05 -3.27828 63.546000 Cu 0.51768 0.265234 0.25 942 63.546 9.53314e-05 -3.27808 63.546000 Cu 0.510802 0.291962 0.5 943 63.546 3.12044e-05 -3.27828 63.546000 Cu 0.592968 0.250187 0.75 682 63.546 0.00048698 -3.27818 63.546000 Cu 0.592968 0.250187 0.25 683 63.546 0.00048698 -3.27818 63.546000 Cu 0.661474 0.261702 5.33571e-16 684 63.546 0.000727221 -3.27807 63.546000 Cu 0.661474 0.261702 0.5 691 63.546 0.000727221 -3.27807 63.546000 Cu 0.654601 0.288313 0.75 736 63.546 0.000357092 -3.27832 63.546000 Cu 0.654601 0.288313 0.25 737 63.546 0.000357092 -3.27832 63.546000 Cu 0.58606 0.276857 1.49527e-16 941 63.546 0.00044731 -3.27836 63.546000 Cu 0.58606 0.276857 0.5 944 63.546 0.00044731 -3.27836 63.546000 Cu 0.730102 0.27301 0.75 735 63.546 0.000307956 -3.27823 63.546000 Cu 0.723216 0.299617 1.46705e-16 739 63.546 7.38271e-05 -3.2781 63.546000 Cu 0.805715 0.257563 0.75 742 63.546 0.000377624 -3.27815 63.546000 Cu 0.805715 0.257563 0.25 743 63.546 0.000377624 -3.27815 63.546000 Cu 0.79874 0.284217 3.83339e-16 744 63.546 0.000247598 -3.27842 63.546000 Cu 0.730102 0.27301 0.25 746 63.546 0.000307956 -3.27823 63.546000 Cu 0.723216 0.299617 0.5 747 63.546 7.38271e-05 -3.2781 63.546000 Cu 0.79874 0.284217 0.5 748 63.546 0.000247598 -3.27842 63.546000 Cu 0.874142 0.268811 2.94822e-16 745 63.546 0.00131114 -3.27877 63.546000 Cu 0.94943 0.253568 1.76329e-18 752 63.546 0.000470605 -3.27816 63.546000 Cu 0.874142 0.268811 0.5 755 63.546 0.00131114 -3.27877 63.546000 Cu 0.94943 0.253568 0.5 756 63.546 0.000470605 -3.27816 63.546000 Cu 0.942464 0.280342 0.75 797 63.546 0.000183322 -3.27842 63.546000 Cu 0.867225 0.295546 0.75 798 63.546 0.000794162 -3.27852 63.546000 Cu 0.867225 0.295546 0.25 799 63.546 0.000794162 -3.27852 63.546000 Cu 0.942464 0.280342 0.25 810 63.546 0.000183322 -3.27842 63.546000 Cu 0.0039119 0.318695 0.75 853 63.546 8.7267e-05 -3.27827 63.546000 Cu 0.0792122 0.30355 0.75 862 63.546 0.000547378 -3.27849 63.546000 Cu 0.0792122 0.30355 0.25 863 63.546 0.000547378 -3.27849 63.546000 Cu 0.0722168 0.330249 7.19421e-16 864 63.546 0.000726483 -3.27851 63.546000 Cu 0.0039119 0.318695 0.25 866 63.546 8.7267e-05 -3.27827 63.546000 Cu 0.0722168 0.330249 0.5 868 63.546 0.000726483 -3.27851 63.546000 Cu 0.140618 0.341595 0.75 918 63.546 0.000447787 -3.27844 63.546000 Cu 0.140618 0.341595 0.25 919 63.546 0.000447787 -3.27844 63.546000 Cu 0.147712 0.314953 4.37648e-16 865 63.546 0.000362276 -3.27847 63.546000 Cu 0.147712 0.314953 0.5 875 63.546 0.000362276 -3.27847 63.546000 Cu 0.216299 0.326211 0.75 917 63.546 0.000130124 -3.27793 63.546000 Cu 0.216299 0.326211 0.25 930 63.546 0.000130124 -3.27793 63.546000 Cu 0.284849 0.337494 3.59711e-16 928 63.546 0.000462931 -3.27823 63.546000 Cu 0.284849 0.337494 0.5 932 63.546 0.000462931 -3.27823 63.546000 Cu 0.291814 0.310862 0.75 926 63.546 0.000294361 -3.27835 63.546000 Cu 0.291814 0.310862 0.25 927 63.546 0.000294361 -3.27835 63.546000 Cu 0.360297 0.322247 6.89445e-16 929 63.546 0.00067364 -3.27843 63.546000 Cu 0.360297 0.322247 0.5 939 63.546 0.00067364 -3.27843 63.546000 Cu 0.35326 0.348931 0.75 980 63.546 0.000593677 -3.27825 63.546000 Cu 0.35326 0.348931 0.25 981 63.546 0.000593677 -3.27825 63.546000 Cu 0.435589 0.3071 7.18716e-16 936 63.546 5.78592e-05 -3.27838 63.546000 Cu 0.435589 0.3071 0.5 940 63.546 5.78592e-05 -3.27838 63.546000 Cu 0.428604 0.333833 0.75 979 63.546 5.61593e-05 -3.27823 63.546000 Cu 0.503912 0.318695 0.75 988 63.546 8.7267e-05 -3.27827 63.546000 Cu 0.503912 0.318695 0.25 989 63.546 8.7267e-05 -3.27827 63.546000 Cu 0.496828 0.345445 7.18716e-16 990 63.546 0.000153776 -3.27834 63.546000 Cu 0.428604 0.333833 0.25 992 63.546 5.61593e-05 -3.27823 63.546000 Cu 0.496828 0.345445 0.5 994 63.546 0.000153776 -3.27834 63.546000 Cu 0.647712 0.314953 2.33812e-16 738 63.546 0.000362276 -3.27847 63.546000 Cu 0.647712 0.314953 0.5 740 63.546 0.000362276 -3.27847 63.546000 Cu 0.640618 0.341595 0.75 787 63.546 0.000447787 -3.27844 63.546000 Cu 0.640618 0.341595 0.25 794 63.546 0.000447787 -3.27844 63.546000 Cu 0.579212 0.30355 0.75 987 63.546 0.000547378 -3.27849 63.546000 Cu 0.572217 0.330249 5.39918e-16 991 63.546 0.000726483 -3.27851 63.546000 Cu 0.579212 0.30355 0.25 995 63.546 0.000547378 -3.27849 63.546000 Cu 0.572217 0.330249 0.5 996 63.546 0.000726483 -3.27851 63.546000 Cu 0.791814 0.310862 0.75 789 63.546 0.000294361 -3.27835 63.546000 Cu 0.716299 0.326211 0.75 790 63.546 0.000130124 -3.27793 63.546000 Cu 0.716299 0.326211 0.25 791 63.546 0.000130124 -3.27793 63.546000 Cu 0.784849 0.337494 4.68682e-16 793 63.546 0.000462931 -3.27823 63.546000 Cu 0.791814 0.310862 0.25 802 63.546 0.000294361 -3.27835 63.546000 Cu 0.784849 0.337494 0.5 803 63.546 0.000462931 -3.27823 63.546000 Cu 0.85326 0.348931 0.75 845 63.546 0.000593677 -3.27825 63.546000 Cu 0.85326 0.348931 0.25 858 63.546 0.000593677 -3.27825 63.546000 Cu 0.996828 0.345445 1.41063e-18 857 63.546 0.000153776 -3.27834 63.546000 Cu 0.996828 0.345445 0.5 867 63.546 0.000153776 -3.27834 63.546000 Cu 0.860297 0.322247 5.43092e-16 800 63.546 0.00067364 -3.27843 63.546000 Cu 0.935589 0.3071 9.31016e-16 801 63.546 5.78592e-05 -3.27838 63.546000 Cu 0.860297 0.322247 0.5 804 63.546 0.00067364 -3.27843 63.546000 Cu 0.935589 0.3071 0.5 811 63.546 5.78592e-05 -3.27838 63.546000 Cu 0.928604 0.333833 0.75 854 63.546 5.61593e-05 -3.27823 63.546000 Cu 0.928604 0.333833 0.25 855 63.546 5.61593e-05 -3.27823 63.546000 Cu 0.0650267 0.356988 0.75 909 63.546 0.00143343 -3.27881 63.546000 Cu 0.057635 0.383772 2.4686e-17 913 63.546 0.0038337 -3.27937 63.546000 Cu 0.133337 0.368234 5.39566e-16 920 63.546 0.000624339 -3.27821 63.546000 Cu 0.0650267 0.356988 0.25 922 63.546 0.00143343 -3.27881 63.546000 Cu 0.057635 0.383772 0.5 923 63.546 0.0038337 -3.27937 63.546000 Cu 0.133337 0.368234 0.5 924 63.546 0.000624339 -3.27821 63.546000 Cu 0.125946 0.39485 0.75 963 63.546 0.00114078 -3.2777 63.546000 Cu 0.125946 0.39485 0.25 976 63.546 0.00114078 -3.2777 63.546000 Cu 0.20916 0.352776 4.55633e-16 921 63.546 0.000468529 -3.27775 63.546000 Cu 0.20916 0.352776 0.5 931 63.546 0.000468529 -3.27775 63.546000 Cu 0.277716 0.364082 0.75 971 63.546 0.000671737 -3.27828 63.546000 Cu 0.201902 0.379296 0.75 972 63.546 0.00187342 -3.27733 63.546000 Cu 0.201902 0.379296 0.25 973 63.546 0.00187342 -3.27733 63.546000 Cu 0.27049 0.390641 4.65155e-16 975 63.546 0.000965085 -3.27849 63.546000 Cu 0.277716 0.364082 0.25 984 63.546 0.000671737 -3.27828 63.546000 Cu 0.27049 0.390641 0.5 985 63.546 0.000965085 -3.27849 63.546000 Cu 0.346091 0.375588 1.80561e-16 982 63.546 0.000672396 -3.2781 63.546000 Cu 0.421496 0.360557 3.24092e-16 983 63.546 0.000133757 -3.27815 63.546000 Cu 0.346091 0.375588 0.5 986 63.546 0.000672396 -3.2781 63.546000 Cu 0.421496 0.360557 0.5 993 63.546 0.000133757 -3.27815 63.546000 Cu 0.414236 0.387295 0.75 1020 63.546 0.000229837 -3.27833 63.546000 Cu 0.414236 0.387295 0.25 1021 63.546 0.000229837 -3.27833 63.546000 Cu 0.48959 0.372217 0.75 1019 63.546 0.000328355 -3.27803 63.546000 Cu 0.482224 0.399014 4.98305e-16 1023 63.546 0.000425802 -3.27753 63.546000 Cu 0.557635 0.383772 1.79855e-16 1029 63.546 0.0038337 -3.27937 63.546000 Cu 0.48959 0.372217 0.25 1030 63.546 0.000328355 -3.27803 63.546000 Cu 0.482224 0.399014 0.5 1031 63.546 0.000425802 -3.27753 63.546000 Cu 0.557635 0.383772 0.5 1032 63.546 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0.77049 0.390641 0.5 852 63.546 0.000965085 -3.27849 63.546000 Cu 0.846091 0.375588 0.5 859 63.546 0.000672396 -3.2781 63.546000 Cu 0.921496 0.360557 2.28875e-16 856 63.546 0.000133757 -3.27815 63.546000 Cu 0.921496 0.360557 0.5 860 63.546 0.000133757 -3.27815 63.546000 Cu 0.914236 0.387295 0.75 901 63.546 0.000229837 -3.27833 63.546000 Cu 0.98959 0.372217 0.75 910 63.546 0.000328355 -3.27803 63.546000 Cu 0.98959 0.372217 0.25 911 63.546 0.000328355 -3.27803 63.546000 Cu 0.982224 0.399014 2.90942e-16 912 63.546 0.000425802 -3.27753 63.546000 Cu 0.914236 0.387295 0.25 914 63.546 0.000229837 -3.27833 63.546000 Cu 0.982224 0.399014 0.5 916 63.546 0.000425802 -3.27753 63.546000 Cu 0.0500851 0.410644 0.75 964 63.546 0.0131616 -3.28021 63.546000 Cu 0.0500851 0.410644 0.25 965 63.546 0.0131616 -3.28021 63.546000 Cu 0.0422908 0.437673 2.71194e-16 966 63.546 0.0498205 -3.28177 63.546000 Cu 0.118411 0.421387 5.21228e-16 967 63.546 0.00356265 -3.27603 63.546000 Cu 0.0422908 0.437673 0.5 970 63.546 0.0498205 -3.28177 63.546000 Cu 0.118411 0.421387 0.5 977 63.546 0.00356265 -3.27603 63.546000 Cu 0.110848 0.44777 0.75 1004 63.546 0.016728 -3.27112 63.546000 Cu 0.110848 0.44777 0.25 1005 63.546 0.016728 -3.27112 63.546000 Cu 0.194604 0.405739 1.79855e-16 974 63.546 0.00622428 -3.27624 63.546000 Cu 0.194604 0.405739 0.5 978 63.546 0.00622428 -3.27624 63.546000 Cu 0.187305 0.432042 0.75 1003 63.546 0.0191956 -3.27443 63.546000 Cu 0.263195 0.417182 0.75 1012 63.546 0.000921202 -3.27904 63.546000 Cu 0.263195 0.417182 0.25 1013 63.546 0.000921202 -3.27904 63.546000 Cu 0.255935 0.443715 8.97513e-16 1014 63.546 0.00172305 -3.28088 63.546000 Cu 0.187305 0.432042 0.25 1016 63.546 0.0191956 -3.27443 63.546000 Cu 0.255935 0.443715 0.5 1018 63.546 0.00172305 -3.28088 63.546000 Cu 0.399449 0.440953 0.25 526 63.546 0.00367211 -3.27959 63.546000 Cu 0.338799 0.402227 0.75 1011 63.546 0.00100874 -3.27761 63.546000 Cu 0.331513 0.428854 6.27378e-16 1015 63.546 0.00269028 -3.27693 63.546000 Cu 0.406857 0.414074 7.18363e-16 1022 63.546 0.000744233 -3.27868 63.546000 Cu 0.338799 0.402227 0.25 1024 63.546 0.00100874 -3.27761 63.546000 Cu 0.331513 0.428854 0.5 1025 63.546 0.00269028 -3.27693 63.546000 Cu 0.406857 0.414074 0.5 1026 63.546 0.000744233 -3.27868 63.546000 Cu 0.399449 0.440953 0.75 1039 63.546 0.00367211 -3.27959 63.546000 Cu 0.542291 0.437673 0.5 491 63.546 0.0498205 -3.28177 63.546000 Cu 0.550085 0.410644 0.25 494 63.546 0.0131616 -3.28021 63.546000 Cu 0.542291 0.437673 5.22638e-16 527 63.546 0.0498205 -3.28177 63.546000 Cu 0.474702 0.425868 0.25 530 63.546 0.000302301 -3.27641 63.546000 Cu 0.550085 0.410644 0.75 1047 63.546 0.0131616 -3.28021 63.546000 Cu 0.474702 0.425868 0.75 1048 63.546 0.000302301 -3.27641 63.546000 Cu 0.618411 0.421387 6.31962e-16 842 63.546 0.00356265 -3.27603 63.546000 Cu 0.694604 0.405739 9.60639e-16 843 63.546 0.00622428 -3.27624 63.546000 Cu 0.618411 0.421387 0.5 844 63.546 0.00356265 -3.27603 63.546000 Cu 0.694604 0.405739 0.5 851 63.546 0.00622428 -3.27624 63.546000 Cu 0.610848 0.44777 0.75 891 63.546 0.016728 -3.27112 63.546000 Cu 0.687305 0.432042 0.75 894 63.546 0.0191956 -3.27443 63.546000 Cu 0.687305 0.432042 0.25 895 63.546 0.0191956 -3.27443 63.546000 Cu 0.610848 0.44777 0.25 898 63.546 0.016728 -3.27112 63.546000 Cu 0.763195 0.417182 0.75 893 63.546 0.000921202 -3.27904 63.546000 Cu 0.755935 0.443715 5.20875e-16 897 63.546 0.00172305 -3.28088 63.546000 Cu 0.838799 0.402227 0.75 902 63.546 0.00100874 -3.27761 63.546000 Cu 0.838799 0.402227 0.25 903 63.546 0.00100874 -3.27761 63.546000 Cu 0.831513 0.428854 2.00309e-16 904 63.546 0.00269028 -3.27693 63.546000 Cu 0.763195 0.417182 0.25 906 63.546 0.000921202 -3.27904 63.546000 Cu 0.755935 0.443715 0.5 907 63.546 0.00172305 -3.28088 63.546000 Cu 0.831513 0.428854 0.5 908 63.546 0.00269028 -3.27693 63.546000 Cu 0.906857 0.414074 4.94778e-16 905 63.546 0.000744233 -3.27868 63.546000 Cu 0.906857 0.414074 0.5 915 63.546 0.000744233 -3.27868 63.546000 Cu 0.974702 0.425868 0.75 955 63.546 0.000302301 -3.27641 63.546000 Cu 0.899449 0.440953 0.75 956 63.546 0.00367211 -3.27959 63.546000 Cu 0.899449 0.440953 0.25 957 63.546 0.00367211 -3.27959 63.546000 Cu 0.974702 0.425868 0.25 968 63.546 0.000302301 -3.27641 63.546000 Cu 0.0342863 0.464978 0.75 998 63.546 0.198998 -3.27528 63.546000 Cu 0.026794 0.492988 1.85145e-16 1001 63.546 4.69192 -3.29673 63.546000 Cu 0.103211 0.473852 2.853e-16 1006 63.546 0.117302 -3.2477 63.546000 Cu 0.0342863 0.464978 0.25 1008 63.546 0.198998 -3.27528 63.546000 Cu 0.026794 0.492988 0.5 1009 63.546 4.69192 -3.29673 63.546000 Cu 0.103211 0.473852 0.5 1010 63.546 0.117302 -3.2477 63.546000 Cu 0.0993662 0.499747 0.75 1033 63.546 4.34521 -3.23311 63.546000 Cu 0.0993662 0.499747 0.25 1038 63.546 4.34521 -3.23311 63.546000 Cu 0.180004 0.458128 5.25107e-16 1007 63.546 0.0552597 -3.26757 63.546000 Cu 0.180004 0.458128 0.5 1017 63.546 0.0552597 -3.26757 63.546000 Cu 0.248532 0.470282 0.75 1034 63.546 0.0174742 -3.26848 63.546000 Cu 0.172952 0.483894 0.75 1035 63.546 3.52415 -3.228 63.546000 Cu 0.172952 0.483894 0.25 1036 63.546 3.52415 -3.228 63.546000 Cu 0.24162 0.497287 7.88895e-16 1037 63.546 5.58532 -3.2809 63.546000 Cu 0.248532 0.470282 0.25 1044 63.546 0.0174742 -3.26848 63.546000 Cu 0.24162 0.497287 0.5 1045 63.546 5.58532 -3.2809 63.546000 Cu 0.384967 0.495528 0.25 52 63.546 5.52112 -3.27508 63.546000 Cu 0.384967 0.495528 0.75 94 63.546 5.52112 -3.27508 63.546000 Cu 0.391835 0.467982 0.5 498 63.546 0.026676 -3.26712 63.546000 Cu 0.32419 0.455453 0.75 1040 63.546 0.010228 -3.27089 63.546000 Cu 0.32419 0.455453 0.25 1041 63.546 0.010228 -3.27089 63.546000 Cu 0.316584 0.48183 7.19421e-16 1042 63.546 3.43548 -3.23068 63.546000 Cu 0.391835 0.467982 6.41131e-16 1043 63.546 0.026676 -3.26712 63.546000 Cu 0.316584 0.48183 0.5 1046 63.546 3.43548 -3.23068 63.546000 Cu 0.526794 0.492988 0.5 3 63.546 4.69192 -3.29673 63.546000 Cu 0.459383 0.479608 0.25 9 63.546 3.38341 -3.23229 63.546000 Cu 0.526794 0.492988 3.59711e-16 19 63.546 4.69192 -3.29673 63.546000 Cu 0.534286 0.464978 0.25 26 63.546 0.198998 -3.27528 63.546000 Cu 0.534286 0.464978 0.75 50 63.546 0.198998 -3.27528 63.546000 Cu 0.459383 0.479608 0.75 95 63.546 3.38341 -3.23229 63.546000 Cu 0.467082 0.452778 0.5 497 63.546 0.00225592 -3.2707 63.546000 Cu 0.467082 0.452778 7.18363e-16 528 63.546 0.00225592 -3.2707 63.546000 Cu 0.603211 0.473852 1 892 63.546 0.117302 -3.2477 63.546000 Cu 0.680004 0.458128 1 896 63.546 0.0552597 -3.26757 63.546000 Cu 0.603211 0.473852 0.5 899 63.546 0.117302 -3.2477 63.546000 Cu 0.680004 0.458128 0.5 900 63.546 0.0552597 -3.26757 63.546000 Cu 0.672952 0.483894 0.75 945 63.546 3.52415 -3.228 63.546000 Cu 0.672952 0.483894 0.25 953 63.546 3.52415 -3.228 63.546000 Cu 0.599366 0.499747 0.75 946 63.546 4.34521 -3.23311 63.546000 Cu 0.599366 0.499747 0.25 947 63.546 4.34521 -3.23311 63.546000 Cu 0.82419 0.455453 0.75 948 63.546 0.010228 -3.27089 63.546000 Cu 0.748532 0.470282 0.75 949 63.546 0.0174742 -3.26848 63.546000 Cu 0.748532 0.470282 0.25 950 63.546 0.0174742 -3.26848 63.546000 Cu 0.74162 0.497287 3.12454e-16 951 63.546 5.58532 -3.2809 63.546000 Cu 0.816584 0.48183 1.06256e-15 952 63.546 3.43548 -3.23068 63.546000 Cu 0.74162 0.497287 0.5 954 63.546 5.58532 -3.2809 63.546000 Cu 0.82419 0.455453 0.25 960 63.546 0.010228 -3.27089 63.546000 Cu 0.816584 0.48183 0.5 961 63.546 3.43548 -3.23068 63.546000 Cu 0.891835 0.467982 5.1488e-17 958 63.546 0.026676 -3.26712 63.546000 Cu 0.967082 0.452778 3.43488e-16 959 63.546 0.00225592 -3.2707 63.546000 Cu 0.891835 0.467982 0.5 962 63.546 0.026676 -3.26712 63.546000 Cu 0.967082 0.452778 0.5 969 63.546 0.00225592 -3.2707 63.546000 Cu 0.884967 0.495528 0.75 997 63.546 5.52112 -3.27508 63.546000 Cu 0.959383 0.479608 0.75 999 63.546 3.38341 -3.23229 63.546000 Cu 0.959383 0.479608 0.25 1000 63.546 3.38341 -3.23229 63.546000 Cu 0.884967 0.495528 0.25 1002 63.546 5.52112 -3.27508 63.546000 Cu 0.111881 0.525542 0.5 7 63.546 5.81453 -3.24364 63.546000 Cu 0.111881 0.525542 7.10957e-16 10 63.546 5.81453 -3.24364 63.546000 Cu 0.0392639 0.521555 0.25 21 63.546 5.66171 -3.26516 63.546000 Cu 0.0392639 0.521555 0.75 34 63.546 5.66171 -3.26516 63.546000 Cu 0.0534103 0.549464 0.5 32 63.546 5.40246 -3.27672 63.546000 Cu 0.0534103 0.549464 9.27489e-16 36 63.546 5.40246 -3.27672 63.546000 Cu 0.256503 0.52391 0.25 4 63.546 0.0321303 -3.26884 63.546000 Cu 0.177363 0.512529 0.25 5 63.546 3.41493 -3.2275 63.546000 Cu 0.177363 0.512529 0.75 6 63.546 3.41493 -3.2275 63.546000 Cu 0.19194 0.537822 0.5 8 63.546 0.0180086 -3.26559 63.546000 Cu 0.256503 0.52391 0.75 15 63.546 0.0321303 -3.26884 63.546000 Cu 0.19194 0.537822 1.05797e-18 16 63.546 0.0180086 -3.26559 63.546000 Cu 0.321206 0.510902 0.5 1 63.546 3.38217 -3.22992 63.546000 Cu 0.321206 0.510902 5.12411e-16 2 63.546 3.38217 -3.22992 63.546000 Cu 0.335605 0.537017 0.25 11 63.546 0.020065 -3.2703 63.546000 Cu 0.335605 0.537017 0.75 12 63.546 0.020065 -3.2703 63.546000 Cu 0.399467 0.522937 0.5 96 63.546 0.0152382 -3.26566 63.546000 Cu 0.399467 0.522937 7.79726e-16 103 63.546 0.0152382 -3.26566 63.546000 Cu 0.46317 0.509166 0.25 93 63.546 3.34851 -3.229 63.546000 Cu 0.539264 0.521555 0.25 98 63.546 5.66171 -3.26516 63.546000 Cu 0.539264 0.521555 0.75 99 63.546 5.66171 -3.26516 63.546000 Cu 0.476925 0.536301 0.5 100 63.546 0.0186286 -3.26267 63.546000 Cu 0.46317 0.509166 0.75 102 63.546 3.34851 -3.229 63.546000 Cu 0.476925 0.536301 1.28367e-16 104 63.546 0.0186286 -3.26267 63.546000 Cu 0.55341 0.549464 0.5 101 63.546 5.40246 -3.27672 63.546000 Cu 0.55341 0.549464 4.78909e-16 111 63.546 5.40246 -3.27672 63.546000 Cu 0.677363 0.512529 0.25 49 63.546 3.41493 -3.2275 63.546000 Cu 0.611881 0.525542 0.5 51 63.546 5.81453 -3.24364 63.546000 Cu 0.69194 0.537822 0.5 56 63.546 0.0180086 -3.26559 63.546000 Cu 0.677363 0.512529 0.75 58 63.546 3.41493 -3.2275 63.546000 Cu 0.611881 0.525542 8.78822e-16 59 63.546 5.81453 -3.24364 63.546000 Cu 0.69194 0.537822 4.63744e-16 60 63.546 0.0180086 -3.26559 63.546000 Cu 0.821206 0.510902 0.5 20 63.546 3.38217 -3.22992 63.546000 Cu 0.821206 0.510902 5.83295e-16 27 63.546 3.38217 -3.22992 63.546000 Cu 0.835605 0.537017 0.25 53 63.546 0.020065 -3.2703 63.546000 Cu 0.756503 0.52391 0.25 54 63.546 0.0321303 -3.26884 63.546000 Cu 0.756503 0.52391 0.75 55 63.546 0.0321303 -3.26884 63.546000 Cu 0.835605 0.537017 0.75 66 63.546 0.020065 -3.2703 63.546000 Cu 0.96317 0.509166 0.25 22 63.546 3.34851 -3.229 63.546000 Cu 0.96317 0.509166 0.75 23 63.546 3.34851 -3.229 63.546000 Cu 0.899467 0.522937 0.5 24 63.546 0.0152382 -3.26566 63.546000 Cu 0.976925 0.536301 0.5 25 63.546 0.0186286 -3.26267 63.546000 Cu 0.899467 0.522937 8.55547e-16 28 63.546 0.0152382 -3.26566 63.546000 Cu 0.976925 0.536301 5.043e-16 35 63.546 0.0186286 -3.26267 63.546000 Cu 0.126284 0.55074 0.25 30 63.546 5.05189 -3.23702 63.546000 Cu 0.126284 0.55074 0.75 31 63.546 5.05189 -3.23702 63.546000 Cu 0.139154 0.575646 0.5 33 63.546 4.5274 -3.2201 63.546000 Cu 0.139154 0.575646 8.54489e-16 43 63.546 4.5274 -3.2201 63.546000 Cu 0.0666687 0.577552 0.25 70 63.546 4.53487 -3.27732 63.546000 Cu 0.0666687 0.577552 0.75 71 63.546 4.53487 -3.27732 63.546000 Cu 0.00191195 0.59123 0.5 72 63.546 0.0194692 -3.26977 63.546000 Cu 0.00191195 0.59123 2.68725e-16 76 63.546 0.0194692 -3.26977 63.546000 Cu 0.270835 0.550149 0.5 13 63.546 0.0164914 -3.28076 63.546000 Cu 0.270835 0.550149 1.16024e-16 17 63.546 0.0164914 -3.28076 63.546000 Cu 0.20549 0.563324 0.25 29 63.546 0.025843 -3.27158 63.546000 Cu 0.283007 0.576475 0.25 38 63.546 0.0131247 -3.27892 63.546000 Cu 0.283007 0.576475 0.75 39 63.546 0.0131247 -3.27892 63.546000 Cu 0.216611 0.589109 0.5 40 63.546 0.0285531 -3.27366 63.546000 Cu 0.20549 0.563324 0.75 42 63.546 0.025843 -3.27158 63.546000 Cu 0.216611 0.589109 1 44 63.546 0.0285531 -3.27366 63.546000 Cu 0.348587 0.56354 0.5 14 63.546 0.0128539 -3.276 63.546000 Cu 0.348587 0.56354 1.03611e-15 18 63.546 0.0128539 -3.276 63.546000 Cu 0.359616 0.590208 0.25 37 63.546 0.0083966 -3.27723 63.546000 Cu 0.359616 0.590208 0.75 46 63.546 0.0083966 -3.27723 63.546000 Cu 0.413229 0.550041 0.25 149 63.546 0.00940353 -3.27622 63.546000 Cu 0.425439 0.577135 0.5 153 63.546 0.0101155 -3.27624 63.546000 Cu 0.413229 0.550041 0.75 155 63.546 0.00940353 -3.27622 63.546000 Cu 0.425439 0.577135 2.52503e-16 156 63.546 0.0101155 -3.27624 63.546000 Cu 0.566669 0.577552 0.25 150 63.546 4.53487 -3.27732 63.546000 Cu 0.490263 0.563755 0.25 151 63.546 0.0201662 -3.26788 63.546000 Cu 0.490263 0.563755 0.75 152 63.546 0.0201662 -3.26788 63.546000 Cu 0.501912 0.59123 0.5 154 63.546 0.0194692 -3.26977 63.546000 Cu 0.566669 0.577552 0.75 162 63.546 4.53487 -3.27732 63.546000 Cu 0.501912 0.59123 6.89093e-16 163 63.546 0.0194692 -3.26977 63.546000 Cu 0.626284 0.55074 0.25 97 63.546 5.05189 -3.23702 63.546000 Cu 0.626284 0.55074 0.75 110 63.546 5.05189 -3.23702 63.546000 Cu 0.70549 0.563324 0.25 106 63.546 0.025843 -3.27158 63.546000 Cu 0.70549 0.563324 0.75 107 63.546 0.025843 -3.27158 63.546000 Cu 0.639154 0.575646 0.5 108 63.546 4.5274 -3.2201 63.546000 Cu 0.639154 0.575646 3.72054e-16 112 63.546 4.5274 -3.2201 63.546000 Cu 0.770835 0.550149 0.5 57 63.546 0.0164914 -3.28076 63.546000 Cu 0.770835 0.550149 3.03991e-16 67 63.546 0.0164914 -3.28076 63.546000 Cu 0.716611 0.589109 0.5 109 63.546 0.0285531 -3.27366 63.546000 Cu 0.716611 0.589109 1 119 63.546 0.0285531 -3.27366 63.546000 Cu 0.848587 0.56354 0.5 64 63.546 0.0128539 -3.276 63.546000 Cu 0.848587 0.56354 6.49242e-16 68 63.546 0.0128539 -3.276 63.546000 Cu 0.783007 0.576475 0.25 105 63.546 0.0131247 -3.27892 63.546000 Cu 0.783007 0.576475 0.75 118 63.546 0.0131247 -3.27892 63.546000 Cu 0.859616 0.590208 0.25 114 63.546 0.0083966 -3.27723 63.546000 Cu 0.859616 0.590208 0.75 115 63.546 0.0083966 -3.27723 63.546000 Cu 0.990263 0.563755 0.25 61 63.546 0.0201662 -3.26788 63.546000 Cu 0.913229 0.550041 0.25 62 63.546 0.00940353 -3.27622 63.546000 Cu 0.913229 0.550041 0.75 63 63.546 0.00940353 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63.546000 Cu 0.156475 0.626049 0.5 80 63.546 0.317168 -3.24579 63.546000 Cu 0.232833 0.641082 0.5 81 63.546 0.0161039 -3.27679 63.546000 Cu 0.156475 0.626049 1.02235e-15 84 63.546 0.317168 -3.24579 63.546000 Cu 0.232833 0.641082 1.25687e-15 90 63.546 0.0161039 -3.27679 63.546000 Cu 0.292959 0.602887 0.5 41 63.546 0.00969045 -3.27844 63.546000 Cu 0.292959 0.602887 5.06416e-16 47 63.546 0.00969045 -3.27844 63.546000 Cu 0.368921 0.616904 0.5 45 63.546 0.00551216 -3.27767 63.546000 Cu 0.368921 0.616904 2.60966e-17 48 63.546 0.00551216 -3.27767 63.546000 Cu 0.301303 0.629297 0.25 77 63.546 0.00719222 -3.27817 63.546000 Cu 0.376947 0.643602 0.25 85 63.546 0.00319485 -3.27776 63.546000 Cu 0.376947 0.643602 0.75 86 63.546 0.00319485 -3.27776 63.546000 Cu 0.301303 0.629297 0.75 89 63.546 0.00719222 -3.27817 63.546000 Cu 0.435798 0.604166 0.25 202 63.546 0.00765695 -3.27662 63.546000 Cu 0.435798 0.604166 0.75 203 63.546 0.00765695 -3.27662 63.546000 Cu 0.511468 0.618613 0.25 201 63.546 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0.693513 8.34387e-16 144 63.546 0.00453727 -3.27703 63.546000 Cu 0.308805 0.655701 0.5 87 63.546 0.00482224 -3.27796 63.546000 Cu 0.384357 0.670277 0.5 88 63.546 0.00174484 -3.27774 63.546000 Cu 0.308805 0.655701 4.88078e-16 91 63.546 0.00482224 -3.27796 63.546000 Cu 0.384357 0.670277 8.28392e-16 92 63.546 0.00174484 -3.27774 63.546000 Cu 0.391669 0.696926 0.25 137 63.546 0.00100111 -3.2782 63.546000 Cu 0.316058 0.682129 0.25 138 63.546 0.00322821 -3.27791 63.546000 Cu 0.316058 0.682129 0.75 139 63.546 0.00322821 -3.27791 63.546000 Cu 0.391669 0.696926 0.75 146 63.546 0.00100111 -3.2782 63.546000 Cu 0.452176 0.658126 0.25 253 63.546 0.00133077 -3.27732 63.546000 Cu 0.527288 0.673022 0.25 255 63.546 0.00194685 -3.2765 63.546000 Cu 0.527288 0.673022 0.75 256 63.546 0.00194685 -3.2765 63.546000 Cu 0.459671 0.685009 0.5 257 63.546 0.000785919 -3.27776 63.546000 Cu 0.452176 0.658126 0.75 259 63.546 0.00133077 -3.27732 63.546000 Cu 0.459671 0.685009 1.53759e-16 260 63.546 0.000785919 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