Number of particles = 900 A = 1 Angstrom (basic length-scale) H0(1,1) = 38.3596 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 76.8632 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61509 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 0.0249305 0.0413438 0 479 63.546 0.00125019 -3.5369 63.546000 Cu 0.0291647 0.00796688 0 482 63.546 0.0102031 -3.53761 63.546000 Cu 0.0958177 0.00821624 0 483 63.546 0.0105455 -3.53385 63.546000 Cu 0.0604271 0.024839 0.5 484 63.546 0.0029928 -3.53529 63.546000 Cu 0.0913056 0.0418973 6.94086e-17 504 63.546 0.00339088 -3.53477 63.546000 Cu 0.15734 0.0430081 0 505 63.546 0.0345105 -3.5355 63.546000 Cu 0.126759 0.0253481 0.5 506 63.546 0.0122178 -3.53151 63.546000 Cu 0.162285 0.00871602 1 508 63.546 0.0592937 -3.52572 63.546000 Cu 0.192477 0.0269803 0.5 510 63.546 0.0993085 -3.52922 63.546000 Cu 0.22761 0.0117985 8.94764e-17 509 63.546 0.256736 -3.50623 63.546000 Cu 0.222764 0.0462782 0 538 63.546 0.0545617 -3.53418 63.546000 Cu 0.288468 0.0522019 4.84186e-17 539 63.546 0.0963022 -3.51294 63.546000 Cu 0.257252 0.03212 0.5 540 63.546 0.0904973 -3.51273 63.546000 Cu 0.29275 0.0202786 6.53017e-17 542 63.546 0.52922 -3.46241 63.546000 Cu 0.328931 0.0063317 0.5 544 63.546 0.41173 -3.50252 63.546000 Cu 0.324196 0.0381739 0.5 545 63.546 0.137606 -3.52242 63.546000 Cu 0.360214 0.0229958 5.43119e-17 543 63.546 0.0281553 -3.53623 63.546000 Cu 0.395894 0.00714297 0.5 546 63.546 0.0140575 -3.53861 63.546000 Cu 0.355651 0.0553896 1 580 63.546 0.0253647 -3.53559 63.546000 Cu 0.39147 0.0398142 0.5 582 63.546 0.00712663 -3.53866 63.546000 Cu 0.427195 0.0237979 1 584 63.546 0.00371298 -3.539 63.546000 Cu 0.493907 0.0242743 5.48049e-17 585 63.546 0.00288379 -3.53769 63.546000 Cu 0.462584 0.0075101 0.5 586 63.546 0.0105479 -3.53867 63.546000 Cu 0.458326 0.0405902 0.5 587 63.546 0.00134098 -3.53825 63.546000 Cu 0.529242 0.00781119 0.5 588 63.546 0.0102118 -3.53752 63.546000 Cu 0.524943 0.0411632 0.5 632 63.546 0.00103793 -3.5369 63.546000 Cu 0.560459 0.0247067 7.65221e-17 634 63.546 0.00277505 -3.53539 63.546000 Cu 0.62678 0.0252829 4.59388e-17 635 63.546 0.0115958 -3.53167 63.546000 Cu 0.595872 0.00812206 0.5 636 63.546 0.010261 -3.53393 63.546000 Cu 0.591324 0.0417975 0.5 637 63.546 0.00326787 -3.5351 63.546000 Cu 0.662303 0.00866732 0.5 638 63.546 0.0581805 -3.5256 63.546000 Cu 0.657353 0.0429657 0.5 690 63.546 0.033448 -3.53565 63.546000 Cu 0.692487 0.0269471 1 692 63.546 0.0991325 -3.52915 63.546000 Cu 0.757249 0.0321161 2.21279e-16 693 63.546 0.0882058 -3.51274 63.546000 Cu 0.727592 0.011772 0.5 694 63.546 0.257292 -3.50601 63.546000 Cu 0.722771 0.0462577 0.5 695 63.546 0.054944 -3.5339 63.546000 Cu 0.788435 0.0522088 0.5 458 63.546 0.0922889 -3.51311 63.546000 Cu 0.828857 0.00636781 3.2055e-16 455 63.546 0.402082 -3.50261 63.546000 Cu 0.792715 0.0202593 0.5 456 63.546 0.510732 -3.46173 63.546000 Cu 0.824137 0.0382143 2.23116e-16 460 63.546 0.1342 -3.52266 63.546000 Cu 0.860137 0.0231001 0.5 462 63.546 0.0289319 -3.53643 63.546000 Cu 0.855569 0.0554832 0.5 463 63.546 0.0258475 -3.5355 63.546000 Cu 0.891398 0.039953 2.45034e-16 461 63.546 0.0075161 -3.53843 63.546000 Cu 0.895821 0.00730911 4.43755e-17 464 63.546 0.0149926 -3.53878 63.546000 Cu 0.962518 0.00770798 8.71183e-17 465 63.546 0.010994 -3.53878 63.546000 Cu 0.927152 0.0239823 0.5 466 63.546 0.00456472 -3.53891 63.546000 Cu 0.958303 0.0407798 1.11512e-16 478 63.546 0.00188815 -3.53831 63.546000 Cu 0.99388 0.0244643 0.5 480 63.546 0.00355656 -3.53781 63.546000 Cu 0.0153626 0.108039 1 497 63.546 0.000336245 -3.5383 63.546000 Cu 0.0201573 0.0747047 1.22455e-16 500 63.546 0.000488322 -3.53772 63.546000 Cu 0.0864942 0.0755521 1.70587e-16 501 63.546 0.00321133 -3.53697 63.546000 Cu 0.0557632 0.0583527 0.5 502 63.546 0.00103583 -3.53655 63.546000 Cu 0.0509681 0.0918281 0.5 503 63.546 0.000918395 -3.53762 63.546000 Cu 0.0817076 0.109124 1 530 63.546 0.00282587 -3.53835 63.546000 Cu 0.121964 0.0592434 0.5 507 63.546 0.0110876 -3.53625 63.546000 Cu 0.117162 0.093002 0.5 532 63.546 0.00861738 -3.5385 63.546000 Cu 0.152533 0.0770185 4.60456e-17 534 63.546 0.0203926 -3.53878 63.546000 Cu 0.218247 0.0801533 2.20918e-16 535 63.546 0.0182061 -3.53821 63.546000 Cu 0.187734 0.0613278 0.5 536 63.546 0.040202 -3.53817 63.546000 Cu 0.183099 0.0952424 0.5 537 63.546 0.0180714 -3.53999 63.546000 Cu 0.147828 0.110804 0 531 63.546 0.0117877 -3.54004 63.546000 Cu 0.253225 0.065701 0.5 541 63.546 0.0163855 -3.53167 63.546000 Cu 0.248946 0.0990239 0.5 574 63.546 0.00445302 -3.53638 63.546000 Cu 0.284233 0.0847511 0 576 63.546 0.0225186 -3.5299 63.546000 Cu 0.319837 0.0703883 0.5 578 63.546 0.048875 -3.52975 63.546000 Cu 0.315416 0.102933 0.5 579 63.546 0.0175244 -3.5344 63.546000 Cu 0.422622 0.0566947 0 581 63.546 0.00279003 -3.53859 63.546000 Cu 0.351097 0.0879561 1.14978e-17 577 63.546 0.0170327 -3.53649 63.546000 Cu 0.386864 0.0725225 0.5 583 63.546 0.00793715 -3.53829 63.546000 Cu 0.382201 0.105323 0.5 624 63.546 0.00693351 -3.53852 63.546000 Cu 0.417932 0.0896307 9.45092e-18 626 63.546 0.00326078 -3.5388 63.546000 Cu 0.453642 0.0736586 0.5 628 63.546 0.00119903 -3.53846 63.546000 Cu 0.448876 0.106755 0.5 629 63.546 0.00127137 -3.53885 63.546000 Cu 0.484554 0.0906941 1.22519e-16 627 63.546 0.000497493 -3.53841 63.546000 Cu 0.489312 0.0574799 0 630 63.546 0.000605819 -3.5378 63.546000 Cu 0.52019 0.0745032 0.5 633 63.546 0.000516968 -3.53783 63.546000 Cu 0.515375 0.107844 0.5 682 63.546 0.000335895 -3.53851 63.546000 Cu 0.550984 0.0916617 1.53517e-16 684 63.546 0.00108989 -3.53788 63.546000 Cu 0.555791 0.058198 0 631 63.546 0.00124022 -3.53684 63.546000 Cu 0.617177 0.0929351 3.14306e-17 685 63.546 0.0077298 -3.5385 63.546000 Cu 0.58653 0.0754421 0.5 686 63.546 0.00314604 -3.53726 63.546000 Cu 0.58169 0.109004 0.5 687 63.546 0.00273518 -3.53846 63.546000 Cu 0.621993 0.0591831 1.03883e-16 688 63.546 0.0101679 -3.53653 63.546000 Cu 0.652564 0.0769871 0.5 691 63.546 0.0189037 -3.53875 63.546000 Cu 0.647809 0.110758 0.5 744 63.546 0.0108954 -3.53992 63.546000 Cu 0.687756 0.0613026 1 689 63.546 0.0398612 -3.53817 63.546000 Cu 0.683101 0.0952193 4.92678e-17 746 63.546 0.0177282 -3.53981 63.546000 Cu 0.748935 0.099032 1 747 63.546 0.00416101 -3.53621 63.546000 Cu 0.718259 0.0801394 0.5 748 63.546 0.0188265 -3.53803 63.546000 Cu 0.753228 0.0657011 1.22309e-16 750 63.546 0.0160552 -3.5313 63.546000 Cu 0.784219 0.0847826 0.5 459 63.546 0.0216741 -3.52997 63.546000 Cu 0.819785 0.0704456 0 457 63.546 0.0488682 -3.5299 63.546000 Cu 0.815364 0.103017 1 470 63.546 0.0187316 -3.53474 63.546000 Cu 0.882152 0.10544 1 471 63.546 0.00632868 -3.53853 63.546000 Cu 0.851043 0.0880535 0.5 472 63.546 0.0173509 -3.53657 63.546000 Cu 0.886798 0.0726404 1 474 63.546 0.00769948 -3.53819 63.546000 Cu 0.922564 0.0568488 0.5 476 63.546 0.00289349 -3.53857 63.546000 Cu 0.953598 0.0738444 3.39086e-18 475 63.546 0.00149017 -3.5387 63.546000 Cu 0.917888 0.0897782 0.5 477 63.546 0.0031467 -3.5389 63.546000 Cu 0.989283 0.0576834 0.5 481 63.546 0.000862896 -3.53797 63.546000 Cu 0.948831 0.106939 3.58768e-17 496 63.546 0.00153364 -3.53894 63.546000 Cu 0.984521 0.0909052 0.5 498 63.546 0.000716441 -3.53844 63.546000 Cu 0.0770027 0.142604 1.22515e-16 527 63.546 0.0024188 -3.53916 63.546000 Cu 0.0461885 0.125251 0.5 528 63.546 0.000779387 -3.53834 63.546000 Cu 0.0415363 0.158623 0.5 529 63.546 0.000641384 -3.53924 63.546000 Cu 0.107865 0.160163 0.5 566 63.546 0.00370169 -3.54007 63.546000 Cu 0.0106253 0.141335 1 526 63.546 0.000187907 -3.53883 63.546000 Cu 0.112432 0.126643 0.5 533 63.546 0.00565383 -3.53939 63.546000 Cu 0.143194 0.144418 0 568 63.546 0.00693522 -3.54029 63.546000 Cu 0.209274 0.147192 1.04507e-16 569 63.546 0.00340757 -3.53978 63.546000 Cu 0.178481 0.12891 0.5 570 63.546 0.00891287 -3.54035 63.546000 Cu 0.174036 0.162422 0.5 571 63.546 0.00470221 -3.5402 63.546000 Cu 0.213757 0.113752 0 572 63.546 0.00721217 -3.53937 63.546000 Cu 0.279892 0.117595 3.40248e-17 573 63.546 0.00630322 -3.53532 63.546000 Cu 0.24454 0.132255 0.5 575 63.546 0.00167686 -3.53808 63.546000 Cu 0.2402 0.165474 0.5 616 63.546 0.000622813 -3.53869 63.546000 Cu 0.275501 0.150577 0 618 63.546 0.001726 -3.53758 63.546000 Cu 0.310945 0.135721 0.5 620 63.546 0.00679181 -3.537 63.546000 Cu 0.342008 0.153578 1 619 63.546 0.00594686 -3.53876 63.546000 Cu 0.346529 0.120686 2.81166e-20 622 63.546 0.00990743 -3.53765 63.546000 Cu 0.413204 0.122615 1.22736e-16 623 63.546 0.00295624 -3.5393 63.546000 Cu 0.377565 0.138243 0.5 625 63.546 0.00569033 -3.53923 63.546000 Cu 0.408592 0.15568 1 676 63.546 0.00267965 -3.53954 63.546000 Cu 0.444156 0.1399 0.5 678 63.546 0.00132795 -3.53935 63.546000 Cu 0.475075 0.157187 1.45007e-17 677 63.546 0.000435374 -3.53929 63.546000 Cu 0.47976 0.12393 1 680 63.546 0.000398239 -3.53908 63.546000 Cu 0.546168 0.125101 0 681 63.546 0.000805338 -3.53857 63.546000 Cu 0.510624 0.141178 0.5 683 63.546 0.000189161 -3.53911 63.546000 Cu 0.541478 0.158507 0 738 63.546 0.000485677 -3.53933 63.546000 Cu 0.607775 0.160069 9.01605e-18 739 63.546 0.00371739 -3.53997 63.546000 Cu 0.576949 0.142497 0.5 740 63.546 0.0022171 -3.53921 63.546000 Cu 0.61239 0.126562 5.1504e-17 742 63.546 0.00526864 -3.53943 63.546000 Cu 0.64315 0.144352 0.5 745 63.546 0.00687062 -3.54024 63.546000 Cu 0.67399 0.162356 1.10174e-16 792 63.546 0.00565924 -3.54014 63.546000 Cu 0.775474 0.150679 0.5 469 63.546 0.00234142 -3.53747 63.546000 Cu 0.67846 0.12887 0 743 63.546 0.00922888 -3.54025 63.546000 Cu 0.713739 0.113731 0.5 749 63.546 0.00799343 -3.53917 63.546000 Cu 0.740174 0.165517 4.88479e-18 793 63.546 0.000514082 -3.53854 63.546000 Cu 0.709267 0.147168 0.5 794 63.546 0.00404751 -3.53958 63.546000 Cu 0.744521 0.13228 1 796 63.546 0.00150007 -3.53782 63.546000 Cu 0.77985 0.117661 0.5 468 63.546 0.00675339 -3.53542 63.546000 Cu 0.810891 0.135839 1 467 63.546 0.00819768 -3.53715 63.546000 Cu 0.846464 0.120798 0.5 473 63.546 0.0100961 -3.5378 63.546000 Cu 0.841977 0.153712 0.5 490 63.546 0.00599614 -3.53875 63.546000 Cu 0.877518 0.138367 2.47117e-16 492 63.546 0.00501876 -3.53933 63.546000 Cu 0.944112 0.140074 9.31728e-17 493 63.546 0.0016671 -3.53939 63.546000 Cu 0.91315 0.122762 0.5 494 63.546 0.00283047 -3.5394 63.546000 Cu 0.908559 0.15584 0.5 495 63.546 0.00283863 -3.53972 63.546000 Cu 0.979725 0.124121 0.5 499 63.546 0.000575376 -3.53894 63.546000 Cu 0.975073 0.157351 0.5 524 63.546 0.000554225 -3.53914 63.546000 Cu 0.0678837 0.209378 0 561 63.546 0.00136855 -3.53953 63.546000 Cu 0.0370047 0.191971 0.5 562 63.546 0.000486717 -3.53951 63.546000 Cu 0.0724702 0.176027 1 564 63.546 0.00168506 -3.53972 63.546000 Cu 0.103371 0.193571 0.5 567 63.546 0.00279839 -3.54 63.546000 Cu 0.00605327 0.17463 1 523 63.546 6.92732e-05 -3.53944 63.546000 Cu 0.00145968 0.207937 1 560 63.546 2.83857e-05 -3.53937 63.546000 Cu 0.138755 0.177894 1.22665e-16 565 63.546 0.00445519 -3.54024 63.546000 Cu 0.134242 0.211252 0 610 63.546 0.00324712 -3.54017 63.546000 Cu 0.200531 0.213794 1 611 63.546 0.00168792 -3.53937 63.546000 Cu 0.169649 0.195787 0.5 612 63.546 0.00340018 -3.54002 63.546000 Cu 0.20494 0.180532 0 614 63.546 0.00195655 -3.53936 63.546000 Cu 0.271186 0.183664 1 615 63.546 0.000388168 -3.53831 63.546000 Cu 0.235864 0.198667 0.5 617 63.546 0.000472663 -3.53879 63.546000 Cu 0.306551 0.168682 0.5 621 63.546 0.00308431 -3.53835 63.546000 Cu 0.266789 0.216817 4.69078e-17 668 63.546 7.38569e-05 -3.53894 63.546000 Cu 0.333076 0.219749 1 669 63.546 0.00340685 -3.53964 63.546000 Cu 0.302143 0.201761 0.5 670 63.546 0.00177429 -3.5389 63.546000 Cu 0.337559 0.186605 1 672 63.546 0.00404057 -3.53914 63.546000 Cu 0.404007 0.188814 3.56949e-17 673 63.546 0.00243784 -3.53972 63.546000 Cu 0.373043 0.171255 0.5 674 63.546 0.00428032 -3.53953 63.546000 Cu 0.368513 0.204365 0.5 675 63.546 0.0032188 -3.53959 63.546000 Cu 0.439555 0.173067 0.5 679 63.546 0.00107365 -3.53962 63.546000 Cu 0.399448 0.222014 2.41465e-17 730 63.546 0.00222182 -3.5399 63.546000 Cu 0.434933 0.206297 0.5 732 63.546 0.0012163 -3.53971 63.546000 Cu 0.470454 0.19046 0 734 63.546 0.000493002 -3.53951 63.546000 Cu 0.536849 0.191874 1 735 63.546 0.000249444 -3.53934 63.546000 Cu 0.505982 0.174507 0.5 736 63.546 7.13627e-05 -3.53943 63.546000 Cu 0.501346 0.207821 0.5 737 63.546 9.15384e-05 -3.53936 63.546000 Cu 0.572339 0.175929 0.5 741 63.546 0.00147959 -3.53957 63.546000 Cu 0.567757 0.209279 0.5 786 63.546 0.00117892 -3.53959 63.546000 Cu 0.603194 0.193466 1 788 63.546 0.00296735 -3.53995 63.546000 Cu 0.638628 0.177798 0.5 790 63.546 0.00514667 -3.54018 63.546000 Cu 0.634133 0.211135 0.5 791 63.546 0.00417297 -3.54019 63.546000 Cu 0.669512 0.195695 0 789 63.546 0.00481191 -3.54004 63.546000 Cu 0.77113 0.183786 0.5 486 63.546 0.000872394 -3.53841 63.546000 Cu 0.766765 0.216938 0.5 487 63.546 0.000360074 -3.53885 63.546000 Cu 0.704862 0.180501 0.5 795 63.546 0.00263994 -3.53935 63.546000 Cu 0.700468 0.213748 0.5 832 63.546 0.00249853 -3.53925 63.546000 Cu 0.735778 0.198717 1 834 63.546 0.000346381 -3.53883 63.546000 Cu 0.802118 0.201916 1 485 63.546 0.00243772 -3.53913 63.546000 Cu 0.806524 0.168826 1 488 63.546 0.00408407 -3.53835 63.546000 Cu 0.873025 0.171405 2.51344e-17 489 63.546 0.00398703 -3.53969 63.546000 Cu 0.837549 0.186758 0.5 491 63.546 0.00401742 -3.53937 63.546000 Cu 0.833089 0.219919 0.5 516 63.546 0.00364872 -3.53983 63.546000 Cu 0.868535 0.204542 8.66853e-17 518 63.546 0.00345933 -3.53996 63.546000 Cu 0.899467 0.222203 0.5 521 63.546 0.00271927 -3.53995 63.546000 Cu 0.934999 0.206472 0 519 63.546 0.00155921 -3.53979 63.546000 Cu 0.904029 0.188994 0.5 520 63.546 0.00291309 -3.54002 63.546000 Cu 0.939561 0.173242 1.12579e-16 522 63.546 0.00146506 -3.53974 63.546000 Cu 0.970536 0.190611 0.5 525 63.546 0.00061153 -3.53963 63.546000 Cu 0.0323366 0.225281 0.5 563 63.546 0.000312079 -3.53945 63.546000 Cu 0.0587796 0.275911 1 603 63.546 0.00107379 -3.53971 63.546000 Cu 0.0277438 0.258577 0.5 604 63.546 0.000268664 -3.53933 63.546000 Cu 0.0632097 0.242668 1 606 63.546 0.00131653 -3.53969 63.546000 Cu 0.0987453 0.226877 0.5 608 63.546 0.00253485 -3.53987 63.546000 Cu 0.0941948 0.260111 0.5 609 63.546 0.00256951 -3.53981 63.546000 Cu 0.129647 0.244493 1 607 63.546 0.00330916 -3.53997 63.546000 Cu 0.165123 0.229057 0.5 613 63.546 0.00294525 -3.53986 63.546000 Cu 0.160662 0.262222 0.5 662 63.546 0.00362869 -3.53938 63.546000 Cu 0.196066 0.246981 1 664 63.546 0.00235134 -3.53923 63.546000 Cu 0.12527 0.277637 1 660 63.546 0.0039598 -3.53955 63.546000 Cu 0.231435 0.231863 0.5 666 63.546 0.000658574 -3.53906 63.546000 Cu 0.227098 0.265035 0.5 667 63.546 0.00135993 -3.53851 63.546000 Cu 0.262384 0.250027 1 665 63.546 0.000165068 -3.53906 63.546000 Cu 0.297718 0.23495 0.5 671 63.546 0.00151997 -3.53959 63.546000 Cu 0.293338 0.268233 0.5 724 63.546 0.00211612 -3.53934 63.546000 Cu 0.328629 0.253006 0 726 63.546 0.00347923 -3.54011 63.546000 Cu 0.394928 0.255307 7.25689e-17 727 63.546 0.00250863 -3.54025 63.546000 Cu 0.364025 0.237584 0.5 728 63.546 0.00305348 -3.54011 63.546000 Cu 0.359541 0.270939 0.5 729 63.546 0.00414483 -3.54025 63.546000 Cu 0.430398 0.239566 0.5 733 63.546 0.00135941 -3.53988 63.546000 Cu 0.425845 0.272908 0.5 778 63.546 0.00190631 -3.5399 63.546000 Cu 0.465882 0.22373 1 731 63.546 0.000513821 -3.53962 63.546000 Cu 0.461332 0.257019 1.14785e-16 780 63.546 0.000569239 -3.53974 63.546000 Cu 0.527807 0.258448 0 781 63.546 0.000138793 -3.53951 63.546000 Cu 0.496834 0.241116 0.5 782 63.546 0.000126181 -3.53945 63.546000 Cu 0.492298 0.274398 0.5 783 63.546 0.000208028 -3.53947 63.546000 Cu 0.53232 0.225178 1.09216e-16 784 63.546 0.000157321 -3.53958 63.546000 Cu 0.563306 0.242559 0.5 787 63.546 0.0009681 -3.53979 63.546000 Cu 0.558837 0.27577 0.5 824 63.546 0.000986523 -3.53967 63.546000 Cu 0.598757 0.226766 1 785 63.546 0.00261218 -3.53996 63.546000 Cu 0.594341 0.259987 9.21962e-17 826 63.546 0.00242562 -3.53983 63.546000 Cu 0.660836 0.262104 0 827 63.546 0.0054047 -3.53937 63.546000 Cu 0.62978 0.244367 0.5 828 63.546 0.00411686 -3.53987 63.546000 Cu 0.665152 0.228949 2.64802e-17 830 63.546 0.00456044 -3.53963 63.546000 Cu 0.625397 0.277497 0.5 829 63.546 0.00485805 -3.53951 63.546000 Cu 0.762488 0.250143 0.5 513 63.546 0.000310331 -3.53853 63.546000 Cu 0.731471 0.231911 1.22405e-16 831 63.546 0.000418369 -3.5386 63.546000 Cu 0.696192 0.246927 0.5 833 63.546 0.00325788 -3.53886 63.546000 Cu 0.727238 0.265076 1.41275e-16 863 63.546 0.000936646 -3.53808 63.546000 Cu 0.79346 0.268377 1.69545e-16 512 63.546 0.00233986 -3.53911 63.546000 Cu 0.797756 0.235107 1 514 63.546 0.00203507 -3.5393 63.546000 Cu 0.864052 0.237781 1 515 63.546 0.00363152 -3.5401 63.546000 Cu 0.828719 0.253189 0.5 517 63.546 0.00403648 -3.53993 63.546000 Cu 0.859658 0.271136 1 552 63.546 0.00491933 -3.54021 63.546000 Cu 0.894998 0.255502 0.5 554 63.546 0.00286932 -3.54002 63.546000 Cu 0.925938 0.273086 2.40809e-17 553 63.546 0.00184151 -3.53959 63.546000 Cu 0.930405 0.239748 1 556 63.546 0.00167648 -3.5396 63.546000 Cu 0.996798 0.241248 1.07941e-16 557 63.546 0.000167393 -3.5392 63.546000 Cu 0.965912 0.223881 0.5 558 63.546 0.000569831 -3.53944 63.546000 Cu 0.96136 0.25718 0.5 559 63.546 0.0005472 -3.53932 63.546000 Cu 0.992339 0.274551 1 602 63.546 0.000146638 -3.53928 63.546000 Cu 0.0233555 0.291849 0.5 605 63.546 0.000155577 -3.53944 63.546000 Cu 0.0190157 0.325098 0.5 654 63.546 0.00024238 -3.53923 63.546000 Cu 0.0544598 0.309123 1 656 63.546 0.000830174 -3.53963 63.546000 Cu 0.0898607 0.293284 0.5 658 63.546 0.00241933 -3.53984 63.546000 Cu 0.0856163 0.326382 0.5 659 63.546 0.00232031 -3.53958 63.546000 Cu 0.121054 0.310701 0 657 63.546 0.00485272 -3.53923 63.546000 Cu 0.191779 0.280084 1 661 63.546 0.00410434 -3.53851 63.546000 Cu 0.156425 0.295281 0.5 663 63.546 0.00571686 -3.53859 63.546000 Cu 0.152331 0.328206 0.5 716 63.546 0.0103755 -3.5377 63.546000 Cu 0.187678 0.313085 1 718 63.546 0.00864849 -3.53687 63.546000 Cu 0.218952 0.33122 0.5 721 63.546 0.0074319 -3.53513 63.546000 Cu 0.222949 0.298167 0.5 720 63.546 0.00298177 -3.53773 63.546000 Cu 0.254077 0.316529 1 719 63.546 0.00133104 -3.53758 63.546000 Cu 0.258149 0.283256 1 722 63.546 0.000477259 -3.53858 63.546000 Cu 0.324315 0.286384 0 723 63.546 0.00464988 -3.54006 63.546000 Cu 0.289162 0.301608 0.5 725 63.546 0.00361754 -3.53929 63.546000 Cu 0.320109 0.3199 0 772 63.546 0.00797671 -3.5398 63.546000 Cu 0.386199 0.322238 1 773 63.546 0.00478471 -3.53967 63.546000 Cu 0.355262 0.304415 0.5 774 63.546 0.00599755 -3.54014 63.546000 Cu 0.390513 0.288715 1 776 63.546 0.00340827 -3.53988 63.546000 Cu 0.421468 0.306323 0.5 779 63.546 0.00210846 -3.53946 63.546000 Cu 0.452459 0.323771 1 818 63.546 0.00130505 -3.53912 63.546000 Cu 0.45683 0.290357 5.76071e-17 777 63.546 0.000823963 -3.53941 63.546000 Cu 0.518926 0.324938 0 819 63.546 0.000294882 -3.5392 63.546000 Cu 0.487835 0.307702 0.5 820 63.546 0.000393326 -3.53929 63.546000 Cu 0.523291 0.291687 1.29938e-16 822 63.546 0.000283027 -3.53937 63.546000 Cu 0.554369 0.308949 0.5 825 63.546 0.00107708 -3.53955 63.546000 Cu 0.589869 0.293123 0 823 63.546 0.0027045 -3.53966 63.546000 Cu 0.585524 0.326196 1 855 63.546 0.0030554 -3.5394 63.546000 Cu 0.652248 0.328078 5.44075e-17 856 63.546 0.011767 -3.53792 63.546000 Cu 0.621018 0.310532 0.5 857 63.546 0.00625381 -3.5393 63.546000 Cu 0.656477 0.295156 1 859 63.546 0.00734749 -3.53876 63.546000 Cu 0.72297 0.298186 1 860 63.546 0.00245408 -3.5374 63.546000 Cu 0.6919 0.280033 0.5 861 63.546 0.00470374 -3.5384 63.546000 Cu 0.687654 0.313032 0.5 862 63.546 0.00856972 -3.53697 63.546000 Cu 0.758225 0.283353 0.5 864 63.546 0.000490333 -3.53825 63.546000 Cu 0.718873 0.33122 8.00198e-17 884 63.546 0.00659118 -3.53493 63.546000 Cu 0.754066 0.316591 0.5 885 63.546 0.0013262 -3.53749 63.546000 Cu 0.789195 0.301722 1 548 63.546 0.00380762 -3.53924 63.546000 Cu 0.855308 0.304594 0 549 63.546 0.00732935 -3.54039 63.546000 Cu 0.824395 0.286551 0.5 550 63.546 0.00530845 -3.5401 63.546000 Cu 0.820131 0.320046 0.5 551 63.546 0.00910162 -3.53991 63.546000 Cu 0.886236 0.322402 0.5 596 63.546 0.00552471 -3.53979 63.546000 Cu 0.890596 0.288898 0.5 555 63.546 0.00382055 -3.53992 63.546000 Cu 0.921546 0.306475 1.36722e-16 598 63.546 0.00191138 -3.53953 63.546000 Cu 0.98795 0.307853 4.53146e-17 599 63.546 0.000211711 -3.53935 63.546000 Cu 0.956919 0.290515 0.5 600 63.546 0.000619237 -3.53933 63.546000 Cu 0.952528 0.323895 0.5 601 63.546 0.000855883 -3.53913 63.546000 Cu 0.0501242 0.342268 0 653 63.546 0.000858384 -3.53928 63.546000 Cu 0.0146199 0.358312 0.5 655 63.546 0.000459703 -3.53893 63.546000 Cu 0.0457679 0.375355 6.15472e-17 710 63.546 0.00106203 -3.53894 63.546000 Cu 0.0813264 0.359391 0.5 712 63.546 0.00228238 -3.53912 63.546000 Cu 0.112629 0.37647 1 711 63.546 0.00685147 -3.5383 63.546000 Cu 0.116857 0.343652 1 714 63.546 0.00592013 -3.53894 63.546000 Cu 0.183673 0.345927 1 715 63.546 0.0203598 -3.53439 63.546000 Cu 0.148206 0.360982 0.5 717 63.546 0.0172926 -3.53658 63.546000 Cu 0.179711 0.378517 1 764 63.546 0.0523322 -3.52976 63.546000 Cu 0.215056 0.364125 0.5 766 63.546 0.0232149 -3.52918 63.546000 Cu 0.246307 0.383192 1.49179e-16 765 63.546 0.0161041 -3.5303 63.546000 Cu 0.250116 0.349826 1.06787e-17 768 63.546 0.00415085 -3.53568 63.546000 Cu 0.31598 0.353586 2.4632e-17 769 63.546 0.0161702 -3.53944 63.546000 Cu 0.285075 0.335075 0.5 770 63.546 0.00724839 -3.53858 63.546000 Cu 0.281059 0.368708 0.5 771 63.546 0.018204 -3.53752 63.546000 Cu 0.311831 0.38753 6.39859e-17 810 63.546 0.0374016 -3.53793 63.546000 Cu 0.351013 0.338027 0.5 775 63.546 0.00958549 -3.53978 63.546000 Cu 0.346803 0.37183 0.5 812 63.546 0.0172246 -3.53882 63.546000 Cu 0.381915 0.355884 8.1017e-17 814 63.546 0.00732154 -3.53888 63.546000 Cu 0.417154 0.339833 0.5 816 63.546 0.00289706 -3.53901 63.546000 Cu 0.412869 0.373416 0.5 817 63.546 0.00331842 -3.53793 63.546000 Cu 0.448153 0.357205 1 815 63.546 0.00136009 -3.53855 63.546000 Cu 0.483516 0.341031 0.5 821 63.546 0.000413242 -3.5389 63.546000 Cu 0.479222 0.374375 0.5 849 63.546 0.000608538 -3.53836 63.546000 Cu 0.514636 0.358174 1 851 63.546 0.000427084 -3.53893 63.546000 Cu 0.550062 0.342095 0.5 853 63.546 0.00109801 -3.53912 63.546000 Cu 0.545807 0.375198 0.5 854 63.546 0.00119357 -3.53888 63.546000 Cu 0.581304 0.359208 1 852 63.546 0.00316921 -3.53909 63.546000 Cu 0.616767 0.343478 0.5 858 63.546 0.00752522 -3.53901 63.546000 Cu 0.612638 0.376306 0.5 878 63.546 0.0083886 -3.53845 63.546000 Cu 0.64816 0.360858 4.55264e-17 880 63.546 0.0183843 -3.53673 63.546000 Cu 0.714994 0.364106 0 881 63.546 0.0228351 -3.52863 63.546000 Cu 0.683587 0.345865 0.5 882 63.546 0.0195573 -3.53421 63.546000 Cu 0.679667 0.378456 0.5 883 63.546 0.051025 -3.52954 63.546000 Cu 0.750054 0.349848 0.5 886 63.546 0.00420083 -3.53538 63.546000 Cu 0.746247 0.383214 0.5 899 63.546 0.0163802 -3.52967 63.546000 Cu 0.785047 0.335159 0 547 63.546 0.00733553 -3.53853 63.546000 Cu 0.780988 0.368778 6.77479e-17 590 63.546 0.0180424 -3.53705 63.546000 Cu 0.846708 0.371993 7.49776e-21 591 63.546 0.0199507 -3.53874 63.546000 Cu 0.815925 0.353716 0.5 592 63.546 0.0180363 -3.53939 63.546000 Cu 0.811742 0.387663 0.5 593 63.546 0.0399359 -3.53753 63.546000 Cu 0.850999 0.33819 1 594 63.546 0.0115657 -3.5399 63.546000 Cu 0.881862 0.356042 0.5 597 63.546 0.00835912 -3.53888 63.546000 Cu 0.917154 0.339964 1 595 63.546 0.00259903 -3.53895 63.546000 Cu 0.912763 0.373555 1 648 63.546 0.00345827 -3.53779 63.546000 Cu 0.979143 0.374491 0 649 63.546 0.000574548 -3.5383 63.546000 Cu 0.948104 0.357321 0.5 650 63.546 0.00114951 -3.53845 63.546000 Cu 0.983535 0.341164 0 652 63.546 0.00041259 -3.5389 63.546000 Cu 0.0414347 0.40842 9.03817e-17 707 63.546 0.00121291 -3.53857 63.546000 Cu 0.0770174 0.392317 0.5 713 63.546 0.00224327 -3.53893 63.546000 Cu 0.0374158 0.441477 1.19964e-19 756 63.546 0.00896152 -3.53869 63.546000 Cu 0.0727242 0.425197 0.5 758 63.546 0.00311262 -3.53897 63.546000 Cu 0.108375 0.409177 0 760 63.546 0.00635119 -3.53873 63.546000 Cu 0.010247 0.391523 0.5 708 63.546 0.000659581 -3.53832 63.546000 Cu 0.00596874 0.424731 0.5 709 63.546 0.0025644 -3.53794 63.546000 Cu 0.104125 0.441829 1 757 63.546 0.0121937 -3.53844 63.546000 Cu 0.175692 0.410772 1 761 63.546 0.138416 -3.52266 63.546000 Cu 0.144073 0.393557 0.5 762 63.546 0.0263978 -3.53575 63.546000 Cu 0.139783 0.425954 0.5 763 63.546 0.0294619 -3.53606 63.546000 Cu 0.211277 0.396721 0.5 767 63.546 0.0950209 -3.51282 63.546000 Cu 0.207249 0.428692 0.5 804 63.546 0.507628 -3.46305 63.546000 Cu 0.171166 0.442613 1 802 63.546 0.407195 -3.50277 63.546000 Cu 0.242646 0.416789 0 806 63.546 0.0875834 -3.51234 63.546000 Cu 0.307469 0.421889 1.22585e-16 807 63.546 0.0941409 -3.52912 63.546000 Cu 0.277012 0.402617 0.5 808 63.546 0.0547652 -3.53341 63.546000 Cu 0.272436 0.437093 0.5 809 63.546 0.25505 -3.50595 63.546000 Cu 0.37763 0.389658 1 811 63.546 0.00951967 -3.53693 63.546000 Cu 0.342465 0.405867 0.5 813 63.546 0.0307884 -3.53563 63.546000 Cu 0.337753 0.440176 0.5 841 63.546 0.0545951 -3.52575 63.546000 Cu 0.373164 0.423575 1.83785e-16 843 63.546 0.0108135 -3.53203 63.546000 Cu 0.439485 0.424205 4.35339e-17 844 63.546 0.00256558 -3.5359 63.546000 Cu 0.408492 0.40708 0.5 845 63.546 0.00327804 -3.53561 63.546000 Cu 0.404183 0.440775 0.5 846 63.546 0.00897534 -3.53428 63.546000 Cu 0.443844 0.390688 6.65876e-17 847 63.546 0.0014235 -3.53734 63.546000 Cu 0.510324 0.391397 4.03717e-17 848 63.546 0.000634277 -3.53827 63.546000 Cu 0.474876 0.407733 0.5 850 63.546 0.000901324 -3.53734 63.546000 Cu 0.470818 0.441102 0.5 870 63.546 0.00866513 -3.5377 63.546000 Cu 0.506045 0.424611 0 872 63.546 0.00233525 -3.53767 63.546000 Cu 0.541501 0.408267 0.5 874 63.546 0.00123506 -3.53834 63.546000 Cu 0.537458 0.441338 0.5 875 63.546 0.00913573 -3.5385 63.546000 Cu 0.572745 0.425034 1.54591e-16 873 63.546 0.00384408 -3.53908 63.546000 Cu 0.577074 0.392141 0 876 63.546 0.00303533 -3.53891 63.546000 Cu 0.644077 0.393447 1.39702e-17 877 63.546 0.0268521 -3.53595 63.546000 Cu 0.608395 0.409021 0.5 879 63.546 0.00783459 -3.53906 63.546000 Cu 0.639755 0.42586 0 894 63.546 0.0294165 -3.53632 63.546000 Cu 0.604135 0.441692 0.5 892 63.546 0.0130924 -3.53873 63.546000 Cu 0.675649 0.410724 0.5 896 63.546 0.13669 -3.52235 63.546000 Cu 0.776917 0.402691 1 589 63.546 0.0541111 -3.53253 63.546000 Cu 0.77234 0.4372 3.0947e-18 640 63.546 0.254556 -3.50578 63.546000 Cu 0.707187 0.428656 2.31999e-17 895 63.546 0.535912 -3.46056 63.546000 Cu 0.711226 0.396694 1 898 63.546 0.0978996 -3.51187 63.546000 Cu 0.742611 0.416842 0.5 900 63.546 0.0935508 -3.51087 63.546000 Cu 0.671094 0.442553 0.5 897 63.546 0.42131 -3.50273 63.546000 Cu 0.877518 0.389834 0.5 646 63.546 0.0114895 -3.53681 63.546000 Cu 0.83767 0.440364 2.3966e-16 641 63.546 0.0583662 -3.52598 63.546000 Cu 0.807363 0.422041 0.5 642 63.546 0.0978907 -3.52852 63.546000 Cu 0.84234 0.406045 0 644 63.546 0.034924 -3.53554 63.546000 Cu 0.87305 0.42376 0.5 647 63.546 0.0125193 -3.53203 63.546000 Cu 0.908381 0.407227 1.12466e-19 645 63.546 0.00338008 -3.53545 63.546000 Cu 0.943746 0.390797 0.5 651 63.546 0.00111054 -3.5372 63.546000 Cu 0.904102 0.440946 1 702 63.546 0.00954257 -3.53426 63.546000 Cu 0.970757 0.441201 8.6243e-17 703 63.546 0.00838807 -3.53792 63.546000 Cu 0.939374 0.424318 0.5 704 63.546 0.00282522 -3.53585 63.546000 Cu 0.974786 0.407841 1 706 63.546 0.000897749 -3.5373 63.546000 Cu 0.0355249 0.474602 2.09862e-17 753 63.546 0.0278286 -3.54033 63.546000 Cu 0.0692667 0.45812 0.5 759 63.546 0.0241551 -3.53866 63.546000 Cu 0.0692422 0.491113 0.5 797 63.546 0.0285495 -3.53838 63.546000 Cu 0.102 0.4746 1 798 63.546 0.0319953 -3.54084 63.546000 Cu 0.00272212 0.457967 0.5 754 63.546 0.0202059 -3.53967 63.546000 Cu 0.00275929 0.491216 0.5 755 63.546 0.022292 -3.53925 63.546000 Cu 0.168535 0.474537 1 799 63.546 3.24728 -3.46712 63.546000 Cu 0.135595 0.458314 0.5 800 63.546 0.0531598 -3.53392 63.546000 Cu 0.135485 0.490818 0.5 801 63.546 0.0628538 -3.53354 63.546000 Cu 0.201593 0.45949 0.5 805 63.546 5.59455 -3.26086 63.546000 Cu 0.201361 0.489588 0.5 835 63.546 5.66372 -3.25633 63.546000 Cu 0.238868 0.497572 1 836 63.546 5.67576 -3.4081 63.546000 Cu 0.238869 0.451202 1 803 63.546 5.72538 -3.40774 63.546000 Cu 0.302338 0.491715 2.21291e-16 837 63.546 0.337486 -3.49614 63.546000 Cu 0.26441 0.474432 0.5 838 63.546 4.51783 -3.52068 63.546000 Cu 0.302285 0.457038 2.29994e-17 839 63.546 0.342088 -3.49565 63.546000 Cu 0.334107 0.474349 0.5 842 63.546 0.149843 -3.51959 63.546000 Cu 0.369014 0.457502 3.55337e-17 840 63.546 0.0365168 -3.53114 63.546000 Cu 0.36909 0.491221 0 865 63.546 0.0365281 -3.53115 63.546000 Cu 0.436067 0.491148 1.48287e-17 866 63.546 0.0234885 -3.53836 63.546000 Cu 0.401792 0.474382 0.5 867 63.546 0.0495672 -3.53979 63.546000 Cu 0.435985 0.457705 5.1727e-17 868 63.546 0.024166 -3.53883 63.546000 Cu 0.502759 0.457844 2.62253e-17 869 63.546 0.0212137 -3.53952 63.546000 Cu 0.468885 0.474455 0.5 871 63.546 0.0304097 -3.54078 63.546000 Cu 0.502828 0.491096 4.75208e-17 887 63.546 0.0213467 -3.53937 63.546000 Cu 0.535581 0.474469 0.5 889 63.546 0.0279805 -3.54042 63.546000 Cu 0.569346 0.49097 1.89894e-16 888 63.546 0.0266701 -3.53867 63.546000 Cu 0.635651 0.490743 5.61713e-17 453 63.546 0.0567878 -3.53337 63.546000 Cu 0.569293 0.457973 7.08557e-17 890 63.546 0.0254045 -3.53861 63.546000 Cu 0.635542 0.458237 1.223e-16 891 63.546 0.0581146 -3.53399 63.546000 Cu 0.602066 0.474483 0.5 893 63.546 0.0319963 -3.54094 63.546000 Cu 0.668592 0.474503 0.5 410 63.546 3.26646 -3.46709 63.546000 Cu 0.738958 0.497686 0.5 31 63.546 5.68716 -3.40915 63.546000 Cu 0.738874 0.451351 0.5 183 63.546 5.70806 -3.40655 63.546000 Cu 0.701482 0.45943 7.00197e-17 408 63.546 5.64343 -3.25786 63.546000 Cu 0.70154 0.489521 1.30461e-18 451 63.546 5.62117 -3.25958 63.546000 Cu 0.764445 0.474512 8.15756e-18 639 63.546 4.51097 -3.52105 63.546000 Cu 0.802289 0.457189 0.5 643 63.546 0.338055 -3.49565 63.546000 Cu 0.802383 0.491868 0.5 697 63.546 0.339389 -3.49575 63.546000 Cu 0.834123 0.47454 7.55137e-17 698 63.546 0.14741 -3.51962 63.546000 Cu 0.868992 0.457695 0.5 700 63.546 0.0355432 -3.53115 63.546000 Cu 0.869082 0.491429 0.5 701 63.546 0.0363001 -3.53106 63.546000 Cu 0.901769 0.474563 0 699 63.546 0.0487086 -3.53979 63.546000 Cu 0.935946 0.457826 0.5 705 63.546 0.0227091 -3.53868 63.546000 Cu 0.93601 0.491281 0.5 751 63.546 0.0248784 -3.53844 63.546000 Cu 0.968823 0.474564 7.80929e-17 752 63.546 0.0310548 -3.54082 63.546000 Cu 0.0375083 0.50774 1.49955e-20 3 63.546 0.0109121 -3.53808 63.546000 Cu 0.0729266 0.524048 0.5 7 63.546 0.00466452 -3.53845 63.546000 Cu 0.00623979 0.524462 0.5 16 63.546 0.00309264 -3.53725 63.546000 Cu 0.0418395 0.540802 0 18 63.546 0.0016555 -3.5379 63.546000 Cu 0.104145 0.507397 1 4 63.546 0.0165393 -3.53839 63.546000 Cu 0.108735 0.540037 1 5 63.546 0.00883089 -3.53859 63.546000 Cu 0.171105 0.506455 1 1 63.546 0.422503 -3.50209 63.546000 Cu 0.207368 0.520326 0.5 2 63.546 0.547131 -3.45998 63.546000 Cu 0.139916 0.523177 0.5 6 63.546 0.0296101 -3.53611 63.546000 Cu 0.176004 0.538274 2.9991e-20 8 63.546 0.139374 -3.52204 63.546000 Cu 0.144607 0.555547 0.5 11 63.546 0.0267647 -3.53548 63.546000 Cu 0.211758 0.552233 0.5 10 63.546 0.0986953 -3.51209 63.546000 Cu 0.242899 0.532064 1 184 63.546 0.093487 -3.5116 63.546000 Cu 0.272452 0.511672 0.5 185 63.546 0.261205 -3.50686 63.546000 Cu 0.307657 0.526804 0 186 63.546 0.103797 -3.52932 63.546000 Cu 0.277379 0.546159 0.5 189 63.546 0.0566575 -3.53347 63.546000 Cu 0.373385 0.525134 1 133 63.546 0.0126592 -3.53176 63.546000 Cu 0.40431 0.507985 0.5 134 63.546 0.0100668 -3.53386 63.546000 Cu 0.337832 0.508526 0.5 135 63.546 0.059266 -3.52605 63.546000 Cu 0.408813 0.541681 0.5 139 63.546 0.00382024 -3.53487 63.546000 Cu 0.34278 0.542798 0.5 188 63.546 0.0374757 -3.53555 63.546000 Cu 0.439707 0.524651 0 136 63.546 0.00272346 -3.53519 63.546000 Cu 0.50627 0.524333 7.19935e-17 91 63.546 0.0029301 -3.53751 63.546000 Cu 0.537587 0.507603 0.5 92 63.546 0.0100883 -3.53841 63.546000 Cu 0.470943 0.507809 0.5 93 63.546 0.00933147 -3.53729 63.546000 Cu 0.541846 0.540661 0.5 97 63.546 0.00155484 -3.53828 63.546000 Cu 0.475194 0.541167 0.5 138 63.546 0.00119755 -3.53677 63.546000 Cu 0.639982 0.523103 1.59562e-16 57 63.546 0.0299631 -3.53609 63.546000 Cu 0.604277 0.507271 0.5 59 63.546 0.0140438 -3.5383 63.546000 Cu 0.573001 0.523895 0 94 63.546 0.0035801 -3.53851 63.546000 Cu 0.608766 0.539917 0.5 96 63.546 0.00764389 -3.5383 63.546000 Cu 0.644583 0.555488 9.74483e-17 98 63.546 0.0277701 -3.53553 63.546000 Cu 0.671253 0.506409 0.5 58 63.546 0.413298 -3.50261 63.546000 Cu 0.707457 0.520319 2.64603e-16 60 63.546 0.529791 -3.46234 63.546000 Cu 0.711722 0.552231 7.84959e-17 61 63.546 0.0940819 -3.51223 63.546000 Cu 0.74294 0.532117 0.5 62 63.546 0.0933016 -3.51195 63.546000 Cu 0.676031 0.538249 0.5 63 63.546 0.14115 -3.52244 63.546000 Cu 0.772571 0.511798 6.9523e-17 696 63.546 0.261666 -3.50673 63.546000 Cu 0.777403 0.546268 1 64 63.546 0.0573825 -3.53419 63.546000 Cu 0.837879 0.508738 0 32 63.546 0.0553884 -3.52562 63.546000 Cu 0.842817 0.543025 1 33 63.546 0.0323305 -3.53565 63.546000 Cu 0.873398 0.525353 0.5 34 63.546 0.0110189 -3.53169 63.546000 Cu 0.807709 0.526993 0.5 35 63.546 0.097787 -3.52925 63.546000 Cu 0.904306 0.50818 0 13 63.546 0.00961472 -3.53389 63.546000 Cu 0.970914 0.507922 1 14 63.546 0.00934364 -3.5372 63.546000 Cu 0.975219 0.541294 0 15 63.546 0.00121023 -3.53668 63.546000 Cu 0.939703 0.52478 0.5 17 63.546 0.00301186 -3.53538 63.546000 Cu 0.908845 0.541864 0 36 63.546 0.00363469 -3.53512 63.546000 Cu 0.0776015 0.556917 0.5 20 63.546 0.00368976 -3.53858 63.546000 Cu 0.0465889 0.57385 1.07741e-16 19 63.546 0.001424 -3.53836 63.546000 Cu 0.0108774 0.557659 0.5 21 63.546 0.000756505 -3.53755 63.546000 Cu 0.0823344 0.589836 0.5 25 63.546 0.00424291 -3.53882 63.546000 Cu 0.0156923 0.590858 0.5 42 63.546 0.000527706 -3.53826 63.546000 Cu 0.0513672 0.606935 0 44 63.546 0.00150937 -3.53872 63.546000 Cu 0.180422 0.570481 3.8411e-17 9 63.546 0.0493346 -3.52949 63.546000 Cu 0.113418 0.572721 1.22354e-16 22 63.546 0.00963396 -3.53836 63.546000 Cu 0.118044 0.605516 2.36091e-16 23 63.546 0.00831896 -3.5386 63.546000 Cu 0.149177 0.5881 0.5 24 63.546 0.017561 -3.53643 63.546000 Cu 0.184787 0.603044 3.16263e-16 26 63.546 0.0182759 -3.53432 63.546000 Cu 0.215967 0.584797 0.5 12 63.546 0.0233159 -3.52934 63.546000 Cu 0.312366 0.561161 0 187 63.546 0.0435619 -3.53779 63.546000 Cu 0.246958 0.565678 0 241 63.546 0.0163579 -3.53068 63.546000 Cu 0.251175 0.599026 4.47822e-17 242 63.546 0.00413286 -3.53579 63.546000 Cu 0.281868 0.580065 0.5 243 63.546 0.0185838 -3.53728 63.546000 Cu 0.316967 0.595082 1.51867e-17 244 63.546 0.0207254 -3.53963 63.546000 Cu 0.37812 0.55903 6.56785e-17 190 63.546 0.0121684 -3.53638 63.546000 Cu 0.382883 0.592785 9.89423e-17 191 63.546 0.00945332 -3.53854 63.546000 Cu 0.413551 0.575323 0.5 192 63.546 0.00403551 -3.53705 63.546000 Cu 0.347519 0.576818 0.5 193 63.546 0.0226826 -3.53859 63.546000 Cu 0.418361 0.608892 0.5 197 63.546 0.00332552 -3.53848 63.546000 Cu 0.444331 0.558158 0 137 63.546 0.00112548 -3.53649 63.546000 Cu 0.352226 0.610591 0.5 246 63.546 0.0142829 -3.54005 63.546000 Cu 0.510837 0.557533 3.71139e-19 140 63.546 0.00078846 -3.53779 63.546000 Cu 0.515583 0.590739 1 141 63.546 0.000636509 -3.53829 63.546000 Cu 0.479916 0.574507 0.5 143 63.546 0.000539964 -3.53766 63.546000 Cu 0.449109 0.591617 1 194 63.546 0.00100786 -3.53771 63.546000 Cu 0.484745 0.607838 0.5 196 63.546 0.000312283 -3.53827 63.546000 Cu 0.546509 0.573717 0.5 142 63.546 0.00140636 -3.53856 63.546000 Cu 0.551282 0.60681 0.5 147 63.546 0.0014638 -3.53879 63.546000 Cu 0.577565 0.556761 2.53908e-16 95 63.546 0.00263518 -3.53853 63.546000 Cu 0.649082 0.588048 1.22525e-16 99 63.546 0.0185891 -3.53646 63.546000 Cu 0.613326 0.572603 0.5 101 63.546 0.00816076 -3.53806 63.546000 Cu 0.58223 0.58968 1 144 63.546 0.00281341 -3.53873 63.546000 Cu 0.617949 0.605402 0.5 146 63.546 0.00700954 -3.53836 63.546000 Cu 0.746905 0.565708 0.5 67 63.546 0.0165235 -3.53124 63.546000 Cu 0.680351 0.570477 0.5 100 63.546 0.0528387 -3.52979 63.546000 Cu 0.715918 0.584809 1 102 63.546 0.0229455 -3.52965 63.546000 Cu 0.751198 0.599038 0.5 104 63.546 0.00468046 -3.53638 63.546000 Cu 0.68475 0.603036 0.5 105 63.546 0.0206219 -3.53449 63.546000 Cu 0.781867 0.580153 2.34699e-17 65 63.546 0.0197078 -3.53823 63.546000 Cu 0.81238 0.561347 0.5 66 63.546 0.0388689 -3.5383 63.546000 Cu 0.847573 0.57703 1.76085e-17 68 63.546 0.0187675 -3.53886 63.546000 Cu 0.817042 0.595248 0.5 71 63.546 0.0174541 -3.54008 63.546000 Cu 0.878178 0.559247 0.5 39 63.546 0.00998437 -3.53663 63.546000 Cu 0.882991 0.59298 0.5 70 63.546 0.00792947 -3.53859 63.546000 Cu 0.852339 0.610788 1.46302e-16 69 63.546 0.0111261 -3.53993 63.546000 Cu 0.913643 0.575497 0 37 63.546 0.00372416 -3.53733 63.546000 Cu 0.944389 0.558285 0.5 38 63.546 0.00149546 -3.53668 63.546000 Cu 0.980008 0.574632 1 40 63.546 0.000535866 -3.53766 63.546000 Cu 0.984828 0.607956 0 41 63.546 0.000381296 -3.53839 63.546000 Cu 0.949215 0.591742 0.5 43 63.546 0.00132445 -3.53792 63.546000 Cu 0.918473 0.60905 1 72 63.546 0.00322736 -3.53853 63.546000 Cu 0.0559854 0.640066 0 45 63.546 0.00152462 -3.53921 63.546000 Cu 0.0869836 0.622813 0.5 46 63.546 0.00389358 -3.53921 63.546000 Cu 0.0204176 0.624067 0.5 47 63.546 0.000434863 -3.53885 63.546000 Cu 0.0914987 0.655881 0.5 51 63.546 0.00365759 -3.53951 63.546000 Cu 0.0250085 0.657311 0.5 78 63.546 0.000398939 -3.53918 63.546000 Cu 0.189158 0.635863 1.98205e-16 27 63.546 0.00779202 -3.53696 63.546000 Cu 0.153651 0.620846 0.5 29 63.546 0.010513 -3.53768 63.546000 Cu 0.122561 0.638436 1.02239e-16 48 63.546 0.00674116 -3.5391 63.546000 Cu 0.158053 0.65375 0.5 50 63.546 0.0062599 -3.53871 63.546000 Cu 0.220232 0.617673 0.5 28 63.546 0.00702816 -3.53526 63.546000 Cu 0.224534 0.650683 0.5 30 63.546 0.00241183 -3.53749 63.546000 Cu 0.321561 0.628744 1.63164e-16 245 63.546 0.0110643 -3.54015 63.546000 Cu 0.286314 0.61368 0.5 247 63.546 0.00714362 -3.53888 63.546000 Cu 0.255531 0.632284 6.82408e-17 295 63.546 0.00135633 -3.53771 63.546000 Cu 0.259818 0.665498 9.05485e-17 296 63.546 0.000427795 -3.53809 63.546000 Cu 0.290765 0.647104 0.5 297 63.546 0.00384143 -3.53916 63.546000 Cu 0.325967 0.66222 0 298 63.546 0.0073574 -3.53994 63.546000 Cu 0.387632 0.626408 7.84584e-17 248 63.546 0.00675398 -3.53952 63.546000 Cu 0.392145 0.659922 1 249 63.546 0.00471005 -3.53998 63.546000 Cu 0.423052 0.642379 0.5 250 63.546 0.00273249 -3.53917 63.546000 Cu 0.356862 0.644186 0.5 251 63.546 0.0094093 -3.54031 63.546000 Cu 0.453897 0.625031 1 195 63.546 0.000959247 -3.53852 63.546000 Cu 0.52035 0.623956 1.45537e-16 198 63.546 0.00061028 -3.53885 63.546000 Cu 0.524908 0.657187 5.07711e-17 199 63.546 0.000480717 -3.53922 63.546000 Cu 0.489406 0.641154 0.5 201 63.546 0.00026685 -3.53886 63.546000 Cu 0.458455 0.65843 0 252 63.546 0.000601779 -3.53919 63.546000 Cu 0.586937 0.622668 1.27799e-17 145 63.546 0.00278785 -3.53919 63.546000 Cu 0.653646 0.620782 1 148 63.546 0.011165 -3.53762 63.546000 Cu 0.622551 0.638307 0.5 151 63.546 0.00541816 -3.53917 63.546000 Cu 0.555928 0.639939 0.5 200 63.546 0.00153979 -3.53938 63.546000 Cu 0.591469 0.655732 3.74888e-21 202 63.546 0.00275932 -3.53988 63.546000 Cu 0.658093 0.653668 1 149 63.546 0.00647007 -3.53876 63.546000 Cu 0.720295 0.617659 0 103 63.546 0.00680451 -3.53529 63.546000 Cu 0.755611 0.632289 0.5 109 63.546 0.00164286 -3.53795 63.546000 Cu 0.689218 0.635828 0.5 150 63.546 0.00887638 -3.53693 63.546000 Cu 0.724628 0.650664 0 152 63.546 0.0023772 -3.53749 63.546000 Cu 0.75989 0.665524 0.5 154 63.546 0.00070524 -3.53849 63.546000 Cu 0.786405 0.613756 2.00546e-17 106 63.546 0.00758225 -3.53937 63.546000 Cu 0.790858 0.647192 0 107 63.546 0.00380039 -3.53954 63.546000 Cu 0.821646 0.628898 0.5 108 63.546 0.00872548 -3.54014 63.546000 Cu 0.856945 0.644366 1 110 63.546 0.00745076 -3.54025 63.546000 Cu 0.826066 0.662391 0.5 113 63.546 0.00507225 -3.5401 63.546000 Cu 0.887737 0.626584 0.5 75 63.546 0.00587609 -3.53946 63.546000 Cu 0.989511 0.641274 1.46204e-16 76 63.546 0.000229927 -3.53888 63.546000 Cu 0.923158 0.64253 1.52523e-17 73 63.546 0.00260722 -3.53927 63.546000 Cu 0.953996 0.625164 0.5 74 63.546 0.00101455 -3.53865 63.546000 Cu 0.958587 0.658558 0.5 79 63.546 0.000674138 -3.53916 63.546000 Cu 0.892276 0.660082 0.5 112 63.546 0.00450739 -3.53998 63.546000 Cu 0.0604558 0.673247 1.555e-16 80 63.546 0.00150739 -3.5397 63.546000 Cu 0.0648014 0.706482 3.86097e-17 81 63.546 0.00160604 -3.53989 63.546000 Cu 0.095901 0.68903 0.5 82 63.546 0.00347423 -3.53981 63.546000 Cu 0.0294186 0.690591 0.5 83 63.546 0.000586058 -3.53967 63.546000 Cu 0.12698 0.671467 0 49 63.546 0.00535151 -3.53964 63.546000 Cu 0.19349 0.668841 9.09703e-17 52 63.546 0.00398551 -3.53844 63.546000 Cu 0.197695 0.701943 0 53 63.546 0.00267737 -3.53895 63.546000 Cu 0.162404 0.6868 0.5 55 63.546 0.00462773 -3.53943 63.546000 Cu 0.131285 0.704586 1 84 63.546 0.00399911 -3.53986 63.546000 Cu 0.166564 0.719973 0.5 86 63.546 0.00432421 -3.53984 63.546000 Cu 0.228804 0.683784 0.5 54 63.546 0.00109558 -3.53792 63.546000 Cu 0.232874 0.716951 0.5 56 63.546 0.000413428 -3.53834 63.546000 Cu 0.295013 0.680429 0.5 301 63.546 0.00283332 -3.53879 63.546000 Cu 0.263989 0.698701 0 341 63.546 0.000275864 -3.53806 63.546000 Cu 0.299164 0.713704 0.5 343 63.546 0.00238206 -3.53891 63.546000 Cu 0.330202 0.695607 0 299 63.546 0.0050924 -3.53984 63.546000 Cu 0.427437 0.675808 0.5 255 63.546 0.00194892 -3.5397 63.546000 Cu 0.361164 0.677658 0.5 300 63.546 0.00634762 -3.54019 63.546000 Cu 0.396455 0.693339 3.53257e-17 302 63.546 0.00355081 -3.54011 63.546000 Cu 0.431865 0.709151 0.5 304 63.546 0.00163206 -3.5398 63.546000 Cu 0.365466 0.711025 0.5 305 63.546 0.00475451 -3.54028 63.546000 Cu 0.462852 0.691772 1 253 63.546 0.000413874 -3.53951 63.546000 Cu 0.493872 0.674457 0.5 254 63.546 7.85225e-05 -3.53946 63.546000 Cu 0.529352 0.690435 1 256 63.546 0.000384515 -3.53965 63.546000 Cu 0.49834 0.707747 0.5 259 63.546 0.000132037 -3.53939 63.546000 Cu 0.595867 0.688884 0 203 63.546 0.00310372 -3.54003 63.546000 Cu 0.62696 0.671329 0.5 204 63.546 0.00434337 -3.53984 63.546000 Cu 0.560394 0.673101 0.5 205 63.546 0.00127672 -3.53988 63.546000 Cu 0.631234 0.704464 0.5 209 63.546 0.00376659 -3.53973 63.546000 Cu 0.564803 0.706331 0.5 258 63.546 0.00153133 -3.53993 63.546000 Cu 0.600131 0.722123 0 260 63.546 0.00339366 -3.5401 63.546000 Cu 0.662346 0.686699 0 206 63.546 0.00417745 -3.53911 63.546000 Cu 0.666486 0.71986 1 207 63.546 0.00337787 -3.53932 63.546000 Cu 0.728774 0.683761 0 153 63.546 0.000749054 -3.53811 63.546000 Cu 0.693519 0.668793 0.5 155 63.546 0.00434122 -3.53815 63.546000 Cu 0.763964 0.698739 0.5 159 63.546 0.000222132 -3.53878 63.546000 Cu 0.697626 0.701877 0.5 208 63.546 0.00229477 -3.5387 63.546000 Cu 0.73283 0.716927 8.25222e-17 210 63.546 0.000323595 -3.5385 63.546000 Cu 0.861303 0.677825 1.56347e-17 111 63.546 0.00515884 -3.54021 63.546000 Cu 0.795051 0.680536 1 156 63.546 0.00213356 -3.53939 63.546000 Cu 0.799126 0.7138 1 157 63.546 0.00166941 -3.53903 63.546000 Cu 0.830264 0.695742 0.5 158 63.546 0.00395789 -3.53988 63.546000 Cu 0.865473 0.711147 0 160 63.546 0.00467057 -3.53999 63.546000 Cu 0.993996 0.674579 5.82088e-17 77 63.546 9.70687e-05 -3.53943 63.546000 Cu 0.998335 0.707899 1 118 63.546 2.58641e-05 -3.53956 63.546000 Cu 0.92761 0.675945 0 114 63.546 0.0020192 -3.53959 63.546000 Cu 0.931893 0.709286 0 115 63.546 0.00169164 -3.53977 63.546000 Cu 0.96298 0.69191 0.5 116 63.546 0.000457957 -3.53947 63.546000 Cu 0.896598 0.693473 0.5 117 63.546 0.00366736 -3.53998 63.546000 Cu 0.100167 0.72224 0.5 87 63.546 0.00295932 -3.54004 63.546000 Cu 0.0026052 0.741207 1.22508e-16 119 63.546 7.59356e-05 -3.53963 63.546000 Cu 0.0336771 0.723876 0.5 120 63.546 0.000697072 -3.53981 63.546000 Cu 0.0690975 0.73976 0 122 63.546 0.00171293 -3.53985 63.546000 Cu 0.0733656 0.773084 0 123 63.546 0.00175244 -3.53979 63.546000 Cu 0.0380284 0.757164 0.5 125 63.546 0.00066727 -3.53962 63.546000 Cu 0.00691941 0.774491 4.86454e-17 168 63.546 0.000138363 -3.5393 63.546000 Cu 0.104466 0.755528 0.5 124 63.546 0.00294295 -3.54014 63.546000 Cu 0.135514 0.737831 5.19707e-17 85 63.546 0.00405049 -3.54013 63.546000 Cu 0.201791 0.735157 1 88 63.546 0.0027784 -3.53922 63.546000 Cu 0.205853 0.768457 1.9043e-16 89 63.546 0.00399211 -3.53864 63.546000 Cu 0.170766 0.753261 0.5 90 63.546 0.00544523 -3.54002 63.546000 Cu 0.139673 0.771202 1.64182e-17 126 63.546 0.00552629 -3.5404 63.546000 Cu 0.26807 0.731878 9.81644e-17 342 63.546 0.000596637 -3.53809 63.546000 Cu 0.303285 0.746868 0.5 347 63.546 0.00339854 -3.53847 63.546000 Cu 0.236966 0.750148 0.5 379 63.546 0.000382591 -3.538 63.546000 Cu 0.272104 0.765023 7.7315e-17 380 63.546 0.00161584 -3.53748 63.546000 Cu 0.400822 0.726645 1.35035e-17 303 63.546 0.00297485 -3.54021 63.546000 Cu 0.334414 0.728867 0 344 63.546 0.00471749 -3.5397 63.546000 Cu 0.338544 0.762024 0 345 63.546 0.00539083 -3.53927 63.546000 Cu 0.369713 0.744264 0.5 346 63.546 0.00447781 -3.54003 63.546000 Cu 0.405038 0.759886 0 348 63.546 0.00267854 -3.5398 63.546000 Cu 0.436161 0.742437 0.5 309 63.546 0.00138348 -3.53982 63.546000 Cu 0.440432 0.775687 0.5 350 63.546 0.00127527 -3.53968 63.546000 Cu 0.373903 0.777403 0.5 351 63.546 0.00514173 -3.53972 63.546000 Cu 0.533705 0.723719 1 257 63.546 0.00052765 -3.53971 63.546000 Cu 0.467257 0.725057 3.4126e-17 306 63.546 0.000558477 -3.53946 63.546000 Cu 0.4715 0.758353 1 307 63.546 0.000486243 -3.53949 63.546000 Cu 0.502588 0.741047 0.5 308 63.546 1.98772e-05 -3.53929 63.546000 Cu 0.537912 0.75705 4.12377e-20 310 63.546 0.000726924 -3.5394 63.546000 Cu 0.506896 0.774369 0.5 313 63.546 8.57893e-05 -3.53926 63.546000 Cu 0.604263 0.755448 0 261 63.546 0.00387023 -3.54011 63.546000 Cu 0.635339 0.737723 0.5 262 63.546 0.00401892 -3.53994 63.546000 Cu 0.568992 0.739647 0.5 263 63.546 0.00204235 -3.53986 63.546000 Cu 0.639592 0.771085 0.5 267 63.546 0.00508888 -3.54036 63.546000 Cu 0.573295 0.773015 0.5 312 63.546 0.00251678 -3.53966 63.546000 Cu 0.736823 0.750135 1 211 63.546 0.000357376 -3.5389 63.546000 Cu 0.701638 0.735061 0.5 213 63.546 0.00160985 -3.53898 63.546000 Cu 0.670559 0.753125 1 264 63.546 0.0033649 -3.5399 63.546000 Cu 0.705817 0.768336 0.5 266 63.546 0.00176431 -3.53935 63.546000 Cu 0.76795 0.731942 0.5 212 63.546 0.000280006 -3.53856 63.546000 Cu 0.772076 0.765123 0.5 217 63.546 0.000595004 -3.5384 63.546000 Cu 0.869587 0.744392 1.22598e-16 161 63.546 0.00455725 -3.54009 63.546000 Cu 0.834295 0.728994 0.5 163 63.546 0.00400909 -3.53961 63.546000 Cu 0.803152 0.746995 1 214 63.546 0.00224134 -3.53896 63.546000 Cu 0.838483 0.762164 0.5 216 63.546 0.00461824 -3.53929 63.546000 Cu 0.873878 0.777532 0 218 63.546 0.00516864 -3.53959 63.546000 Cu 0.967199 0.725219 0.5 121 63.546 0.000355135 -3.53976 63.546000 Cu 0.900716 0.72677 0.5 162 63.546 0.00340883 -3.54019 63.546000 Cu 0.936087 0.742573 1 164 63.546 0.00151813 -3.54008 63.546000 Cu 0.940404 0.775802 1 165 63.546 0.00133602 -3.53965 63.546000 Cu 0.971525 0.7585 0.5 166 63.546 0.00022401 -3.53971 63.546000 Cu 0.90498 0.759999 0.5 167 63.546 0.00326083 -3.53999 63.546000 Cu 0.0113036 0.807786 7.11106e-17 169 63.546 0.000327611 -3.53884 63.546000 Cu 0.0422908 0.790492 0.5 170 63.546 0.000851713 -3.53925 63.546000 Cu 0.0776769 0.806516 2.21574e-16 172 63.546 0.00243747 -3.53939 63.546000 Cu 0.0468174 0.823899 0.5 175 63.546 0.00102804 -3.5386 63.546000 Cu 0.108608 0.788946 0.5 129 63.546 0.00400991 -3.54009 63.546000 Cu 0.143854 0.804698 1 127 63.546 0.00894606 -3.54034 63.546000 Cu 0.17479 0.786664 0.5 128 63.546 0.00817928 -3.53992 63.546000 Cu 0.179081 0.820163 0.5 132 63.546 0.0127463 -3.53996 63.546000 Cu 0.113035 0.822496 0.5 174 63.546 0.00629519 -3.53954 63.546000 Cu 0.209944 0.801788 9.18944e-17 130 63.546 0.00539045 -3.53886 63.546000 Cu 0.276212 0.798105 1 381 63.546 0.00371232 -3.53716 63.546000 Cu 0.307354 0.779943 0.5 382 63.546 0.00593016 -3.53829 63.546000 Cu 0.240945 0.783354 0.5 383 63.546 0.000785262 -3.53761 63.546000 Cu 0.311606 0.812911 0.5 387 63.546 0.0105994 -3.53679 63.546000 Cu 0.24517 0.816545 0.5 411 63.546 0.00131035 -3.53694 63.546000 Cu 0.280438 0.831084 0 412 63.546 0.00963369 -3.5348 63.546000 Cu 0.40936 0.793036 1.22436e-16 349 63.546 0.00307956 -3.53981 63.546000 Cu 0.342767 0.795071 1 384 63.546 0.00717082 -3.5389 63.546000 Cu 0.347083 0.827982 0 385 63.546 0.0116529 -3.53788 63.546000 Cu 0.378236 0.810459 0.5 386 63.546 0.00576679 -3.53937 63.546000 Cu 0.41377 0.826136 1 388 63.546 0.00290642 -3.53954 63.546000 Cu 0.54233 0.790411 1.76141e-17 311 63.546 0.000805214 -3.53921 63.546000 Cu 0.4759 0.791639 0 352 63.546 0.00033751 -3.53934 63.546000 Cu 0.480359 0.8249 1 353 63.546 0.000373959 -3.53889 63.546000 Cu 0.511343 0.807694 0.5 354 63.546 0.000170523 -3.53901 63.546000 Cu 0.444851 0.808887 0.5 355 63.546 0.00119517 -3.53949 63.546000 Cu 0.546808 0.823811 1 356 63.546 0.00109963 -3.53875 63.546000 Cu 0.608648 0.788862 1 314 63.546 0.00484748 -3.54 63.546000 Cu 0.613095 0.822369 8.24753e-20 315 63.546 0.00641441 -3.5396 63.546000 Cu 0.643961 0.804544 0.5 316 63.546 0.00698137 -3.54023 63.546000 Cu 0.577733 0.806437 0.5 317 63.546 0.00303635 -3.53938 63.546000 Cu 0.674867 0.786492 1.0781e-16 265 63.546 0.00427519 -3.54006 63.546000 Cu 0.741034 0.783358 1 268 63.546 0.000481125 -3.53854 63.546000 Cu 0.745216 0.816601 1 269 63.546 0.00160981 -3.53766 63.546000 Cu 0.710063 0.801683 0.5 271 63.546 0.00295686 -3.53937 63.546000 Cu 0.67917 0.819996 4.51103e-17 318 63.546 0.00785169 -3.54004 63.546000 Cu 0.776274 0.798245 0.5 270 63.546 0.00176021 -3.53732 63.546000 Cu 0.807385 0.780095 1 215 63.546 0.00384084 -3.53821 63.546000 Cu 0.842759 0.795219 0.5 221 63.546 0.00665571 -3.53854 63.546000 Cu 0.811605 0.813085 0 272 63.546 0.00795909 -3.53655 63.546000 Cu 0.847095 0.828118 0.5 274 63.546 0.0116136 -3.5377 63.546000 Cu 0.780453 0.83125 0.5 275 63.546 0.00636896 -3.53499 63.546000 Cu 0.878221 0.810584 5.50673e-17 219 63.546 0.00609833 -3.53919 63.546000 Cu 0.975841 0.791746 0.5 171 63.546 0.000329152 -3.53905 63.546000 Cu 0.909319 0.793151 0.5 220 63.546 0.00332124 -3.53968 63.546000 Cu 0.944811 0.808988 7.53862e-17 222 63.546 0.00133148 -3.53927 63.546000 Cu 0.980375 0.824989 0.5 224 63.546 0.000410291 -3.53877 63.546000 Cu 0.9138 0.826238 0.5 225 63.546 0.00314442 -3.53946 63.546000 Cu 0.0822399 0.840045 1.50416e-16 173 63.546 0.00336728 -3.53851 63.546000 Cu 0.0159389 0.841117 2.44899e-16 226 63.546 0.000491944 -3.53838 63.546000 Cu 0.0204458 0.874473 1.22298e-16 227 63.546 0.000608432 -3.53768 63.546000 Cu 0.0513807 0.857358 0.5 228 63.546 0.0013044 -3.53777 63.546000 Cu 0.0867321 0.873658 1.2247e-16 230 63.546 0.00438847 -3.5374 63.546000 Cu 0.148325 0.838318 1.91005e-18 176 63.546 0.0143779 -3.53983 63.546000 Cu 0.152778 0.872098 1 177 63.546 0.0234194 -3.53908 63.546000 Cu 0.183483 0.853799 0.5 178 63.546 0.0215017 -3.5394 63.546000 Cu 0.117547 0.856161 0.5 179 63.546 0.0100061 -3.53876 63.546000 Cu 0.187908 0.887677 0.5 182 63.546 0.0414049 -3.53788 63.546000 Cu 0.214275 0.83519 1.19726e-16 131 63.546 0.0083811 -3.53816 63.546000 Cu 0.218552 0.868743 0 180 63.546 0.0170676 -3.53707 63.546000 Cu 0.284561 0.863964 5.4878e-17 413 63.546 0.0262876 -3.52938 63.546000 Cu 0.315854 0.845729 0.5 414 63.546 0.0227679 -3.53483 63.546000 Cu 0.249386 0.849761 0.5 415 63.546 0.00343578 -3.5352 63.546000 Cu 0.319995 0.878322 0.5 419 63.546 0.0546631 -3.52992 63.546000 Cu 0.253425 0.883088 0.5 433 63.546 0.01437 -3.53004 63.546000 Cu 0.418253 0.859169 1.0277e-16 389 63.546 0.00275094 -3.53892 63.546000 Cu 0.382664 0.843421 0.5 391 63.546 0.00649633 -3.53898 63.546000 Cu 0.351405 0.860768 3.66172e-17 416 63.546 0.0182546 -3.53676 63.546000 Cu 0.387056 0.87625 0.5 418 63.546 0.00758989 -3.53803 63.546000 Cu 0.515888 0.841027 0.5 359 63.546 0.000336925 -3.53853 63.546000 Cu 0.449344 0.842045 0.5 390 63.546 0.00123353 -3.53903 63.546000 Cu 0.484907 0.85814 0 392 63.546 0.000505542 -3.53859 63.546000 Cu 0.520471 0.874373 0.5 394 63.546 0.000583343 -3.53786 63.546000 Cu 0.453862 0.875155 0.5 395 63.546 0.00130942 -3.53865 63.546000 Cu 0.551394 0.857248 1 357 63.546 0.00137223 -3.53798 63.546000 Cu 0.648396 0.838147 0.5 321 63.546 0.0110312 -3.53983 63.546000 Cu 0.582249 0.839927 0.5 358 63.546 0.00354152 -3.53869 63.546000 Cu 0.617624 0.855999 1 360 63.546 0.00874597 -3.53874 63.546000 Cu 0.652856 0.871945 0.5 362 63.546 0.0196334 -3.53889 63.546000 Cu 0.586812 0.873505 0.5 363 63.546 0.00399718 -3.53738 63.546000 Cu 0.683543 0.853677 1 319 63.546 0.0171196 -3.53963 63.546000 Cu 0.714315 0.83514 0.5 320 63.546 0.00703981 -3.53899 63.546000 Cu 0.749403 0.849856 1 322 63.546 0.00446166 -3.53594 63.546000 Cu 0.753443 0.883172 1 323 63.546 0.0163204 -3.53038 63.546000 Cu 0.718577 0.868745 0.5 325 63.546 0.0178348 -3.53774 63.546000 Cu 0.687924 0.887615 1 364 63.546 0.0400285 -3.53801 63.546000 Cu 0.815887 0.845884 7.75006e-17 273 63.546 0.0196752 -3.53443 63.546000 Cu 0.851458 0.860871 0.5 279 63.546 0.0188891 -3.53663 63.546000 Cu 0.784595 0.864105 0.5 324 63.546 0.0222095 -3.52898 63.546000 Cu 0.820059 0.878442 4.02367e-17 326 63.546 0.0512186 -3.5294 63.546000 Cu 0.882713 0.843513 3.57887e-17 276 63.546 0.0075168 -3.53892 63.546000 Cu 0.887095 0.876327 0 277 63.546 0.00847068 -3.53817 63.546000 Cu 0.949408 0.842135 0 223 63.546 0.00136946 -3.53915 63.546000 Cu 0.984947 0.858228 0.5 229 63.546 0.000620227 -3.53859 63.546000 Cu 0.918302 0.859254 0.5 278 63.546 0.0029709 -3.53899 63.546000 Cu 0.953883 0.875245 1.22429e-16 280 63.546 0.00134408 -3.5386 63.546000 Cu 0.0913325 0.907348 8.38493e-17 231 63.546 0.00484512 -3.53553 63.546000 Cu 0.0558905 0.890869 0.5 233 63.546 0.00140171 -3.53683 63.546000 Cu 0.0249407 0.907865 1 284 63.546 0.00095637 -3.53692 63.546000 Cu 0.0290761 0.941252 0 285 63.546 0.00854969 -3.53736 63.546000 Cu 0.0603833 0.924419 0.5 286 63.546 0.0030402 -3.53549 63.546000 Cu 0.0957361 0.941043 1.76507e-16 288 63.546 0.0101668 -3.53413 63.546000 Cu 0.122093 0.889947 0.5 232 63.546 0.0136887 -3.53696 63.546000 Cu 0.157398 0.906092 0 234 63.546 0.0368379 -3.53585 63.546000 Cu 0.162217 0.940347 1.60152e-17 235 63.546 0.0585701 -3.52616 63.546000 Cu 0.192463 0.921986 0.5 236 63.546 0.0961526 -3.5286 63.546000 Cu 0.126745 0.92384 0.5 237 63.546 0.0143994 -3.53224 63.546000 Cu 0.222835 0.9026 1.47314e-16 181 63.546 0.0505201 -3.53255 63.546000 Cu 0.227512 0.93707 2.80641e-17 238 63.546 0.25002 -3.50479 63.546000 Cu 0.288517 0.896552 0 434 63.546 0.100632 -3.51291 63.546000 Cu 0.292602 0.92855 9.04792e-18 435 63.546 0.519147 -3.46266 63.546000 Cu 0.257201 0.916694 0.5 437 63.546 0.0860196 -3.51129 63.546000 Cu 0.324106 0.910583 0.5 436 63.546 0.141817 -3.52295 63.546000 Cu 0.328677 0.942443 0.5 441 63.546 0.414364 -3.50338 63.546000 Cu 0.355673 0.893341 1.22442e-16 417 63.546 0.0277704 -3.53566 63.546000 Cu 0.422711 0.892106 0 420 63.546 0.00271085 -3.53868 63.546000 Cu 0.427096 0.92499 1 421 63.546 0.00331243 -3.53872 63.546000 Cu 0.391389 0.908953 0.5 423 63.546 0.0073215 -3.53863 63.546000 Cu 0.360018 0.92575 7.7598e-17 438 63.546 0.0306022 -3.53631 63.546000 Cu 0.395697 0.941602 0.5 440 63.546 0.0120296 -3.53835 63.546000 Cu 0.489453 0.891363 1 393 63.546 0.000675638 -3.53813 63.546000 Cu 0.524986 0.907732 0.5 399 63.546 0.000907169 -3.5369 63.546000 Cu 0.458336 0.908239 0.5 422 63.546 0.00131721 -3.5384 63.546000 Cu 0.493876 0.92458 8.54744e-19 424 63.546 0.00268212 -3.53752 63.546000 Cu 0.529164 0.941099 0.5 426 63.546 0.00859119 -3.53735 63.546000 Cu 0.462471 0.941294 0.5 427 63.546 0.00881489 -3.53842 63.546000 Cu 0.62216 0.889778 8.06759e-18 361 63.546 0.0115965 -3.53666 63.546000 Cu 0.555953 0.890725 5.30991e-17 396 63.546 0.00137253 -3.5368 63.546000 Cu 0.560436 0.924243 1.06656e-16 397 63.546 0.00254496 -3.53539 63.546000 Cu 0.591379 0.907166 0.5 398 63.546 0.00378732 -3.53524 63.546000 Cu 0.626759 0.923696 0 400 63.546 0.0126515 -3.53185 63.546000 Cu 0.595799 0.94088 0.5 403 63.546 0.00925529 -3.53394 63.546000 Cu 0.6574 0.905987 0.5 367 63.546 0.0351939 -3.53562 63.546000 Cu 0.662226 0.940298 0.5 402 63.546 0.0597815 -3.5258 63.546000 Cu 0.692441 0.921969 1 365 63.546 0.0998641 -3.52888 63.546000 Cu 0.722817 0.902625 0.5 366 63.546 0.0535821 -3.53315 63.546000 Cu 0.757217 0.916734 2.2689e-16 368 63.546 0.0863909 -3.51234 63.546000 Cu 0.727504 0.937077 0.5 371 63.546 0.25081 -3.50539 63.546000 Cu 0.824188 0.910676 1 327 63.546 0.138169 -3.52262 63.546000 Cu 0.855733 0.893438 0.5 328 63.546 0.0274809 -3.53572 63.546000 Cu 0.788564 0.896642 0.5 329 63.546 0.0974404 -3.51242 63.546000 Cu 0.860108 0.925848 0.5 333 63.546 0.0300631 -3.53633 63.546000 Cu 0.792669 0.928598 0.5 370 63.546 0.512744 -3.46215 63.546000 Cu 0.828773 0.94251 3.6722e-16 372 63.546 0.408437 -3.50223 63.546000 Cu 0.989436 0.891463 0.5 282 63.546 0.000817578 -3.53799 63.546000 Cu 0.993827 0.924698 0.5 287 63.546 0.00282257 -3.53756 63.546000 Cu 0.958323 0.908333 2.66092e-16 281 63.546 0.00140901 -3.53834 63.546000 Cu 0.922729 0.892189 0.5 283 63.546 0.00285497 -3.53872 63.546000 Cu 0.891432 0.909044 1 330 63.546 0.00755293 -3.5389 63.546000 Cu 0.927106 0.925091 0.5 332 63.546 0.00361671 -3.53892 63.546000 Cu 0.962416 0.941418 1.10433e-16 334 63.546 0.00896634 -3.53868 63.546000 Cu 0.895739 0.94172 1.22266e-16 331 63.546 0.0128566 -3.53868 63.546000 Cu 0.0639337 0.957916 0.5 291 63.546 0.0227076 -3.53845 63.546000 Cu 0.0310898 0.974617 1.22375e-16 338 63.546 0.0295138 -3.54077 63.546000 Cu 0.0639925 0.991343 0.5 339 63.546 0.0242836 -3.53863 63.546000 Cu 0.0982211 0.974625 0 289 63.546 0.0494825 -3.53966 63.546000 Cu 0.197681 0.957129 0.5 240 63.546 0.342572 -3.49529 63.546000 Cu 0.130949 0.957726 0.5 290 63.546 0.0358677 -3.53122 63.546000 Cu 0.165942 0.974527 7.17498e-17 292 63.546 0.151181 -3.51932 63.546000 Cu 0.197765 0.991834 0.5 293 63.546 0.3491 -3.49538 63.546000 Cu 0.131009 0.991428 0.5 294 63.546 0.0381583 -3.53097 63.546000 Cu 0.261197 0.997691 0.5 511 63.546 5.72171 -3.40754 63.546000 Cu 0.235585 0.974473 0 239 63.546 4.54024 -3.51866 63.546000 Cu 0.261035 0.951163 0.5 447 63.546 5.75289 -3.40567 63.546000 Cu 0.298349 0.959354 0 448 63.546 5.62278 -3.26113 63.546000 Cu 0.298543 0.989498 0 449 63.546 5.63643 -3.25982 63.546000 Cu 0.331378 0.974403 0.5 450 63.546 3.28356 -3.46793 63.546000 Cu 0.364295 0.958122 0 439 63.546 0.0537087 -3.53393 63.546000 Cu 0.430662 0.957895 1 442 63.546 0.0248026 -3.53837 63.546000 Cu 0.397936 0.974362 0.5 445 63.546 0.0318232 -3.54064 63.546000 Cu 0.364469 0.990614 8.32438e-17 452 63.546 0.0590598 -3.53351 63.546000 Cu 0.430774 0.990855 0 443 63.546 0.0279079 -3.5386 63.546000 Cu 0.497273 0.95781 1 425 63.546 0.0211048 -3.5395 63.546000 Cu 0.53124 0.974465 0.5 431 63.546 0.0318672 -3.5408 63.546000 Cu 0.46449 0.974402 0.5 444 63.546 0.0285328 -3.54028 63.546000 Cu 0.497343 0.991046 0 446 63.546 0.0233717 -3.53948 63.546000 Cu 0.631025 0.957637 1 401 63.546 0.0369794 -3.53105 63.546000 Cu 0.564056 0.957759 0 428 63.546 0.0238027 -3.53858 63.546000 Cu 0.564108 0.991213 7.39729e-17 429 63.546 0.0254599 -3.53871 63.546000 Cu 0.59833 0.974508 0.5 430 63.546 0.0514136 -3.53982 63.546000 Cu 0.631068 0.991359 0 432 63.546 0.0378803 -3.53099 63.546000 Cu 0.666006 0.974487 0.5 407 63.546 0.153096 -3.51926 63.546000 Cu 0.761184 0.997681 2.58005e-16 454 63.546 5.71746 -3.4064 63.546000 Cu 0.761125 0.9511 4.70128e-16 369 63.546 5.77541 -3.40629 63.546000 Cu 0.697761 0.957117 3.19554e-17 404 63.546 0.352122 -3.49582 63.546000 Cu 0.697796 0.991794 1 405 63.546 0.350321 -3.49518 63.546000 Cu 0.735609 0.974412 0.5 406 63.546 4.54839 -3.51928 63.546000 Cu 0.831369 0.974443 5.59299e-16 373 63.546 3.3029 -3.46786 63.546000 Cu 0.864321 0.958229 0.5 374 63.546 0.0541443 -3.53364 63.546000 Cu 0.798364 0.959348 0.5 375 63.546 5.61088 -3.26032 63.546000 Cu 0.864394 0.99073 0.5 378 63.546 0.0575401 -3.53363 63.546000 Cu 0.79848 0.989509 0.5 409 63.546 5.63536 -3.25897 63.546000 Cu 0.997151 0.957957 0.5 336 63.546 0.0199738 -3.53967 63.546000 Cu 0.99722 0.991218 0.5 340 63.546 0.0219288 -3.53963 63.546000 Cu 0.964367 0.974574 1.21938e-16 335 63.546 0.0265862 -3.54056 63.546000 Cu 0.930607 0.958044 0.5 337 63.546 0.0243531 -3.53876 63.546000 Cu 0.897875 0.974522 2.44665e-16 376 63.546 0.0306334 -3.54076 63.546000 Cu 0.930678 0.991047 0.5 377 63.546 0.0267862 -3.53878