Number of particles = 796 A = 1 Angstrom (basic length-scale) H0(1,1) = 25.5235 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 102.255 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61653 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 0.0766372 0.0122472 0 406 63.546 0.372456 -3.49866 63.546000 Cu 0.00569903 0.0127929 0.5 407 63.546 0.176239 -3.53114 63.546000 Cu 0.153059 0.0100647 0.5 409 63.546 4.30978 -3.43853 63.546000 Cu 0.01421 0.0304126 4.19707e-19 416 63.546 0.159697 -3.52477 63.546000 Cu 0.0873426 0.0285376 0.5 418 63.546 0.0658858 -3.53077 63.546000 Cu 0.160874 0.0261295 8.15131e-17 420 63.546 0.0433809 -3.51414 63.546000 Cu 0.224045 0.00670681 0 408 63.546 9.12714 -3.287 63.546000 Cu 0.235939 0.0226371 0.5 422 63.546 0.835614 -3.44712 63.546000 Cu 0.305552 0.0178851 0 424 63.546 0.891356 -3.41667 63.546000 Cu 0.313999 0.0365087 0.5 427 63.546 0.154934 -3.51015 63.546000 Cu 0.243921 0.0394569 0 421 63.546 0.0960876 -3.53536 63.546000 Cu 0.379874 0.0339072 1.01989e-16 425 63.546 0.0524051 -3.49934 63.546000 Cu 0.368208 0.0142286 0.5 426 63.546 0.393607 -3.46844 63.546000 Cu 0.435692 0.0133081 1.15599e-16 428 63.546 0.22095 -3.52697 63.546000 Cu 0.445341 0.0318258 0.5 431 63.546 0.10971 -3.52162 63.546000 Cu 0.51421 0.0304126 0 429 63.546 0.159697 -3.52477 63.546000 Cu 0.505699 0.0127929 0.5 430 63.546 0.176239 -3.53114 63.546000 Cu 0.576637 0.0122472 0 432 63.546 0.372456 -3.49866 63.546000 Cu 0.660874 0.0261295 5.48917e-17 433 63.546 0.0433809 -3.51414 63.546000 Cu 0.653059 0.0100647 0.5 434 63.546 4.30978 -3.43853 63.546000 Cu 0.587343 0.0285376 0.5 435 63.546 0.0658858 -3.53077 63.546000 Cu 0.724045 0.00670681 0 436 63.546 9.12714 -3.287 63.546000 Cu 0.805552 0.0178851 4.0082e-17 437 63.546 0.891356 -3.41667 63.546000 Cu 0.735939 0.0226371 0.5 439 63.546 0.835614 -3.44712 63.546000 Cu 0.813999 0.0365087 0.5 466 63.546 0.154934 -3.51015 63.546000 Cu 0.743921 0.0394569 0 464 63.546 0.0960876 -3.53536 63.546000 Cu 0.935692 0.0133081 5.99582e-20 404 63.546 0.22095 -3.52697 63.546000 Cu 0.868208 0.0142286 0.5 405 63.546 0.393607 -3.46844 63.546000 Cu 0.879874 0.0339072 1.79875e-19 412 63.546 0.0524051 -3.49934 63.546000 Cu 0.945341 0.0318258 0.5 414 63.546 0.10971 -3.52162 63.546000 Cu 0.0978522 0.0452682 2.93795e-17 417 63.546 0.0267012 -3.53708 63.546000 Cu 0.0263269 0.0477021 0.5 419 63.546 0.0422746 -3.53752 63.546000 Cu 0.0384127 0.0650687 2.39833e-19 444 63.546 0.00522755 -3.53879 63.546000 Cu 0.109285 0.0622875 0.5 446 63.546 0.0113873 -3.54291 63.546000 Cu 0.120135 0.0796592 1.79875e-19 445 63.546 0.00629265 -3.54252 63.546000 Cu 0.171265 0.0425097 0.5 423 63.546 0.0256774 -3.53682 63.546000 Cu 0.180811 0.0595245 3.12682e-17 448 63.546 0.0244173 -3.54443 63.546000 Cu 0.260346 0.0746156 4.38894e-17 449 63.546 0.00394346 -3.54125 63.546000 Cu 0.251922 0.0569184 0.5 450 63.546 0.0239686 -3.54255 63.546000 Cu 0.190405 0.0770207 0.5 451 63.546 0.00915521 -3.54312 63.546000 Cu 0.321501 0.0545885 0 452 63.546 0.017572 -3.53405 63.546000 Cu 0.329927 0.0724051 0.5 455 63.546 0.00405721 -3.53754 63.546000 Cu 0.399216 0.0701866 6.99712e-17 453 63.546 0.0149297 -3.53445 63.546000 Cu 0.389566 0.0523625 0.5 454 63.546 0.0313308 -3.52485 63.546000 Cu 0.457122 0.0500857 3.89728e-19 456 63.546 0.0395024 -3.52692 63.546000 Cu 0.468625 0.0677396 0.5 459 63.546 0.0125767 -3.53507 63.546000 Cu 0.538413 0.0650687 5.57011e-17 457 63.546 0.00522755 -3.53879 63.546000 Cu 0.526327 0.0477021 0.5 458 63.546 0.0422746 -3.53752 63.546000 Cu 0.597852 0.0452682 1.19916e-19 460 63.546 0.0267012 -3.53708 63.546000 Cu 0.609285 0.0622875 0.5 463 63.546 0.0113873 -3.54291 63.546000 Cu 0.620135 0.0796592 3.54353e-17 489 63.546 0.00629265 -3.54252 63.546000 Cu 0.680811 0.0595245 4.20906e-17 461 63.546 0.0244173 -3.54443 63.546000 Cu 0.671265 0.0425097 0.5 462 63.546 0.0256774 -3.53682 63.546000 Cu 0.821501 0.0545885 4.54483e-17 465 63.546 0.017572 -3.53405 63.546000 Cu 0.751922 0.0569184 0.5 467 63.546 0.0239686 -3.54255 63.546000 Cu 0.690405 0.0770207 0.5 491 63.546 0.00915521 -3.54312 63.546000 Cu 0.760346 0.0746156 6.50246e-17 493 63.546 0.00394346 -3.54125 63.546000 Cu 0.829927 0.0724051 0.5 495 63.546 0.00405721 -3.53754 63.546000 Cu 0.957122 0.0500857 8.99373e-20 413 63.546 0.0395024 -3.52692 63.546000 Cu 0.889566 0.0523625 0.5 415 63.546 0.0313308 -3.52485 63.546000 Cu 0.899216 0.0701866 1.04927e-18 440 63.546 0.0149297 -3.53445 63.546000 Cu 0.968625 0.0677396 0.5 442 63.546 0.0125767 -3.53507 63.546000 Cu 0.0497697 0.0824306 0.5 447 63.546 0.00163087 -3.54005 63.546000 Cu 0.0602339 0.0998653 2.23944e-17 473 63.546 0.00164371 -3.54054 63.546000 Cu 0.140208 0.114826 3.2977e-19 474 63.546 0.000702237 -3.53993 63.546000 Cu 0.130306 0.0972189 0.5 475 63.546 0.00253486 -3.54083 63.546000 Cu 0.0702839 0.117368 0.5 476 63.546 0.00100054 -3.5405 63.546000 Cu 9.73518e-05 0.119957 4.8776e-17 470 63.546 0.000376359 -3.54062 63.546000 Cu 0.200085 0.0946959 1.79875e-19 477 63.546 0.00149404 -3.54033 63.546000 Cu 0.279545 0.10997 0 478 63.546 0.000962242 -3.53899 63.546000 Cu 0.269665 0.0923352 0.5 479 63.546 0.00115118 -3.5395 63.546000 Cu 0.209889 0.112365 0.5 480 63.546 0.000230201 -3.53926 63.546000 Cu 0.339348 0.0900449 5.68703e-17 481 63.546 0.00336517 -3.53859 63.546000 Cu 0.419568 0.10511 0 482 63.546 0.000882846 -3.53968 63.546000 Cu 0.409285 0.0876902 0.5 483 63.546 0.0043376 -3.53807 63.546000 Cu 0.349414 0.107576 0.5 484 63.546 0.00147562 -3.53926 63.546000 Cu 0.479465 0.0851555 0 485 63.546 0.00265355 -3.53827 63.546000 Cu 0.489923 0.102529 0.5 488 63.546 0.000499588 -3.54008 63.546000 Cu 0.560234 0.0998653 2.872e-17 486 63.546 0.00164371 -3.54054 63.546000 Cu 0.54977 0.0824306 0.5 487 63.546 0.00163087 -3.54005 63.546000 Cu 0.630306 0.0972189 0.5 492 63.546 0.00253486 -3.54083 63.546000 Cu 0.570284 0.117368 0.5 517 63.546 0.00100054 -3.5405 63.546000 Cu 0.640208 0.114826 1.19916e-19 519 63.546 0.000702237 -3.53993 63.546000 Cu 0.500097 0.119957 1.19916e-19 515 63.546 0.000376359 -3.54062 63.546000 Cu 0.700085 0.0946959 1.19916e-19 490 63.546 0.00149404 -3.54033 63.546000 Cu 0.769665 0.0923352 0.5 496 63.546 0.00115118 -3.5395 63.546000 Cu 0.709889 0.112365 0.5 521 63.546 0.000230201 -3.53926 63.546000 Cu 0.779545 0.10997 7.05108e-17 523 63.546 0.000962242 -3.53899 63.546000 Cu 0.979465 0.0851555 5.99582e-20 441 63.546 0.00265355 -3.53827 63.546000 Cu 0.909285 0.0876902 0.5 443 63.546 0.0043376 -3.53807 63.546000 Cu 0.919568 0.10511 7.8875e-17 469 63.546 0.000882846 -3.53968 63.546000 Cu 0.989923 0.102529 0.5 471 63.546 0.000499588 -3.54008 63.546000 Cu 0.839348 0.0900449 0 494 63.546 0.00336517 -3.53859 63.546000 Cu 0.849414 0.107576 0.5 524 63.546 0.00147562 -3.53926 63.546000 Cu 0.0201538 0.15497 2.99791e-20 500 63.546 0.000148423 -3.54038 63.546000 Cu 0.0101751 0.137443 0.5 501 63.546 0.00036849 -3.5406 63.546000 Cu 0.0801975 0.134915 2.99791e-20 503 63.546 0.00032033 -3.54026 63.546000 Cu 0.159983 0.150001 3.2977e-19 504 63.546 4.27114e-05 -3.53965 63.546000 Cu 0.150064 0.132429 0.5 505 63.546 8.90584e-05 -3.53963 63.546000 Cu 0.0901106 0.152477 0.5 506 63.546 4.74336e-05 -3.54004 63.546000 Cu 0.219836 0.129976 3.60948e-17 507 63.546 0.000240376 -3.53921 63.546000 Cu 0.299788 0.145044 0 508 63.546 0.00017259 -3.53965 63.546000 Cu 0.289666 0.127529 0.5 509 63.546 0.000480818 -3.53925 63.546000 Cu 0.229847 0.147528 0.5 510 63.546 0.000141278 -3.53949 63.546000 Cu 0.359644 0.125058 0 511 63.546 0.000427101 -3.53969 63.546000 Cu 0.440015 0.139993 2.03858e-17 512 63.546 9.95892e-05 -3.5405 63.546000 Cu 0.429829 0.122534 0.5 513 63.546 0.000138258 -3.5403 63.546000 Cu 0.369854 0.142533 0.5 514 63.546 7.1998e-05 -3.54006 63.546000 Cu 0.450088 0.157487 0.5 542 63.546 0.000122315 -3.54045 63.546000 Cu 0.580197 0.134915 0 516 63.546 0.00032033 -3.54026 63.546000 Cu 0.510175 0.137443 0.5 518 63.546 0.00036849 -3.5406 63.546000 Cu 0.650064 0.132429 0.5 522 63.546 8.90584e-05 -3.53963 63.546000 Cu 0.520154 0.15497 2.99791e-18 544 63.546 0.000148423 -3.54038 63.546000 Cu 0.590111 0.152477 0.5 546 63.546 4.74336e-05 -3.54004 63.546000 Cu 0.659983 0.150001 0 548 63.546 4.27114e-05 -3.53965 63.546000 Cu 0.719836 0.129976 0 520 63.546 0.000240376 -3.53921 63.546000 Cu 0.789666 0.127529 0.5 525 63.546 0.000480818 -3.53925 63.546000 Cu 0.729847 0.147528 0.5 550 63.546 0.000141278 -3.53949 63.546000 Cu 0.799788 0.145044 0 552 63.546 0.00017259 -3.53965 63.546000 Cu 0.859644 0.125058 9.59331e-19 468 63.546 0.000427101 -3.53969 63.546000 Cu 0.929829 0.122534 0.5 472 63.546 0.000138258 -3.5403 63.546000 Cu 0.869854 0.142533 0.5 498 63.546 7.1998e-05 -3.54006 63.546000 Cu 0.940015 0.139993 1.49895e-19 499 63.546 9.95892e-05 -3.5405 63.546000 Cu 0.950088 0.157487 0.5 502 63.546 0.000122315 -3.54045 63.546000 Cu 0.0399994 0.190031 4.11013e-17 529 63.546 9.07495e-06 -3.53991 63.546000 Cu 0.0300642 0.172506 0.5 530 63.546 2.37319e-05 -3.54009 63.546000 Cu 0.100034 0.170024 0 532 63.546 2.34254e-05 -3.53988 63.546000 Cu 0.109951 0.187549 0.5 535 63.546 2.75043e-05 -3.53983 63.546000 Cu 0.179928 0.185066 5.76798e-17 533 63.546 5.65519e-05 -3.53985 63.546000 Cu 0.169961 0.167547 0.5 534 63.546 7.14707e-05 -3.53978 63.546000 Cu 0.239894 0.165057 5.57611e-17 536 63.546 9.11525e-05 -3.53985 63.546000 Cu 0.319978 0.180048 5.99582e-20 537 63.546 8.9706e-06 -3.54019 63.546000 Cu 0.309889 0.162547 0.5 538 63.546 4.19217e-05 -3.54002 63.546000 Cu 0.249938 0.182566 0.5 539 63.546 4.32541e-05 -3.54 63.546000 Cu 0.330013 0.197548 0.5 566 63.546 1.78047e-05 -3.54007 63.546000 Cu 0.379971 0.160019 0 540 63.546 2.30501e-05 -3.54027 63.546000 Cu 0.460057 0.175004 1.49895e-19 541 63.546 4.60587e-05 -3.54028 63.546000 Cu 0.39002 0.177522 0.5 543 63.546 2.33682e-05 -3.54032 63.546000 Cu 0.400046 0.195033 6.94915e-17 568 63.546 2.52863e-05 -3.54011 63.546000 Cu 0.47004 0.192525 0.5 570 63.546 1.79947e-05 -3.54004 63.546000 Cu 0.600034 0.170024 0 545 63.546 2.34254e-05 -3.53988 63.546000 Cu 0.530064 0.172506 0.5 547 63.546 2.37319e-05 -3.54009 63.546000 Cu 0.539999 0.190031 1.49895e-19 572 63.546 9.07495e-06 -3.53991 63.546000 Cu 0.609951 0.187549 0.5 574 63.546 2.75043e-05 -3.53983 63.546000 Cu 0.739894 0.165057 0 549 63.546 9.11525e-05 -3.53985 63.546000 Cu 0.669961 0.167547 0.5 551 63.546 7.14707e-05 -3.53978 63.546000 Cu 0.809889 0.162547 0.5 553 63.546 4.19217e-05 -3.54002 63.546000 Cu 0.679928 0.185066 0 576 63.546 5.65519e-05 -3.53985 63.546000 Cu 0.749938 0.182566 0.5 578 63.546 4.32541e-05 -3.54 63.546000 Cu 0.819978 0.180048 1.56011e-16 580 63.546 8.9706e-06 -3.54019 63.546000 Cu 0.830013 0.197548 0.5 581 63.546 1.78047e-05 -3.54007 63.546000 Cu 0.879971 0.160019 8.40014e-17 497 63.546 2.30501e-05 -3.54027 63.546000 Cu 0.900046 0.195033 5.99582e-20 526 63.546 2.52863e-05 -3.54011 63.546000 Cu 0.89002 0.177522 0.5 527 63.546 2.33682e-05 -3.54032 63.546000 Cu 0.960057 0.175004 4.14611e-17 528 63.546 4.60587e-05 -3.54028 63.546000 Cu 0.97004 0.192525 0.5 531 63.546 1.79947e-05 -3.54004 63.546000 Cu 0.059969 0.225044 3.74739e-18 557 63.546 5.16041e-06 -3.53975 63.546000 Cu 0.0499702 0.207546 0.5 558 63.546 1.27777e-05 -3.53978 63.546000 Cu 0.11993 0.205057 0 560 63.546 3.38974e-05 -3.53979 63.546000 Cu 0.129959 0.222548 0.5 563 63.546 5.48025e-06 -3.53975 63.546000 Cu 0.199966 0.220047 6.64037e-17 561 63.546 2.53023e-06 -3.53979 63.546000 Cu 0.189926 0.202563 0.5 562 63.546 3.16477e-05 -3.53985 63.546000 Cu 0.259962 0.20006 0 564 63.546 1.5016e-05 -3.53995 63.546000 Cu 0.269989 0.217541 0.5 567 63.546 2.82194e-06 -3.53982 63.546000 Cu 0.20999 0.237535 0.5 592 63.546 1.14598e-05 -3.54006 63.546000 Cu 0.280001 0.235028 0 594 63.546 1.35502e-05 -3.54005 63.546000 Cu 0.340018 0.215035 2.99791e-19 565 63.546 7.80022e-06 -3.53984 63.546000 Cu 0.480014 0.210036 5.99582e-20 569 63.546 7.04336e-06 -3.5398 63.546000 Cu 0.410033 0.212532 0.5 571 63.546 1.17263e-05 -3.53983 63.546000 Cu 0.350008 0.232524 0.5 596 63.546 1.15773e-05 -3.54 63.546000 Cu 0.420003 0.230027 1.21595e-16 598 63.546 5.50408e-06 -3.53991 63.546000 Cu 0.489988 0.227535 0.5 600 63.546 2.40306e-06 -3.53981 63.546000 Cu 0.61993 0.205057 0 573 63.546 3.38974e-05 -3.53979 63.546000 Cu 0.54997 0.207546 0.5 575 63.546 1.27777e-05 -3.53978 63.546000 Cu 0.559969 0.225044 5.99582e-20 602 63.546 5.16041e-06 -3.53975 63.546000 Cu 0.629959 0.222548 0.5 604 63.546 5.48025e-06 -3.53975 63.546000 Cu 0.759962 0.20006 7.47379e-17 577 63.546 1.5016e-05 -3.53995 63.546000 Cu 0.689926 0.202563 0.5 579 63.546 3.16477e-05 -3.53985 63.546000 Cu 0.699966 0.220047 8.34618e-17 606 63.546 2.53023e-06 -3.53979 63.546000 Cu 0.780001 0.235028 1.79875e-19 607 63.546 1.35502e-05 -3.54005 63.546000 Cu 0.769989 0.217541 0.5 608 63.546 2.82194e-06 -3.53982 63.546000 Cu 0.70999 0.237535 0.5 609 63.546 1.14598e-05 -3.54006 63.546000 Cu 0.920003 0.230027 0 554 63.546 5.50408e-06 -3.53991 63.546000 Cu 0.910033 0.212532 0.5 555 63.546 1.17263e-05 -3.53983 63.546000 Cu 0.980014 0.210036 0 556 63.546 7.04336e-06 -3.5398 63.546000 Cu 0.989988 0.227535 0.5 559 63.546 2.40306e-06 -3.53981 63.546000 Cu 0.840018 0.215035 0 610 63.546 7.80022e-06 -3.53984 63.546000 Cu 0.850008 0.232524 0.5 611 63.546 1.15773e-05 -3.54 63.546000 Cu 0.0799829 0.260044 3.26772e-17 587 63.546 3.13033e-06 -3.54008 63.546000 Cu 0.0699826 0.242539 0.5 588 63.546 3.46294e-06 -3.53999 63.546000 Cu 0.00999761 0.262538 0.5 589 63.546 2.58071e-06 -3.53995 63.546000 Cu 0.139983 0.240039 3.25573e-17 590 63.546 7.65101e-06 -3.54003 63.546000 Cu 0.149977 0.257544 0.5 593 63.546 2.82749e-06 -3.54022 63.546000 Cu 0.0899553 0.277547 0.5 618 63.546 1.01113e-05 -3.53991 63.546000 Cu 0.159955 0.275046 0 620 63.546 1.93269e-05 -3.53999 63.546000 Cu 0.219981 0.255038 9.35347e-18 591 63.546 1.13266e-06 -3.54028 63.546000 Cu 0.289991 0.252531 0.5 597 63.546 1.12979e-06 -3.54026 63.546000 Cu 0.229975 0.272538 0.5 622 63.546 1.76897e-05 -3.54002 63.546000 Cu 0.299999 0.270031 3.98422e-17 624 63.546 1.05643e-05 -3.53999 63.546000 Cu 0.359998 0.250026 6.7423e-17 595 63.546 2.36097e-06 -3.54017 63.546000 Cu 0.429997 0.247528 0.5 601 63.546 1.80125e-06 -3.54007 63.546000 Cu 0.370013 0.267528 0.5 626 63.546 5.51789e-06 -3.53992 63.546000 Cu 0.440011 0.265031 2.61118e-17 628 63.546 3.17836e-06 -3.53989 63.546000 Cu 0.499989 0.245034 5.39624e-18 599 63.546 1.18559e-06 -3.54 63.546000 Cu 0.639983 0.240039 2.92896e-17 603 63.546 7.65101e-06 -3.54003 63.546000 Cu 0.569983 0.242539 0.5 605 63.546 3.46294e-06 -3.53999 63.546000 Cu 0.509998 0.262538 0.5 630 63.546 2.58071e-06 -3.53995 63.546000 Cu 0.579983 0.260044 5.99582e-20 632 63.546 3.13033e-06 -3.54008 63.546000 Cu 0.659955 0.275046 1.49895e-19 633 63.546 1.93269e-05 -3.53999 63.546000 Cu 0.649977 0.257544 0.5 634 63.546 2.82749e-06 -3.54022 63.546000 Cu 0.589955 0.277547 0.5 635 63.546 1.01113e-05 -3.53991 63.546000 Cu 0.719981 0.255038 4.1551e-17 636 63.546 1.13266e-06 -3.54028 63.546000 Cu 0.799999 0.270031 4.5868e-18 637 63.546 1.05643e-05 -3.53999 63.546000 Cu 0.789991 0.252531 0.5 638 63.546 1.12979e-06 -3.54026 63.546000 Cu 0.729975 0.272538 0.5 639 63.546 1.76897e-05 -3.54002 63.546000 Cu 0.999989 0.245034 1 586 63.546 1.18559e-06 -3.54 63.546000 Cu 0.859998 0.250026 2.89298e-17 582 63.546 2.36097e-06 -3.54017 63.546000 Cu 0.940011 0.265031 1.66084e-17 583 63.546 3.17836e-06 -3.53989 63.546000 Cu 0.929997 0.247528 0.5 584 63.546 1.80125e-06 -3.54007 63.546000 Cu 0.870013 0.267528 0.5 585 63.546 5.51789e-06 -3.53992 63.546000 Cu 0.0199803 0.280041 1.09424e-17 616 63.546 3.96414e-06 -3.53982 63.546000 Cu 0.0999217 0.295046 2.77606e-17 617 63.546 3.49004e-05 -3.53994 63.546000 Cu 0.0299387 0.297552 0.5 619 63.546 2.25873e-05 -3.53997 63.546000 Cu 0.0399074 0.315071 5.99282e-17 644 63.546 6.87426e-05 -3.5402 63.546000 Cu 0.109932 0.312547 0.5 646 63.546 3.97389e-05 -3.54021 63.546000 Cu 0.24 0.290019 1.03098e-16 621 63.546 4.13738e-06 -3.53977 63.546000 Cu 0.169949 0.292532 0.5 623 63.546 1.77904e-05 -3.53984 63.546000 Cu 0.31004 0.287515 0.5 627 63.546 1.60877e-05 -3.53972 63.546000 Cu 0.179985 0.310016 0 648 63.546 3.00235e-05 -3.54005 63.546000 Cu 0.250041 0.307499 0.5 650 63.546 6.4963e-05 -3.53987 63.546000 Cu 0.320073 0.305002 8.99373e-20 652 63.546 9.15525e-05 -3.53979 63.546000 Cu 0.380046 0.28502 5.99582e-20 625 63.546 2.52249e-05 -3.53971 63.546000 Cu 0.450019 0.28253 0.5 631 63.546 1.37663e-05 -3.53974 63.546000 Cu 0.390053 0.302523 0.5 654 63.546 5.62381e-05 -3.53982 63.546000 Cu 0.459997 0.300043 3.60349e-17 656 63.546 1.49157e-05 -3.53992 63.546000 Cu 0.469921 0.317573 0.5 659 63.546 4.26016e-05 -3.54003 63.546000 Cu 0.51998 0.280041 5.72301e-17 629 63.546 3.96414e-06 -3.53982 63.546000 Cu 0.539907 0.315071 3.59149e-17 657 63.546 6.87426e-05 -3.5402 63.546000 Cu 0.529939 0.297552 0.5 658 63.546 2.25873e-05 -3.53997 63.546000 Cu 0.599922 0.295046 0 660 63.546 3.49004e-05 -3.53994 63.546000 Cu 0.609932 0.312547 0.5 663 63.546 3.97389e-05 -3.54021 63.546000 Cu 0.679985 0.310016 2.39833e-18 661 63.546 3.00235e-05 -3.54005 63.546000 Cu 0.669949 0.292532 0.5 662 63.546 1.77904e-05 -3.53984 63.546000 Cu 0.74 0.290019 6.93716e-17 664 63.546 4.13738e-06 -3.53977 63.546000 Cu 0.820073 0.305002 0 665 63.546 9.15525e-05 -3.53979 63.546000 Cu 0.81004 0.287515 0.5 666 63.546 1.60877e-05 -3.53972 63.546000 Cu 0.750041 0.307499 0.5 667 63.546 6.4963e-05 -3.53987 63.546000 Cu 0.880046 0.28502 2.09854e-19 612 63.546 2.52249e-05 -3.53971 63.546000 Cu 0.959997 0.300043 8.27723e-17 613 63.546 1.49157e-05 -3.53992 63.546000 Cu 0.950019 0.28253 0.5 614 63.546 1.37663e-05 -3.53974 63.546000 Cu 0.890053 0.302523 0.5 615 63.546 5.62381e-05 -3.53982 63.546000 Cu 0.969921 0.317573 0.5 642 63.546 4.26016e-05 -3.54003 63.546000 Cu 0.120007 0.330047 0 645 63.546 2.59281e-05 -3.54035 63.546000 Cu 0.0498919 0.332584 0.5 647 63.546 0.000111924 -3.54043 63.546000 Cu 0.0599342 0.350078 0 673 63.546 0.000131569 -3.54058 63.546000 Cu 0.130137 0.347534 0.5 675 63.546 7.65986e-05 -3.54019 63.546000 Cu 0.260102 0.325001 2.09854e-19 649 63.546 0.000150473 -3.53986 63.546000 Cu 0.190094 0.327513 0.5 651 63.546 5.60005e-05 -3.54012 63.546000 Cu 0.330053 0.322517 0.5 655 63.546 0.000114623 -3.53977 63.546000 Cu 0.200233 0.345017 5.99582e-20 677 63.546 0.00025307 -3.53979 63.546000 Cu 0.270171 0.342532 0.5 679 63.546 0.000226825 -3.53958 63.546000 Cu 0.399978 0.32005 8.99373e-20 653 63.546 1.78577e-05 -3.53983 63.546000 Cu 0.339995 0.340066 5.27632e-18 681 63.546 5.97287e-05 -3.53968 63.546000 Cu 0.419759 0.35516 5.1534e-17 682 63.546 0.000356462 -3.54029 63.546000 Cu 0.409853 0.337595 0.5 683 63.546 8.28031e-05 -3.53999 63.546000 Cu 0.349924 0.357647 0.5 684 63.546 8.84961e-05 -3.53962 63.546000 Cu 0.479815 0.335103 0 685 63.546 0.000161566 -3.54029 63.546000 Cu 0.489769 0.35263 0.5 688 63.546 0.000400729 -3.54067 63.546000 Cu 0.559934 0.350078 4.93456e-17 686 63.546 0.000131569 -3.54058 63.546000 Cu 0.549892 0.332584 0.5 687 63.546 0.000111924 -3.54043 63.546000 Cu 0.620007 0.330047 5.99582e-20 689 63.546 2.59281e-05 -3.54035 63.546000 Cu 0.630137 0.347534 0.5 692 63.546 7.65986e-05 -3.54019 63.546000 Cu 0.700233 0.345017 0 690 63.546 0.00025307 -3.53979 63.546000 Cu 0.690094 0.327513 0.5 691 63.546 5.60005e-05 -3.54012 63.546000 Cu 0.760102 0.325001 2.04457e-17 693 63.546 0.000150473 -3.53986 63.546000 Cu 0.830053 0.322517 0.5 695 63.546 0.000114623 -3.53977 63.546000 Cu 0.770171 0.342532 0.5 696 63.546 0.000226825 -3.53958 63.546000 Cu 0.899978 0.32005 1.49895e-19 640 63.546 1.78577e-05 -3.53983 63.546000 Cu 0.979815 0.335103 1.19916e-19 641 63.546 0.000161566 -3.54029 63.546000 Cu 0.909853 0.337595 0.5 643 63.546 8.28031e-05 -3.53999 63.546000 Cu 0.919759 0.35516 5.99582e-20 669 63.546 0.000356462 -3.54029 63.546000 Cu 0.989769 0.35263 0.5 671 63.546 0.000400729 -3.54067 63.546000 Cu 0.839995 0.340066 1.37904e-16 694 63.546 5.97287e-05 -3.53968 63.546000 Cu 0.849924 0.357647 0.5 724 63.546 8.84961e-05 -3.53962 63.546000 Cu 0.140335 0.365008 1.19467e-16 674 63.546 0.000498878 -3.53985 63.546000 Cu 0.0701244 0.367537 0.5 676 63.546 0.000132411 -3.54036 63.546000 Cu 0.0100705 0.387543 0.5 701 63.546 0.00041306 -3.54006 63.546000 Cu 0.0804072 0.384962 0 703 63.546 0.000931408 -3.5396 63.546000 Cu 0.150539 0.382496 0.5 705 63.546 0.00149362 -3.53925 63.546000 Cu 0.280162 0.360098 1.49895e-19 678 63.546 0.000186647 -3.53921 63.546000 Cu 0.210342 0.362538 0.5 680 63.546 0.000553858 -3.53934 63.546000 Cu 0.220396 0.380102 8.99373e-20 707 63.546 0.000860564 -3.53901 63.546000 Cu 0.299857 0.395377 2.09854e-19 708 63.546 0.0014835 -3.54058 63.546000 Cu 0.290073 0.377705 0.5 709 63.546 0.00020635 -3.53925 63.546000 Cu 0.230239 0.397738 0.5 710 63.546 0.000971028 -3.53944 63.546000 Cu 0.359764 0.37525 6.13072e-17 711 63.546 0.000705094 -3.53979 63.546000 Cu 0.439721 0.39021 1.30109e-17 712 63.546 0.00177205 -3.54053 63.546000 Cu 0.429677 0.372711 0.5 713 63.546 0.00109303 -3.54044 63.546000 Cu 0.36964 0.392859 0.5 714 63.546 0.00280524 -3.54079 63.546000 Cu 0.499846 0.370119 1.97862e-17 715 63.546 0.000448423 -3.54063 63.546000 Cu 0.580407 0.384962 6.46349e-17 716 63.546 0.000931408 -3.5396 63.546000 Cu 0.570124 0.367537 0.5 717 63.546 0.000132411 -3.54036 63.546000 Cu 0.51007 0.387543 0.5 718 63.546 0.00041306 -3.54006 63.546000 Cu 0.640335 0.365008 5.27632e-17 719 63.546 0.000498878 -3.53985 63.546000 Cu 0.650539 0.382496 0.5 722 63.546 0.00149362 -3.53925 63.546000 Cu 0.720396 0.380102 7.19498e-18 720 63.546 0.000860564 -3.53901 63.546000 Cu 0.710342 0.362538 0.5 721 63.546 0.000553858 -3.53934 63.546000 Cu 0.780162 0.360098 2.99791e-19 723 63.546 0.000186647 -3.53921 63.546000 Cu 0.790073 0.377705 0.5 725 63.546 0.00020635 -3.53925 63.546000 Cu 0.730239 0.397738 0.5 750 63.546 0.000971028 -3.53944 63.546000 Cu 0.799857 0.395377 0 752 63.546 0.0014835 -3.54058 63.546000 Cu 0.999846 0.370119 0 670 63.546 0.000448423 -3.54063 63.546000 Cu 0.859764 0.37525 0 668 63.546 0.000705094 -3.53979 63.546000 Cu 0.929677 0.372711 0.5 672 63.546 0.00109303 -3.54044 63.546000 Cu 0.86964 0.392859 0.5 698 63.546 0.00280524 -3.54079 63.546000 Cu 0.939721 0.39021 2.09854e-19 699 63.546 0.00177205 -3.54053 63.546000 Cu 0.02053 0.404919 2.99791e-20 700 63.546 0.00264613 -3.53829 63.546000 Cu 0.160577 0.400024 0 704 63.546 0.00324152 -3.53845 63.546000 Cu 0.0906494 0.402384 0.5 706 63.546 0.00405409 -3.53796 63.546000 Cu 0.0313771 0.422332 0.5 730 63.546 0.012507 -3.53481 63.546000 Cu 0.100747 0.419888 5.33628e-17 732 63.546 0.0145085 -3.5343 63.546000 Cu 0.110419 0.437705 0.5 735 63.546 0.0316731 -3.52467 63.546000 Cu 0.0429155 0.439978 1.49296e-16 729 63.546 0.0412059 -3.52703 63.546000 Cu 0.178511 0.435486 1.5739e-17 733 63.546 0.0169778 -3.53417 63.546000 Cu 0.170051 0.417664 0.5 734 63.546 0.00413529 -3.53764 63.546000 Cu 0.239568 0.415455 5.99582e-20 736 63.546 0.00377125 -3.54117 63.546000 Cu 0.319173 0.430543 5.27332e-17 737 63.546 0.0234435 -3.5446 63.546000 Cu 0.309526 0.413056 0.5 738 63.546 0.00931231 -3.54321 63.546000 Cu 0.248074 0.433155 0.5 739 63.546 0.0241205 -3.54256 63.546000 Cu 0.379848 0.410413 0 740 63.546 0.00601148 -3.54244 63.546000 Cu 0.461551 0.425004 0 741 63.546 0.00507486 -3.53899 63.546000 Cu 0.450215 0.40764 0.5 742 63.546 0.00146365 -3.5402 63.546000 Cu 0.390658 0.427783 0.5 743 63.546 0.0110926 -3.54297 63.546000 Cu 0.52053 0.404919 0 744 63.546 0.00264613 -3.53829 63.546000 Cu 0.600747 0.419888 8.99373e-20 745 63.546 0.0145085 -3.5343 63.546000 Cu 0.590649 0.402384 0.5 746 63.546 0.00405409 -3.53796 63.546000 Cu 0.531377 0.422332 0.5 747 63.546 0.012507 -3.53481 63.546000 Cu 0.660577 0.400024 7.07506e-17 748 63.546 0.00324152 -3.53845 63.546000 Cu 0.610419 0.437705 0.5 774 63.546 0.0316731 -3.52467 63.546000 Cu 0.542916 0.439978 5.99582e-20 772 63.546 0.0412059 -3.52703 63.546000 Cu 0.739568 0.415455 2.99791e-20 749 63.546 0.00377125 -3.54117 63.546000 Cu 0.670051 0.417664 0.5 751 63.546 0.00413529 -3.53764 63.546000 Cu 0.809526 0.413056 0.5 753 63.546 0.00931231 -3.54321 63.546000 Cu 0.678511 0.435486 0 776 63.546 0.0169778 -3.53417 63.546000 Cu 0.748074 0.433155 0.5 778 63.546 0.0241205 -3.54256 63.546000 Cu 0.819173 0.430543 5.60909e-17 780 63.546 0.0234435 -3.5446 63.546000 Cu 0.879848 0.410413 0 697 63.546 0.00601148 -3.54244 63.546000 Cu 0.950215 0.40764 0.5 702 63.546 0.00146365 -3.5402 63.546000 Cu 0.890658 0.427783 0.5 727 63.546 0.0110926 -3.54297 63.546000 Cu 0.961551 0.425004 3.71741e-17 728 63.546 0.00507486 -3.53899 63.546000 Cu 0.0642536 0.476748 5.46818e-17 757 63.546 0.216975 -3.52702 63.546000 Cu 0.0546302 0.458247 0.5 758 63.546 0.109523 -3.52187 63.546000 Cu 0.120111 0.456164 0 760 63.546 0.0522934 -3.4993 63.546000 Cu 0.131764 0.475845 0.5 763 63.546 0.39979 -3.46835 63.546000 Cu 0.194415 0.472179 5.25833e-17 761 63.546 0.897907 -3.41655 63.546000 Cu 0.185982 0.453555 0.5 762 63.546 0.155854 -3.50994 63.546000 Cu 0.25608 0.450611 0 764 63.546 0.0954569 -3.53503 63.546000 Cu 0.32872 0.447568 0.5 766 63.546 0.0269267 -3.53672 63.546000 Cu 0.26402 0.467429 0.5 767 63.546 0.84733 -3.44731 63.546000 Cu 0.339121 0.463934 8.23226e-17 765 63.546 0.043061 -3.51401 63.546000 Cu 0.402133 0.444804 1.13921e-18 768 63.546 0.0268531 -3.53693 63.546000 Cu 0.485746 0.459658 1.49895e-19 769 63.546 0.157209 -3.52501 63.546000 Cu 0.473658 0.442364 0.5 770 63.546 0.042012 -3.53761 63.546000 Cu 0.412704 0.461523 0.5 771 63.546 0.0674763 -3.53047 63.546000 Cu 0.494265 0.47727 0.5 793 63.546 0.174361 -3.53116 63.546000 Cu 0.423299 0.477816 1.09843e-16 791 63.546 0.36633 -3.49863 63.546000 Cu 0.631764 0.475845 0.5 398 63.546 0.39979 -3.46835 63.546000 Cu 0.620111 0.456164 0 773 63.546 0.0522934 -3.4993 63.546000 Cu 0.55463 0.458247 0.5 775 63.546 0.109523 -3.52187 63.546000 Cu 0.564254 0.476748 0 795 63.546 0.216975 -3.52702 63.546000 Cu 0.76402 0.467429 0.5 11 63.546 0.84733 -3.44731 63.546000 Cu 0.694415 0.472179 9.07767e-17 387 63.546 0.897907 -3.41655 63.546000 Cu 0.75608 0.450611 1.19916e-19 777 63.546 0.0954569 -3.53503 63.546000 Cu 0.685982 0.453555 0.5 779 63.546 0.155854 -3.50994 63.546000 Cu 0.82872 0.447568 0.5 781 63.546 0.0269267 -3.53672 63.546000 Cu 0.839121 0.463934 1.09094e-16 3 63.546 0.043061 -3.51401 63.546000 Cu 0.902133 0.444804 3.80135e-17 726 63.546 0.0268531 -3.53693 63.546000 Cu 0.973658 0.442364 0.5 731 63.546 0.042012 -3.53761 63.546000 Cu 0.912704 0.461523 0.5 755 63.546 0.0674763 -3.53047 63.546000 Cu 0.985746 0.459658 3.74139e-17 756 63.546 0.157209 -3.52501 63.546000 Cu 0.994265 0.47727 0.5 759 63.546 0.174361 -3.53116 63.546000 Cu 0.923299 0.477816 0 754 63.546 0.36633 -3.49863 63.546000 Cu 0.0640766 0.513204 0 6 63.546 0.213324 -3.5267 63.546000 Cu 0.131663 0.514058 0.5 8 63.546 0.439159 -3.46365 63.546000 Cu 0.0679561 0.494962 0.5 785 63.546 0.25528 -3.52827 63.546000 Cu 0.141299 0.494978 2.69812e-19 786 63.546 1.67867 -3.4993 63.546000 Cu 0.194157 0.517774 2.99791e-19 10 63.546 1.0043 -3.40621 63.546000 Cu 0.275291 0.506372 2.69812e-19 12 63.546 9.27141 -3.28998 63.546000 Cu 0.214023 0.494634 0.5 787 63.546 7.9073 -3.44886 63.546000 Cu 0.275972 0.483373 4.75768e-17 788 63.546 9.14654 -3.28703 63.546000 Cu 0.34647 0.509838 0.5 14 63.546 4.37656 -3.43685 63.546000 Cu 0.423106 0.512092 0 16 63.546 0.385422 -3.49684 63.546000 Cu 0.494055 0.512652 0.5 18 63.546 0.176013 -3.53023 63.546000 Cu 0.358938 0.494945 3.16879e-17 789 63.546 6.22293 -3.2238 63.546000 Cu 0.346964 0.480006 0.5 790 63.546 4.29959 -3.43893 63.546000 Cu 0.42711 0.494953 0.5 794 63.546 0.476237 -3.51321 63.546000 Cu 0.496959 0.494971 6.22666e-17 792 63.546 0.123309 -3.53848 63.546000 Cu 0.564077 0.513204 7.3149e-18 20 63.546 0.213324 -3.5267 63.546000 Cu 0.631663 0.514058 0.5 22 63.546 0.439159 -3.46365 63.546000 Cu 0.567956 0.494962 0.5 397 63.546 0.25528 -3.52827 63.546000 Cu 0.641299 0.494978 0 796 63.546 1.67867 -3.4993 63.546000 Cu 0.775291 0.506372 1.42311e-16 2 63.546 9.27141 -3.28998 63.546000 Cu 0.714023 0.494634 0.5 9 63.546 7.9073 -3.44886 63.546000 Cu 0.694157 0.517774 0 24 63.546 1.0043 -3.40621 63.546000 Cu 0.775972 0.483373 0 385 63.546 9.14654 -3.28703 63.546000 Cu 0.996959 0.494971 1.99661e-17 784 63.546 0.123309 -3.53848 63.546000 Cu 0.846964 0.480006 0.5 1 63.546 4.29959 -3.43893 63.546000 Cu 0.923106 0.512092 0 4 63.546 0.385422 -3.49684 63.546000 Cu 0.84647 0.509838 0.5 5 63.546 4.37656 -3.43685 63.546000 Cu 0.994055 0.512652 0.5 7 63.546 0.176013 -3.53023 63.546000 Cu 0.858938 0.494945 1.07625e-17 782 63.546 6.22293 -3.2238 63.546000 Cu 0.92711 0.494953 0.5 783 63.546 0.476237 -3.51321 63.546000 Cu 0.0424291 0.549928 5.41422e-17 33 63.546 0.0391834 -3.52684 63.546000 Cu 0.0543125 0.531671 0.5 34 63.546 0.111507 -3.52166 63.546000 Cu 0.119835 0.533789 0 36 63.546 0.0577297 -3.49924 63.546000 Cu 0.110066 0.552197 0.5 37 63.546 0.0300152 -3.52518 63.546000 Cu 0.263635 0.5224 0.5 15 63.546 0.930502 -3.44519 63.546000 Cu 0.178225 0.554437 0 38 63.546 0.016159 -3.53422 63.546000 Cu 0.185759 0.536369 0.5 39 63.546 0.149563 -3.50949 63.546000 Cu 0.255797 0.539293 2.69812e-19 40 63.546 0.0874013 -3.53587 63.546000 Cu 0.318814 0.559366 2.69812e-19 41 63.546 0.0223915 -3.54437 63.546000 Cu 0.328273 0.542305 0.5 42 63.546 0.0266121 -3.53759 63.546000 Cu 0.247807 0.556779 0.5 43 63.546 0.0203824 -3.54234 63.546000 Cu 0.338563 0.525884 0 13 63.546 0.039156 -3.5148 63.546000 Cu 0.485331 0.530271 8.21427e-18 17 63.546 0.156844 -3.52406 63.546000 Cu 0.412145 0.528349 0.5 19 63.546 0.0641952 -3.53043 63.546000 Cu 0.401562 0.545073 1.79875e-19 44 63.546 0.0235718 -3.53766 63.546000 Cu 0.473161 0.547536 0.5 46 63.546 0.0409273 -3.53767 63.546000 Cu 0.619835 0.533789 0 21 63.546 0.0577297 -3.49924 63.546000 Cu 0.554313 0.531671 0.5 23 63.546 0.111507 -3.52166 63.546000 Cu 0.542429 0.549928 1.19916e-19 48 63.546 0.0391834 -3.52684 63.546000 Cu 0.610066 0.552197 0.5 50 63.546 0.0300152 -3.52518 63.546000 Cu 0.755797 0.539293 0 25 63.546 0.0874013 -3.53587 63.546000 Cu 0.763635 0.5224 0.5 26 63.546 0.930502 -3.44519 63.546000 Cu 0.685759 0.536369 0.5 27 63.546 0.149563 -3.50949 63.546000 Cu 0.828273 0.542305 0.5 31 63.546 0.0266121 -3.53759 63.546000 Cu 0.678225 0.554437 4.19108e-17 52 63.546 0.016159 -3.53422 63.546000 Cu 0.747807 0.556779 0.5 54 63.546 0.0203824 -3.54234 63.546000 Cu 0.818814 0.559366 3.40562e-17 56 63.546 0.0223915 -3.54437 63.546000 Cu 0.838563 0.525884 1.73279e-17 28 63.546 0.039156 -3.5148 63.546000 Cu 0.901562 0.545073 6.05278e-17 29 63.546 0.0235718 -3.53766 63.546000 Cu 0.912145 0.528349 0.5 30 63.546 0.0641952 -3.53043 63.546000 Cu 0.985331 0.530271 5.23135e-17 32 63.546 0.156844 -3.52406 63.546000 Cu 0.973161 0.547536 0.5 35 63.546 0.0409273 -3.53767 63.546000 Cu 0.0201992 0.584966 1.5742e-16 61 63.546 0.00225908 -3.53833 63.546000 Cu 0.0309715 0.567561 0.5 62 63.546 0.0122319 -3.53517 63.546000 Cu 0.100436 0.57001 4.16709e-17 64 63.546 0.0139731 -3.53467 63.546000 Cu 0.0904138 0.587514 0.5 65 63.546 0.00424656 -3.53808 63.546000 Cu 0.160376 0.589886 7.98943e-17 66 63.546 0.0033961 -3.53866 63.546000 Cu 0.169743 0.572243 0.5 67 63.546 0.00354799 -3.53776 63.546000 Cu 0.239345 0.574475 0 68 63.546 0.00303404 -3.54113 63.546000 Cu 0.299722 0.59455 7.26093e-17 69 63.546 0.00126378 -3.54027 63.546000 Cu 0.309295 0.576875 0.5 70 63.546 0.00796299 -3.54279 63.546000 Cu 0.230106 0.592187 0.5 71 63.546 0.00117471 -3.53957 63.546000 Cu 0.461107 0.564884 0 45 63.546 0.00460635 -3.53893 63.546000 Cu 0.390247 0.562107 0.5 47 63.546 0.0111998 -3.54296 63.546000 Cu 0.379542 0.579492 0 72 63.546 0.00619222 -3.54223 63.546000 Cu 0.439548 0.599692 1.16918e-17 73 63.546 0.00177824 -3.54052 63.546000 Cu 0.449878 0.582245 0.5 74 63.546 0.00184334 -3.53998 63.546000 Cu 0.369498 0.597063 0.5 75 63.546 0.00227383 -3.54073 63.546000 Cu 0.600436 0.57001 5.8789e-17 49 63.546 0.0139731 -3.53467 63.546000 Cu 0.530971 0.567561 0.5 51 63.546 0.0122319 -3.53517 63.546000 Cu 0.520199 0.584966 0 76 63.546 0.00225908 -3.53833 63.546000 Cu 0.590414 0.587514 0.5 78 63.546 0.00424656 -3.53808 63.546000 Cu 0.660376 0.589886 0 80 63.546 0.0033961 -3.53866 63.546000 Cu 0.739345 0.574475 1.79875e-19 53 63.546 0.00303404 -3.54113 63.546000 Cu 0.669743 0.572243 0.5 55 63.546 0.00354799 -3.53776 63.546000 Cu 0.809295 0.576875 0.5 59 63.546 0.00796299 -3.54279 63.546000 Cu 0.730106 0.592187 0.5 82 63.546 0.00117471 -3.53957 63.546000 Cu 0.799722 0.59455 0 84 63.546 0.00126378 -3.54027 63.546000 Cu 0.879542 0.579492 0 57 63.546 0.00619222 -3.54223 63.546000 Cu 0.890247 0.562107 0.5 58 63.546 0.0111998 -3.54296 63.546000 Cu 0.961107 0.564884 1.04447e-16 60 63.546 0.00460635 -3.53893 63.546000 Cu 0.949878 0.582245 0.5 63 63.546 0.00184334 -3.53998 63.546000 Cu 0.869498 0.597063 0.5 86 63.546 0.00227383 -3.54073 63.546000 Cu 0.939548 0.599692 0 88 63.546 0.00177824 -3.54052 63.546000 Cu 0.00984423 0.602342 0.5 90 63.546 0.000555757 -3.54001 63.546000 Cu 0.0802012 0.604925 1.79275e-17 92 63.546 0.000604269 -3.53951 63.546000 Cu 0.0700368 0.622357 0.5 93 63.546 0.000138056 -3.54033 63.546000 Cu 0.140194 0.624889 1.17638e-16 94 63.546 0.000258028 -3.53974 63.546000 Cu 0.150397 0.607407 0.5 95 63.546 0.00144112 -3.53916 63.546000 Cu 0.0599139 0.639844 1.46898e-18 120 63.546 9.53576e-05 -3.54053 63.546000 Cu 0.220293 0.60982 1.1419e-16 96 63.546 0.00109049 -3.53907 63.546000 Cu 0.280085 0.629843 1.62577e-16 97 63.546 0.000316282 -3.53932 63.546000 Cu 0.289982 0.612227 0.5 98 63.546 0.000239631 -3.53945 63.546000 Cu 0.210188 0.627379 0.5 99 63.546 0.000413454 -3.53934 63.546000 Cu 0.359701 0.614688 1.19916e-19 100 63.546 0.000494979 -3.54003 63.546000 Cu 0.419817 0.634784 2.39833e-19 101 63.546 0.000185622 -3.54026 63.546000 Cu 0.429636 0.617218 0.5 102 63.546 0.000815821 -3.54054 63.546000 Cu 0.349918 0.632301 0.5 103 63.546 8.262e-05 -3.53967 63.546000 Cu 0.489812 0.637303 0.5 107 63.546 0.000257522 -3.54061 63.546000 Cu 0.499809 0.61979 1.03937e-16 104 63.546 0.000412295 -3.54065 63.546000 Cu 0.580201 0.604925 9.92308e-17 77 63.546 0.000604269 -3.53951 63.546000 Cu 0.509844 0.602342 0.5 79 63.546 0.000555757 -3.54001 63.546000 Cu 0.650397 0.607407 0.5 83 63.546 0.00144112 -3.53916 63.546000 Cu 0.559914 0.639844 2.09854e-19 105 63.546 9.53576e-05 -3.54053 63.546000 Cu 0.570037 0.622357 0.5 106 63.546 0.000138056 -3.54033 63.546000 Cu 0.640194 0.624889 5.22535e-17 108 63.546 0.000258028 -3.53974 63.546000 Cu 0.720293 0.60982 3.33068e-17 81 63.546 0.00109049 -3.53907 63.546000 Cu 0.789982 0.612227 0.5 87 63.546 0.000239631 -3.53945 63.546000 Cu 0.710188 0.627379 0.5 110 63.546 0.000413454 -3.53934 63.546000 Cu 0.780085 0.629843 1.43e-17 112 63.546 0.000316282 -3.53932 63.546000 Cu 0.999809 0.61979 1.38503e-17 89 63.546 0.000412295 -3.54065 63.546000 Cu 0.859701 0.614688 0 85 63.546 0.000494979 -3.54003 63.546000 Cu 0.929636 0.617218 0.5 91 63.546 0.000815821 -3.54054 63.546000 Cu 0.849918 0.632301 0.5 114 63.546 8.262e-05 -3.53967 63.546000 Cu 0.919817 0.634784 3.7294e-17 116 63.546 0.000185622 -3.54026 63.546000 Cu 0.989812 0.637303 0.5 118 63.546 0.000257522 -3.54061 63.546000 Cu 0.119971 0.659886 0 121 63.546 1.98866e-05 -3.54024 63.546000 Cu 0.130026 0.64238 0.5 122 63.546 3.53625e-05 -3.5401 63.546000 Cu 0.049886 0.657363 0.5 123 63.546 7.27677e-05 -3.54036 63.546000 Cu 0.0399325 0.674896 0 148 63.546 2.46509e-05 -3.54014 63.546000 Cu 0.109951 0.677409 0.5 150 63.546 1.39288e-05 -3.54023 63.546000 Cu 0.200101 0.644897 7.58771e-17 124 63.546 8.34208e-05 -3.53971 63.546000 Cu 0.260037 0.664926 5.41122e-17 125 63.546 3.72019e-05 -3.53993 63.546000 Cu 0.270089 0.647393 0.5 126 63.546 0.00011311 -3.53954 63.546000 Cu 0.190036 0.662411 0.5 127 63.546 1.48875e-05 -3.54008 63.546000 Cu 0.329997 0.667427 0.5 131 63.546 5.32434e-05 -3.53982 63.546000 Cu 0.179973 0.679931 1.03668e-16 152 63.546 6.22812e-06 -3.54018 63.546000 Cu 0.340007 0.649876 2.94694e-17 128 63.546 6.18706e-05 -3.53968 63.546000 Cu 0.399948 0.669914 0 129 63.546 2.83037e-05 -3.53983 63.546000 Cu 0.409902 0.652359 0.5 130 63.546 2.21299e-05 -3.54001 63.546000 Cu 0.479849 0.654852 6.68234e-17 132 63.546 7.49167e-05 -3.5403 63.546000 Cu 0.469932 0.6724 0.5 135 63.546 1.22052e-05 -3.53997 63.546000 Cu 0.630026 0.64238 0.5 111 63.546 3.53625e-05 -3.5401 63.546000 Cu 0.539932 0.674896 0 133 63.546 2.46509e-05 -3.54014 63.546000 Cu 0.549886 0.657363 0.5 134 63.546 7.27677e-05 -3.54036 63.546000 Cu 0.619971 0.659886 0 136 63.546 1.98866e-05 -3.54024 63.546000 Cu 0.609951 0.677409 0.5 139 63.546 1.39288e-05 -3.54023 63.546000 Cu 0.700101 0.644897 1.49895e-19 109 63.546 8.34208e-05 -3.53971 63.546000 Cu 0.770089 0.647393 0.5 115 63.546 0.00011311 -3.53954 63.546000 Cu 0.679973 0.679931 1.05826e-17 137 63.546 6.22812e-06 -3.54018 63.546000 Cu 0.690036 0.662411 0.5 138 63.546 1.48875e-05 -3.54008 63.546000 Cu 0.760037 0.664926 2.56621e-17 140 63.546 3.72019e-05 -3.53993 63.546000 Cu 0.829997 0.667427 0.5 142 63.546 5.32434e-05 -3.53982 63.546000 Cu 0.840007 0.649876 1.08224e-16 113 63.546 6.18706e-05 -3.53968 63.546000 Cu 0.979849 0.654852 0 117 63.546 7.49167e-05 -3.5403 63.546000 Cu 0.909902 0.652359 0.5 119 63.546 2.21299e-05 -3.54001 63.546000 Cu 0.899948 0.669914 4.17309e-17 144 63.546 2.83037e-05 -3.53983 63.546000 Cu 0.969932 0.6724 0.5 146 63.546 1.22052e-05 -3.53997 63.546000 Cu 0.0999317 0.694936 0 149 63.546 1.57737e-05 -3.53999 63.546000 Cu 0.0299455 0.692428 0.5 151 63.546 8.65585e-06 -3.53992 63.546000 Cu 0.0199678 0.709954 5.99582e-20 176 63.546 3.02201e-06 -3.53984 63.546000 Cu 0.0899512 0.712453 0.5 178 63.546 9.05754e-06 -3.53986 63.546000 Cu 0.159964 0.714958 7.61469e-18 180 63.546 8.37461e-06 -3.53988 63.546000 Cu 0.239999 0.699961 0 153 63.546 6.23769e-06 -3.53992 63.546000 Cu 0.250004 0.68245 0.5 154 63.546 2.57642e-05 -3.54002 63.546000 Cu 0.169954 0.697449 0.5 155 63.546 1.14751e-05 -3.53999 63.546000 Cu 0.32002 0.684954 0 156 63.546 2.95551e-05 -3.53985 63.546000 Cu 0.310034 0.702467 0.5 159 63.546 1.53316e-05 -3.53987 63.546000 Cu 0.229989 0.717466 0.5 182 63.546 5.82629e-06 -3.53988 63.546000 Cu 0.300011 0.719975 3.18678e-17 184 63.546 3.65519e-06 -3.53987 63.546000 Cu 0.380036 0.704966 5.76798e-17 157 63.546 1.62433e-05 -3.53983 63.546000 Cu 0.390015 0.687445 0.5 158 63.546 1.47568e-05 -3.53979 63.546000 Cu 0.459982 0.689932 0 160 63.546 4.78616e-06 -3.53982 63.546000 Cu 0.450005 0.707459 0.5 163 63.546 3.6396e-06 -3.53983 63.546000 Cu 0.519968 0.709954 0 161 63.546 3.02201e-06 -3.53984 63.546000 Cu 0.529945 0.692428 0.5 162 63.546 8.65585e-06 -3.53992 63.546000 Cu 0.599932 0.694936 0 164 63.546 1.57737e-05 -3.53999 63.546000 Cu 0.659964 0.714958 5.99582e-20 165 63.546 8.37461e-06 -3.53988 63.546000 Cu 0.589951 0.712453 0.5 167 63.546 9.05754e-06 -3.53986 63.546000 Cu 0.82002 0.684954 9.1736e-18 141 63.546 2.95551e-05 -3.53985 63.546000 Cu 0.750004 0.68245 0.5 143 63.546 2.57642e-05 -3.54002 63.546000 Cu 0.669954 0.697449 0.5 166 63.546 1.14751e-05 -3.53999 63.546000 Cu 0.739999 0.699961 5.99582e-20 168 63.546 6.23769e-06 -3.53992 63.546000 Cu 0.800011 0.719975 4.67974e-17 169 63.546 3.65519e-06 -3.53987 63.546000 Cu 0.810034 0.702467 0.5 170 63.546 1.53316e-05 -3.53987 63.546000 Cu 0.729989 0.717466 0.5 171 63.546 5.82629e-06 -3.53988 63.546000 Cu 0.959982 0.689932 0 145 63.546 4.78616e-06 -3.53982 63.546000 Cu 0.890015 0.687445 0.5 147 63.546 1.47568e-05 -3.53979 63.546000 Cu 0.880036 0.704966 2.55722e-17 172 63.546 1.62433e-05 -3.53983 63.546000 Cu 0.950005 0.707459 0.5 174 63.546 3.6396e-06 -3.53983 63.546000 Cu 0.0799919 0.729974 2.27841e-17 177 63.546 4.06848e-06 -3.53998 63.546000 Cu 0.0100014 0.727477 0.5 179 63.546 2.18689e-06 -3.5399 63.546000 Cu 0.149989 0.732475 0.5 183 63.546 8.73742e-06 -3.54005 63.546000 Cu 1.16673e-05 0.745002 1.49895e-19 204 63.546 8.39517e-07 -3.54 63.546000 Cu 0.070011 0.747501 0.5 206 63.546 1.6988e-06 -3.54006 63.546000 Cu 0.140014 0.750003 6.96414e-17 209 63.546 2.32782e-06 -3.54015 63.546000 Cu 0.219994 0.734981 0 181 63.546 1.13356e-05 -3.54008 63.546000 Cu 0.290002 0.737491 0.5 187 63.546 1.00977e-05 -3.54008 63.546000 Cu 0.210021 0.752511 0.5 211 63.546 1.2622e-06 -3.54023 63.546000 Cu 0.280028 0.755021 0 212 63.546 7.8468e-07 -3.54025 63.546000 Cu 0.360009 0.739998 1.79875e-19 185 63.546 6.43689e-06 -3.54004 63.546000 Cu 0.370019 0.72248 0.5 186 63.546 3.74324e-06 -3.53985 63.546000 Cu 0.440013 0.724981 0 188 63.546 3.60868e-06 -3.53986 63.546000 Cu 0.430012 0.742502 0.5 191 63.546 2.52617e-06 -3.54 63.546000 Cu 0.35003 0.757529 0.5 214 63.546 1.71426e-06 -3.5402 63.546000 Cu 0.500012 0.745002 1.79875e-19 189 63.546 8.39517e-07 -3.54 63.546000 Cu 0.510001 0.727477 0.5 190 63.546 2.18689e-06 -3.5399 63.546000 Cu 0.579992 0.729974 8.99373e-20 192 63.546 4.06848e-06 -3.53998 63.546000 Cu 0.640014 0.750003 0 193 63.546 2.32782e-06 -3.54015 63.546000 Cu 0.649989 0.732475 0.5 194 63.546 8.73742e-06 -3.54005 63.546000 Cu 0.570011 0.747501 0.5 195 63.546 1.6988e-06 -3.54006 63.546000 Cu 0.719994 0.734981 2.94694e-17 196 63.546 1.13356e-05 -3.54008 63.546000 Cu 0.780028 0.755021 0 197 63.546 7.8468e-07 -3.54025 63.546000 Cu 0.790002 0.737491 0.5 198 63.546 1.00977e-05 -3.54008 63.546000 Cu 0.710021 0.752511 0.5 199 63.546 1.2622e-06 -3.54023 63.546000 Cu 0.940013 0.724981 0 173 63.546 3.60868e-06 -3.53986 63.546000 Cu 0.870019 0.72248 0.5 175 63.546 3.74324e-06 -3.53985 63.546000 Cu 0.860009 0.739998 1.79875e-19 200 63.546 6.43689e-06 -3.54004 63.546000 Cu 0.930012 0.742502 0.5 202 63.546 2.52617e-06 -3.54 63.546000 Cu 0.85003 0.757529 0.5 203 63.546 1.71426e-06 -3.5402 63.546000 Cu 0.0600082 0.765028 0 205 63.546 2.36983e-06 -3.53997 63.546000 Cu 0.130012 0.76753 0.5 208 63.546 4.03822e-06 -3.54 63.546000 Cu 0.050009 0.782554 0.5 234 63.546 7.78925e-06 -3.53983 63.546000 Cu 0.119992 0.785049 1.90667e-17 236 63.546 1.43582e-05 -3.5398 63.546000 Cu 0.200029 0.770038 2.56021e-17 210 63.546 1.04473e-05 -3.54006 63.546000 Cu 0.270052 0.772549 0.5 215 63.546 1.95493e-05 -3.54008 63.546000 Cu 0.190005 0.78755 0.5 239 63.546 8.54798e-06 -3.5398 63.546000 Cu 0.260044 0.790058 3.63646e-17 240 63.546 3.01338e-06 -3.5398 63.546000 Cu 0.330087 0.792572 0.5 242 63.546 1.64308e-05 -3.53983 63.546000 Cu 0.420025 0.760031 0 216 63.546 2.34247e-06 -3.54009 63.546000 Cu 0.340068 0.775059 0 213 63.546 2.03658e-05 -3.54004 63.546000 Cu 0.48004 0.780059 2.99791e-19 217 63.546 2.1834e-06 -3.53989 63.546000 Cu 0.490015 0.76253 0.5 218 63.546 2.40512e-06 -3.54 63.546000 Cu 0.410064 0.777562 0.5 219 63.546 9.17183e-06 -3.53996 63.546000 Cu 0.400104 0.795085 0 244 63.546 2.6419e-05 -3.53987 63.546000 Cu 0.470082 0.79759 0.5 246 63.546 1.25723e-05 -3.53989 63.546000 Cu 0.560008 0.765028 2.99791e-19 220 63.546 2.36983e-06 -3.53997 63.546000 Cu 0.619992 0.785049 5.42621e-17 221 63.546 1.43582e-05 -3.5398 63.546000 Cu 0.630012 0.76753 0.5 222 63.546 4.03822e-06 -3.54 63.546000 Cu 0.550009 0.782554 0.5 223 63.546 7.78925e-06 -3.53983 63.546000 Cu 0.700029 0.770038 0 224 63.546 1.04473e-05 -3.54006 63.546000 Cu 0.760044 0.790058 8.96375e-18 225 63.546 3.01338e-06 -3.5398 63.546000 Cu 0.770052 0.772549 0.5 226 63.546 1.95493e-05 -3.54008 63.546000 Cu 0.690005 0.78755 0.5 227 63.546 8.54798e-06 -3.5398 63.546000 Cu 0.830087 0.792572 0.5 231 63.546 1.64308e-05 -3.53983 63.546000 Cu 0.920025 0.760031 0 201 63.546 2.34247e-06 -3.54009 63.546000 Cu 0.990015 0.76253 0.5 207 63.546 2.40512e-06 -3.54 63.546000 Cu 0.840068 0.775059 8.09435e-19 228 63.546 2.03658e-05 -3.54004 63.546000 Cu 0.900104 0.795085 0 229 63.546 2.6419e-05 -3.53987 63.546000 Cu 0.910064 0.777562 0.5 230 63.546 9.17183e-06 -3.53996 63.546000 Cu 0.98004 0.780059 0 232 63.546 2.1834e-06 -3.53989 63.546000 Cu 0.970082 0.79759 0.5 235 63.546 1.25723e-05 -3.53989 63.546000 Cu 0.0400314 0.800084 9.3145e-17 233 63.546 7.25947e-06 -3.53987 63.546000 Cu 0.109992 0.80257 0.5 237 63.546 3.2998e-05 -3.53981 63.546000 Cu 0.020183 0.835168 3.55252e-17 261 63.546 7.9318e-05 -3.5402 63.546000 Cu 0.0300931 0.817625 0.5 262 63.546 2.08528e-05 -3.53993 63.546000 Cu 0.100051 0.820107 0 264 63.546 1.41416e-05 -3.5398 63.546000 Cu 0.0901528 0.837661 0.5 265 63.546 4.2937e-05 -3.53994 63.546000 Cu 0.179986 0.805058 0 238 63.546 5.21634e-05 -3.53981 63.546000 Cu 0.320063 0.810077 1.02798e-16 241 63.546 1.9968e-05 -3.53998 63.546000 Cu 0.250019 0.807559 0.5 243 63.546 3.90829e-05 -3.53987 63.546000 Cu 0.170004 0.822585 0.5 267 63.546 7.53292e-05 -3.53979 63.546000 Cu 0.239977 0.825079 5.35726e-17 268 63.546 8.1907e-05 -3.53992 63.546000 Cu 0.309985 0.827595 0.5 270 63.546 2.47892e-05 -3.54014 63.546000 Cu 0.46011 0.815124 0 245 63.546 3.94867e-05 -3.54005 63.546000 Cu 0.390099 0.812604 0.5 247 63.546 2.53198e-05 -3.54007 63.546000 Cu 0.380047 0.830125 2.99791e-19 272 63.546 1.45606e-05 -3.5403 63.546000 Cu 0.450128 0.832654 0.5 274 63.546 6.00624e-05 -3.54032 63.546000 Cu 0.540031 0.800084 0 248 63.546 7.25947e-06 -3.53987 63.546000 Cu 0.600051 0.820107 0 249 63.546 1.41416e-05 -3.5398 63.546000 Cu 0.609992 0.80257 0.5 250 63.546 3.2998e-05 -3.53981 63.546000 Cu 0.530093 0.817625 0.5 251 63.546 2.08528e-05 -3.53993 63.546000 Cu 0.520183 0.835168 5.99582e-20 276 63.546 7.9318e-05 -3.5402 63.546000 Cu 0.590153 0.837661 0.5 278 63.546 4.2937e-05 -3.53994 63.546000 Cu 0.679986 0.805058 8.4541e-18 252 63.546 5.21634e-05 -3.53981 63.546000 Cu 0.739977 0.825079 0 253 63.546 8.1907e-05 -3.53992 63.546000 Cu 0.750019 0.807559 0.5 254 63.546 3.90829e-05 -3.53987 63.546000 Cu 0.670004 0.822585 0.5 255 63.546 7.53292e-05 -3.53979 63.546000 Cu 0.820063 0.810077 5.99582e-20 256 63.546 1.9968e-05 -3.53998 63.546000 Cu 0.809985 0.827595 0.5 259 63.546 2.47892e-05 -3.54014 63.546000 Cu 0.880047 0.830125 0 257 63.546 1.45606e-05 -3.5403 63.546000 Cu 0.890099 0.812604 0.5 258 63.546 2.53198e-05 -3.54007 63.546000 Cu 0.96011 0.815124 0 260 63.546 3.94867e-05 -3.54005 63.546000 Cu 0.950128 0.832654 0.5 263 63.546 6.00624e-05 -3.54032 63.546000 Cu 0.160049 0.84014 1.03878e-16 266 63.546 5.81444e-05 -3.53967 63.546000 Cu 0.000267513 0.870238 0 289 63.546 0.000425205 -3.54067 63.546000 Cu 0.0102515 0.852715 0.5 290 63.546 0.000223083 -3.54064 63.546000 Cu 0.0802597 0.855238 1.18118e-17 292 63.546 0.000194481 -3.54029 63.546000 Cu 0.0704062 0.872811 0.5 293 63.546 0.00079171 -3.54046 63.546000 Cu 0.140332 0.875342 6.60139e-17 294 63.546 0.000476912 -3.53984 63.546000 Cu 0.150127 0.857726 0.5 295 63.546 6.95066e-05 -3.53967 63.546000 Cu 0.299895 0.845118 2.21845e-17 269 63.546 0.000120987 -3.53986 63.546000 Cu 0.229926 0.842619 0.5 271 63.546 0.000156078 -3.53962 63.546000 Cu 0.219945 0.860187 0 296 63.546 0.000220886 -3.53928 63.546000 Cu 0.289822 0.862647 0.5 298 63.546 0.000420506 -3.53938 63.546000 Cu 0.210056 0.877801 0.5 299 63.546 0.000221284 -3.53939 63.546000 Cu 0.440127 0.850176 5.52515e-17 273 63.546 8.37202e-05 -3.54058 63.546000 Cu 0.369973 0.847639 0.5 275 63.546 3.2573e-05 -3.54024 63.546000 Cu 0.359856 0.865136 2.99791e-19 300 63.546 0.0002543 -3.53989 63.546000 Cu 0.430041 0.867669 0.5 302 63.546 0.000114266 -3.54042 63.546000 Cu 0.660049 0.84014 2.87499e-17 280 63.546 5.81444e-05 -3.53967 63.546000 Cu 0.58026 0.855238 1.01929e-17 277 63.546 0.000194481 -3.54029 63.546000 Cu 0.510251 0.852715 0.5 279 63.546 0.000223083 -3.54064 63.546000 Cu 0.650127 0.857726 0.5 283 63.546 6.95066e-05 -3.53967 63.546000 Cu 0.500268 0.870238 0 304 63.546 0.000425205 -3.54067 63.546000 Cu 0.570406 0.872811 0.5 306 63.546 0.00079171 -3.54046 63.546000 Cu 0.640332 0.875342 8.61599e-17 308 63.546 0.000476912 -3.53984 63.546000 Cu 0.719945 0.860187 3.54353e-17 281 63.546 0.000220886 -3.53928 63.546000 Cu 0.729926 0.842619 0.5 282 63.546 0.000156078 -3.53962 63.546000 Cu 0.799895 0.845118 5.99582e-20 284 63.546 0.000120987 -3.53986 63.546000 Cu 0.789822 0.862647 0.5 287 63.546 0.000420506 -3.53938 63.546000 Cu 0.710056 0.877801 0.5 310 63.546 0.000221284 -3.53939 63.546000 Cu 0.859856 0.865136 2.09854e-19 285 63.546 0.0002543 -3.53989 63.546000 Cu 0.869973 0.847639 0.5 286 63.546 3.2573e-05 -3.54024 63.546000 Cu 0.940127 0.850176 1.79875e-18 288 63.546 8.37202e-05 -3.54058 63.546000 Cu 0.930041 0.867669 0.5 291 63.546 0.000114266 -3.54042 63.546000 Cu 0.0604898 0.890339 0 320 63.546 0.00182252 -3.54052 63.546000 Cu 0.120463 0.910543 8.4541e-18 321 63.546 0.00591455 -3.5422 63.546000 Cu 0.130542 0.892968 0.5 322 63.546 0.00233402 -3.54066 63.546000 Cu 0.0501145 0.907791 0.5 323 63.546 0.00169605 -3.54016 63.546000 Cu 0.27978 0.880211 1.49895e-19 297 63.546 0.000957712 -3.53914 63.546000 Cu 0.200329 0.89548 0 324 63.546 0.00116142 -3.5405 63.546000 Cu 0.26072 0.915562 2.39833e-17 325 63.546 0.00283862 -3.54104 63.546000 Cu 0.269983 0.897852 0.5 326 63.546 0.000988346 -3.53956 63.546000 Cu 0.190744 0.913165 0.5 327 63.546 0.0078704 -3.54285 63.546000 Cu 0.330284 0.917799 0.5 331 63.546 0.00336179 -3.53773 63.546000 Cu 0.419845 0.885113 1.49895e-19 301 63.546 0.000571581 -3.53954 63.546000 Cu 0.34968 0.882628 0.5 303 63.546 0.00134268 -3.53923 63.546000 Cu 0.490176 0.887691 0.5 307 63.546 0.0004878 -3.54006 63.546000 Cu 0.339668 0.900156 1.79875e-19 328 63.546 0.00338102 -3.5385 63.546000 Cu 0.409619 0.90253 0.5 330 63.546 0.00404652 -3.53788 63.546000 Cu 0.479784 0.905077 0 332 63.546 0.00212536 -3.53826 63.546000 Cu 0.56049 0.890339 5.75299e-17 305 63.546 0.00182252 -3.54052 63.546000 Cu 0.630542 0.892968 0.5 311 63.546 0.00233402 -3.54066 63.546000 Cu 0.550114 0.907791 0.5 334 63.546 0.00169605 -3.54016 63.546000 Cu 0.620463 0.910543 6.15171e-17 336 63.546 0.00591455 -3.5422 63.546000 Cu 0.77978 0.880211 0 312 63.546 0.000957712 -3.53914 63.546000 Cu 0.700329 0.89548 0 309 63.546 0.00116142 -3.5405 63.546000 Cu 0.769983 0.897852 0.5 315 63.546 0.000988346 -3.53956 63.546000 Cu 0.690744 0.913165 0.5 338 63.546 0.0078704 -3.54285 63.546000 Cu 0.76072 0.915562 4.04718e-17 340 63.546 0.00283862 -3.54104 63.546000 Cu 0.830284 0.917799 0.5 342 63.546 0.00336179 -3.53773 63.546000 Cu 0.839668 0.900156 2.20946e-17 313 63.546 0.00338102 -3.5385 63.546000 Cu 0.84968 0.882628 0.5 314 63.546 0.00134268 -3.53923 63.546000 Cu 0.919845 0.885113 9.21857e-17 316 63.546 0.000571581 -3.53954 63.546000 Cu 0.979784 0.905077 0 317 63.546 0.00212536 -3.53826 63.546000 Cu 0.990176 0.887691 0.5 318 63.546 0.0004878 -3.54006 63.546000 Cu 0.909619 0.90253 0.5 319 63.546 0.00404652 -3.53788 63.546000 Cu 0.0388965 0.925157 0 348 63.546 0.00449901 -3.53919 63.546000 Cu 0.0984766 0.944976 1.11732e-16 349 63.546 0.0233855 -3.53766 63.546000 Cu 0.1098 0.927935 0.5 350 63.546 0.0108873 -3.54299 63.546000 Cu 0.026873 0.942509 0.5 351 63.546 0.0402616 -3.53776 63.546000 Cu 0.0147162 0.95979 0 376 63.546 0.152974 -3.52422 63.546000 Cu 0.181201 0.930674 8.25924e-17 352 63.546 0.021416 -3.54445 63.546000 Cu 0.244203 0.95075 2.39833e-19 353 63.546 0.0862663 -3.53579 63.546000 Cu 0.25218 0.933266 0.5 354 63.546 0.0201169 -3.54222 63.546000 Cu 0.17175 0.947756 0.5 355 63.546 0.0280453 -3.53769 63.546000 Cu 0.321737 0.935607 0 356 63.546 0.0155332 -3.53425 63.546000 Cu 0.314251 0.953673 0.5 359 63.546 0.149351 -3.50936 63.546000 Cu 0.39957 0.920039 2.39833e-19 329 63.546 0.0133395 -3.53448 63.546000 Cu 0.468973 0.922479 0.5 335 63.546 0.0124932 -3.53501 63.546000 Cu 0.38017 0.956257 2.19147e-17 357 63.546 0.0580879 -3.49931 63.546000 Cu 0.38995 0.937852 0.5 358 63.546 0.029457 -3.52518 63.546000 Cu 0.45757 0.940124 8.99373e-20 360 63.546 0.0387345 -3.52703 63.546000 Cu 0.445718 0.958385 0.5 363 63.546 0.110805 -3.52174 63.546000 Cu 0.538896 0.925157 8.96075e-17 333 63.546 0.00449901 -3.53919 63.546000 Cu 0.6098 0.927935 0.5 339 63.546 0.0108873 -3.54299 63.546000 Cu 0.514716 0.95979 1.61887e-17 361 63.546 0.152974 -3.52422 63.546000 Cu 0.526873 0.942509 0.5 362 63.546 0.0402616 -3.53776 63.546000 Cu 0.598477 0.944976 0 364 63.546 0.0233855 -3.53766 63.546000 Cu 0.681201 0.930674 2.99791e-20 337 63.546 0.021416 -3.54445 63.546000 Cu 0.821737 0.935607 1.49895e-19 341 63.546 0.0155332 -3.53425 63.546000 Cu 0.75218 0.933266 0.5 343 63.546 0.0201169 -3.54222 63.546000 Cu 0.67175 0.947756 0.5 366 63.546 0.0280453 -3.53769 63.546000 Cu 0.744203 0.95075 2.09854e-19 368 63.546 0.0862663 -3.53579 63.546000 Cu 0.814251 0.953673 0.5 370 63.546 0.149351 -3.50936 63.546000 Cu 0.89957 0.920039 3.75638e-17 344 63.546 0.0133395 -3.53448 63.546000 Cu 0.95757 0.940124 6.7303e-17 345 63.546 0.0387345 -3.52703 63.546000 Cu 0.968973 0.922479 0.5 346 63.546 0.0124932 -3.53501 63.546000 Cu 0.88995 0.937852 0.5 347 63.546 0.029457 -3.52518 63.546000 Cu 0.88017 0.956257 4.49686e-19 372 63.546 0.0580879 -3.49931 63.546000 Cu 0.945718 0.958385 0.5 374 63.546 0.110805 -3.52174 63.546000 Cu 0.0769438 0.977975 1.06156e-16 377 63.546 0.375167 -3.49698 63.546000 Cu 0.0877987 0.961699 0.5 378 63.546 0.0658574 -3.53044 63.546000 Cu 0.00594715 0.9774 0.5 379 63.546 0.17562 -3.53029 63.546000 Cu 0.161465 0.964174 6.67035e-17 380 63.546 0.0378756 -3.51471 63.546000 Cu 0.153471 0.980223 0.5 383 63.546 4.36476 -3.43732 63.546000 Cu 0.00302653 0.995084 0 400 63.546 0.123259 -3.53841 63.546000 Cu 0.0728582 0.995117 0.5 401 63.546 0.4782 -3.51313 63.546000 Cu 0.141051 0.99512 4.17309e-17 402 63.546 6.22687 -3.22467 63.546000 Cu 0.285944 0.995484 0.5 411 63.546 7.93642 -3.44829 63.546000 Cu 0.224738 0.983686 9.37446e-17 381 63.546 9.28705 -3.29087 63.546000 Cu 0.236404 0.967661 0.5 382 63.546 0.944329 -3.4451 63.546000 Cu 0.30586 0.972276 2.69812e-19 384 63.546 1.01631 -3.40523 63.546000 Cu 0.358663 0.995065 5.99582e-20 410 63.546 1.68844 -3.49901 63.546000 Cu 0.368377 0.975996 0.5 386 63.546 0.440431 -3.46296 63.546000 Cu 0.435916 0.976852 0 388 63.546 0.214793 -3.52638 63.546000 Cu 0.43204 0.995102 0.5 391 63.546 0.254778 -3.5282 63.546000 Cu 0.661465 0.964174 0 365 63.546 0.0378756 -3.51471 63.546000 Cu 0.587799 0.961699 0.5 367 63.546 0.0658574 -3.53044 63.546000 Cu 0.503027 0.995084 0 389 63.546 0.123259 -3.53841 63.546000 Cu 0.505947 0.9774 0.5 390 63.546 0.17562 -3.53029 63.546000 Cu 0.576944 0.977975 8.99373e-20 392 63.546 0.375167 -3.49698 63.546000 Cu 0.641051 0.99512 0 393 63.546 6.22687 -3.22467 63.546000 Cu 0.653471 0.980223 0.5 394 63.546 4.36476 -3.43732 63.546000 Cu 0.572858 0.995117 0.5 395 63.546 0.4782 -3.51313 63.546000 Cu 0.785944 0.995484 0.5 438 63.546 7.93642 -3.44829 63.546000 Cu 0.80586 0.972276 5.99582e-20 369 63.546 1.01631 -3.40523 63.546000 Cu 0.736404 0.967661 0.5 371 63.546 0.944329 -3.4451 63.546000 Cu 0.724738 0.983686 0 396 63.546 9.28705 -3.29087 63.546000 Cu 0.858663 0.995065 1.17518e-17 403 63.546 1.68844 -3.49901 63.546000 Cu 0.935916 0.976852 8.99373e-20 373 63.546 0.214793 -3.52638 63.546000 Cu 0.868377 0.975996 0.5 375 63.546 0.440431 -3.46296 63.546000 Cu 0.93204 0.995102 0.5 399 63.546 0.254778 -3.5282