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 4.67674e-18 406 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 2.99791e-20 416 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 2.79405e-17 420 63.546 0.0433809 -3.51414 63.546000 Cu 0.171265 0.0425097 0.5 423 63.546 0.0256774 -3.53682 63.546000 Cu 0.224045 0.00670681 1.19916e-19 408 63.546 9.12714 -3.287 63.546000 Cu 0.243921 0.0394569 1.65784e-17 421 63.546 0.0960875 -3.53536 63.546000 Cu 0.235939 0.0226371 0.5 422 63.546 0.835613 -3.44712 63.546000 Cu 0.305552 0.0178851 8.99373e-20 424 63.546 0.891355 -3.41667 63.546000 Cu 0.379874 0.0339072 5.97183e-17 425 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 0.313999 0.0365087 0.5 427 63.546 0.154934 -3.51015 63.546000 Cu 0.435692 0.0133081 1.49895e-19 428 63.546 0.22095 -3.52697 63.546000 Cu 0.51421 0.0304126 1.19916e-17 429 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 0.445341 0.0318258 0.5 431 63.546 0.10971 -3.52162 63.546000 Cu 0.576637 0.0122472 1.9996e-17 432 63.546 0.372456 -3.49866 63.546000 Cu 0.587343 0.0285376 0.5 435 63.546 0.0658858 -3.53077 63.546000 Cu 0.660874 0.0261295 2.69812e-19 433 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 0.724045 0.00670681 2.69812e-19 436 63.546 9.12714 -3.287 63.546000 Cu 0.735939 0.0226371 0.5 439 63.546 0.835613 -3.44712 63.546000 Cu 0.671265 0.0425097 0.5 462 63.546 0.0256774 -3.53682 63.546000 Cu 0.743921 0.0394569 2.39833e-19 464 63.546 0.0960875 -3.53536 63.546000 Cu 0.805552 0.0178851 2.09854e-19 437 63.546 0.891355 -3.41667 63.546000 Cu 0.935692 0.0133081 0 404 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 1.49895e-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 0.813999 0.0365087 0.5 466 63.546 0.154934 -3.51015 63.546000 Cu 0.0978522 0.0452682 5.4502e-17 417 63.546 0.0267012 -3.53708 63.546000 Cu 0.0263269 0.0477021 0.5 419 63.546 0.0422747 -3.53752 63.546000 Cu 0.0384127 0.0650687 5.37525e-17 444 63.546 0.00522755 -3.53879 63.546000 Cu 0.120135 0.0796592 9.71322e-18 445 63.546 0.00629266 -3.54252 63.546000 Cu 0.109285 0.0622875 0.5 446 63.546 0.0113873 -3.54291 63.546000 Cu 0.0497697 0.0824306 0.5 447 63.546 0.00163087 -3.54005 63.546000 Cu 0.180811 0.0595245 1.9996e-17 448 63.546 0.0244173 -3.54443 63.546000 Cu 0.190405 0.0770207 0.5 451 63.546 0.00915518 -3.54312 63.546000 Cu 0.260346 0.0746156 3.24973e-17 449 63.546 0.00394345 -3.54125 63.546000 Cu 0.251922 0.0569184 0.5 450 63.546 0.0239686 -3.54255 63.546000 Cu 0.321501 0.0545885 4.32598e-17 452 63.546 0.017572 -3.53405 63.546000 Cu 0.399216 0.0701866 1.93965e-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 0.329927 0.0724051 0.5 455 63.546 0.0040572 -3.53754 63.546000 Cu 0.457122 0.0500857 2.17948e-17 456 63.546 0.0395024 -3.52692 63.546000 Cu 0.538413 0.0650687 1.9996e-17 457 63.546 0.00522755 -3.53879 63.546000 Cu 0.526327 0.0477021 0.5 458 63.546 0.0422747 -3.53752 63.546000 Cu 0.468625 0.0677396 0.5 459 63.546 0.0125767 -3.53507 63.546000 Cu 0.597852 0.0452682 6.14271e-17 460 63.546 0.0267012 -3.53708 63.546000 Cu 0.479465 0.0851555 1.28251e-16 485 63.546 0.00265354 -3.53827 63.546000 Cu 0.54977 0.0824306 0.5 487 63.546 0.00163087 -3.54005 63.546000 Cu 0.680811 0.0595245 2.95894e-17 461 63.546 0.0244173 -3.54443 63.546000 Cu 0.609285 0.0622875 0.5 463 63.546 0.0113873 -3.54291 63.546000 Cu 0.751922 0.0569184 0.5 467 63.546 0.0239686 -3.54255 63.546000 Cu 0.620135 0.0796592 1.9996e-17 489 63.546 0.00629266 -3.54252 63.546000 Cu 0.690405 0.0770207 0.5 491 63.546 0.00915518 -3.54312 63.546000 Cu 0.760346 0.0746156 2.77007e-17 493 63.546 0.00394345 -3.54125 63.546000 Cu 0.957122 0.0500857 5.99582e-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 1.19916e-19 440 63.546 0.0149297 -3.53445 63.546000 Cu 0.979465 0.0851555 2.99791e-20 441 63.546 0.00265354 -3.53827 63.546000 Cu 0.968625 0.0677396 0.5 442 63.546 0.0125767 -3.53507 63.546000 Cu 0.821501 0.0545885 2.40732e-17 465 63.546 0.017572 -3.53405 63.546000 Cu 0.829927 0.0724051 0.5 495 63.546 0.0040572 -3.53754 63.546000 Cu 9.73525e-05 0.119957 3.08785e-17 470 63.546 0.000376363 -3.54062 63.546000 Cu 0.0602339 0.0998653 5.99582e-20 473 63.546 0.00164372 -3.54054 63.546000 Cu 0.140208 0.114826 5.99582e-20 474 63.546 0.000702242 -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 0.200085 0.0946959 2.50026e-17 477 63.546 0.00149404 -3.54033 63.546000 Cu 0.279545 0.10997 4.57181e-17 478 63.546 0.000962243 -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 0.0002302 -3.53926 63.546000 Cu 0.339348 0.0900449 0 481 63.546 0.00336518 -3.53859 63.546000 Cu 0.349414 0.107576 0.5 484 63.546 0.00147562 -3.53926 63.546000 Cu 0.219836 0.129976 6.61339e-17 507 63.546 0.00024038 -3.53921 63.546000 Cu 0.289666 0.127529 0.5 509 63.546 0.000480819 -3.53925 63.546000 Cu 0.359644 0.125058 1.19916e-19 511 63.546 0.000427096 -3.53969 63.546000 Cu 0.419568 0.10511 5.738e-17 482 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 0.560234 0.0998653 5.1564e-17 486 63.546 0.00164372 -3.54054 63.546000 Cu 0.489923 0.102529 0.5 488 63.546 0.000499593 -3.54008 63.546000 Cu 0.429829 0.122534 0.5 513 63.546 0.000138259 -3.5403 63.546000 Cu 0.500097 0.119957 6.26563e-18 515 63.546 0.000376363 -3.54062 63.546000 Cu 0.570284 0.117368 0.5 517 63.546 0.00100054 -3.5405 63.546000 Cu 0.700085 0.0946959 3.42361e-17 490 63.546 0.00149404 -3.54033 63.546000 Cu 0.630306 0.0972189 0.5 492 63.546 0.00253486 -3.54083 63.546000 Cu 0.769665 0.0923352 0.5 496 63.546 0.00115118 -3.5395 63.546000 Cu 0.640208 0.114826 3.83432e-17 519 63.546 0.000702242 -3.53993 63.546000 Cu 0.719836 0.129976 1.19916e-19 520 63.546 0.00024038 -3.53921 63.546000 Cu 0.709889 0.112365 0.5 521 63.546 0.0002302 -3.53926 63.546000 Cu 0.779545 0.10997 6.95515e-18 523 63.546 0.000962243 -3.53899 63.546000 Cu 0.789666 0.127529 0.5 525 63.546 0.000480819 -3.53925 63.546000 Cu 0.909285 0.0876902 0.5 443 63.546 0.0043376 -3.53807 63.546000 Cu 0.859644 0.125058 1.19916e-19 468 63.546 0.000427096 -3.53969 63.546000 Cu 0.919568 0.10511 2.99791e-20 469 63.546 0.000882846 -3.53968 63.546000 Cu 0.989923 0.102529 0.5 471 63.546 0.000499593 -3.54008 63.546000 Cu 0.929829 0.122534 0.5 472 63.546 0.000138259 -3.5403 63.546000 Cu 0.839348 0.0900449 5.99582e-20 494 63.546 0.00336518 -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 8.99373e-20 500 63.546 0.000148424 -3.54038 63.546000 Cu 0.0101751 0.137443 0.5 501 63.546 0.000368488 -3.5406 63.546000 Cu 0.0801975 0.134915 1.79875e-19 503 63.546 0.000320331 -3.54026 63.546000 Cu 0.159983 0.150001 1.8617e-17 504 63.546 4.27122e-05 -3.53965 63.546000 Cu 0.150064 0.132429 0.5 505 63.546 8.90593e-05 -3.53963 63.546000 Cu 0.0901106 0.152477 0.5 506 63.546 4.74327e-05 -3.54004 63.546000 Cu 0.0300642 0.172506 0.5 530 63.546 2.37319e-05 -3.54009 63.546000 Cu 0.100034 0.170024 5.99582e-20 532 63.546 2.34246e-05 -3.53988 63.546000 Cu 0.169961 0.167547 0.5 534 63.546 7.14703e-05 -3.53978 63.546000 Cu 0.299788 0.145044 1.46898e-17 508 63.546 0.000172588 -3.53965 63.546000 Cu 0.229847 0.147528 0.5 510 63.546 0.000141277 -3.53949 63.546000 Cu 0.369854 0.142533 0.5 514 63.546 7.19976e-05 -3.54006 63.546000 Cu 0.239894 0.165057 1.9996e-17 536 63.546 9.11511e-05 -3.53985 63.546000 Cu 0.309889 0.162547 0.5 538 63.546 4.19213e-05 -3.54002 63.546000 Cu 0.379971 0.160019 2.99791e-19 540 63.546 2.30503e-05 -3.54027 63.546000 Cu 0.440015 0.139993 1.25912e-17 512 63.546 9.95893e-05 -3.5405 63.546000 Cu 0.580197 0.134915 4.7367e-17 516 63.546 0.000320331 -3.54026 63.546000 Cu 0.510175 0.137443 0.5 518 63.546 0.000368488 -3.5406 63.546000 Cu 0.450088 0.157487 0.5 542 63.546 0.000122314 -3.54045 63.546000 Cu 0.520154 0.15497 2.99791e-20 544 63.546 0.000148424 -3.54038 63.546000 Cu 0.590111 0.152477 0.5 546 63.546 4.74327e-05 -3.54004 63.546000 Cu 0.530064 0.172506 0.5 547 63.546 2.37319e-05 -3.54009 63.546000 Cu 0.600034 0.170024 0 545 63.546 2.34246e-05 -3.53988 63.546000 Cu 0.650064 0.132429 0.5 522 63.546 8.90593e-05 -3.53963 63.546000 Cu 0.659983 0.150001 8.99373e-20 548 63.546 4.27122e-05 -3.53965 63.546000 Cu 0.739894 0.165057 3.31269e-17 549 63.546 9.11511e-05 -3.53985 63.546000 Cu 0.729847 0.147528 0.5 550 63.546 0.000141277 -3.53949 63.546000 Cu 0.669961 0.167547 0.5 551 63.546 7.14703e-05 -3.53978 63.546000 Cu 0.799788 0.145044 7.19498e-17 552 63.546 0.000172588 -3.53965 63.546000 Cu 0.879971 0.160019 9.84813e-17 497 63.546 2.30503e-05 -3.54027 63.546000 Cu 0.869854 0.142533 0.5 498 63.546 7.19976e-05 -3.54006 63.546000 Cu 0.940015 0.139993 7.05408e-17 499 63.546 9.95893e-05 -3.5405 63.546000 Cu 0.950088 0.157487 0.5 502 63.546 0.000122314 -3.54045 63.546000 Cu 0.809889 0.162547 0.5 553 63.546 4.19213e-05 -3.54002 63.546000 Cu 0.0399994 0.190031 1.9996e-17 529 63.546 9.07465e-06 -3.53992 63.546000 Cu 0.179928 0.185066 2.09854e-19 533 63.546 5.65511e-05 -3.53985 63.546000 Cu 0.109951 0.187549 0.5 535 63.546 2.75034e-05 -3.53983 63.546000 Cu 0.0499702 0.207546 0.5 558 63.546 1.2778e-05 -3.53978 63.546000 Cu 0.11993 0.205057 1.9996e-17 560 63.546 3.3898e-05 -3.53979 63.546000 Cu 0.189926 0.202563 0.5 562 63.546 3.16485e-05 -3.53985 63.546000 Cu 0.319978 0.180048 4.47288e-17 537 63.546 8.97047e-06 -3.54019 63.546000 Cu 0.249938 0.182566 0.5 539 63.546 4.32539e-05 -3.54 63.546000 Cu 0.39002 0.177522 0.5 543 63.546 2.3368e-05 -3.54032 63.546000 Cu 0.259962 0.20006 1.9996e-17 564 63.546 1.50167e-05 -3.53995 63.546000 Cu 0.340018 0.215035 5.99582e-20 565 63.546 7.80021e-06 -3.53984 63.546000 Cu 0.330013 0.197548 0.5 566 63.546 1.78051e-05 -3.54007 63.546000 Cu 0.400046 0.195033 1.45998e-17 568 63.546 2.52861e-05 -3.54011 63.546000 Cu 0.460057 0.175004 2.1435e-17 541 63.546 4.60577e-05 -3.54028 63.546000 Cu 0.480014 0.210036 1.79875e-19 569 63.546 7.04367e-06 -3.5398 63.546000 Cu 0.47004 0.192525 0.5 570 63.546 1.79947e-05 -3.54004 63.546000 Cu 0.410033 0.212532 0.5 571 63.546 1.17263e-05 -3.53983 63.546000 Cu 0.539999 0.190031 4.82363e-17 572 63.546 9.07465e-06 -3.53992 63.546000 Cu 0.54997 0.207546 0.5 575 63.546 1.2778e-05 -3.53978 63.546000 Cu 0.61993 0.205057 2.28141e-17 573 63.546 3.3898e-05 -3.53979 63.546000 Cu 0.609951 0.187549 0.5 574 63.546 2.75034e-05 -3.53983 63.546000 Cu 0.679928 0.185066 1.19916e-19 576 63.546 5.65511e-05 -3.53985 63.546000 Cu 0.759962 0.20006 1.19916e-19 577 63.546 1.50167e-05 -3.53995 63.546000 Cu 0.749938 0.182566 0.5 578 63.546 4.32539e-05 -3.54 63.546000 Cu 0.689926 0.202563 0.5 579 63.546 3.16485e-05 -3.53985 63.546000 Cu 0.900046 0.195033 1.64885e-18 526 63.546 2.52861e-05 -3.54011 63.546000 Cu 0.89002 0.177522 0.5 527 63.546 2.3368e-05 -3.54032 63.546000 Cu 0.960057 0.175004 2.32937e-17 528 63.546 4.60577e-05 -3.54028 63.546000 Cu 0.97004 0.192525 0.5 531 63.546 1.79947e-05 -3.54004 63.546000 Cu 0.910033 0.212532 0.5 555 63.546 1.17263e-05 -3.53983 63.546000 Cu 0.980014 0.210036 2.99791e-20 556 63.546 7.04367e-06 -3.5398 63.546000 Cu 0.819978 0.180048 2.39533e-17 580 63.546 8.97047e-06 -3.54019 63.546000 Cu 0.830013 0.197548 0.5 581 63.546 1.78051e-05 -3.54007 63.546000 Cu 0.840018 0.215035 1.49895e-19 610 63.546 7.80021e-06 -3.53984 63.546000 Cu 0.059969 0.225044 3.09684e-17 557 63.546 5.16046e-06 -3.53975 63.546000 Cu 0.199966 0.220047 5.78596e-18 561 63.546 2.53017e-06 -3.53979 63.546000 Cu 0.129959 0.222548 0.5 563 63.546 5.48031e-06 -3.53975 63.546000 Cu 0.0799829 0.260044 1.79875e-19 587 63.546 3.13014e-06 -3.54008 63.546000 Cu 0.0699826 0.242539 0.5 588 63.546 3.46279e-06 -3.53999 63.546000 Cu 0.139983 0.240039 2.39833e-19 590 63.546 7.65059e-06 -3.54003 63.546000 Cu 0.149977 0.257544 0.5 593 63.546 2.82728e-06 -3.54022 63.546000 Cu 0.269989 0.217541 0.5 567 63.546 2.82186e-06 -3.53982 63.546000 Cu 0.219981 0.255038 1.01629e-17 591 63.546 1.13251e-06 -3.54028 63.546000 Cu 0.20999 0.237535 0.5 592 63.546 1.1459e-05 -3.54006 63.546000 Cu 0.280001 0.235028 5.25833e-17 594 63.546 1.35492e-05 -3.54005 63.546000 Cu 0.359998 0.250026 1.9996e-17 595 63.546 2.361e-06 -3.54017 63.546000 Cu 0.350008 0.232524 0.5 596 63.546 1.15765e-05 -3.54 63.546000 Cu 0.289991 0.252531 0.5 597 63.546 1.12979e-06 -3.54026 63.546000 Cu 0.420003 0.230027 8.99373e-20 598 63.546 5.50362e-06 -3.53991 63.546000 Cu 0.499989 0.245034 1.49895e-19 599 63.546 1.18552e-06 -3.54 63.546000 Cu 0.489988 0.227535 0.5 600 63.546 2.40299e-06 -3.53981 63.546000 Cu 0.429997 0.247528 0.5 601 63.546 1.80122e-06 -3.54007 63.546000 Cu 0.559969 0.225044 2.07155e-17 602 63.546 5.16046e-06 -3.53975 63.546000 Cu 0.569983 0.242539 0.5 605 63.546 3.46279e-06 -3.53999 63.546000 Cu 0.579983 0.260044 3.80734e-17 632 63.546 3.13014e-06 -3.54008 63.546000 Cu 0.639983 0.240039 0 603 63.546 7.65059e-06 -3.54003 63.546000 Cu 0.629959 0.222548 0.5 604 63.546 5.48031e-06 -3.53975 63.546000 Cu 0.699966 0.220047 1.19916e-19 606 63.546 2.53017e-06 -3.53979 63.546000 Cu 0.780001 0.235028 2.73709e-17 607 63.546 1.35492e-05 -3.54005 63.546000 Cu 0.769989 0.217541 0.5 608 63.546 2.82186e-06 -3.53982 63.546000 Cu 0.70999 0.237535 0.5 609 63.546 1.1459e-05 -3.54006 63.546000 Cu 0.649977 0.257544 0.5 634 63.546 2.82728e-06 -3.54022 63.546000 Cu 0.719981 0.255038 5.99582e-20 636 63.546 1.13251e-06 -3.54028 63.546000 Cu 0.789991 0.252531 0.5 638 63.546 1.12979e-06 -3.54026 63.546000 Cu 0.999989 0.245034 3.16879e-17 586 63.546 1.18552e-06 -3.54 63.546000 Cu 0.920003 0.230027 1.9996e-17 554 63.546 5.50362e-06 -3.53991 63.546000 Cu 0.989988 0.227535 0.5 559 63.546 2.40299e-06 -3.53981 63.546000 Cu 0.859998 0.250026 8.46909e-17 582 63.546 2.361e-06 -3.54017 63.546000 Cu 0.929997 0.247528 0.5 584 63.546 1.80122e-06 -3.54007 63.546000 Cu 0.850008 0.232524 0.5 611 63.546 1.15765e-05 -3.54 63.546000 Cu 0.00999761 0.262538 0.5 589 63.546 2.58062e-06 -3.53995 63.546000 Cu 0.0199803 0.280041 1.16199e-16 616 63.546 3.9642e-06 -3.53982 63.546000 Cu 0.0999217 0.295046 5.00651e-17 617 63.546 3.49e-05 -3.53994 63.546000 Cu 0.0899553 0.277547 0.5 618 63.546 1.01111e-05 -3.53991 63.546000 Cu 0.0299387 0.297552 0.5 619 63.546 2.25872e-05 -3.53997 63.546000 Cu 0.159955 0.275046 7.22796e-17 620 63.546 1.93263e-05 -3.53999 63.546000 Cu 0.169949 0.292532 0.5 623 63.546 1.77901e-05 -3.53984 63.546000 Cu 0.24 0.290019 6.70932e-17 621 63.546 4.13748e-06 -3.53977 63.546000 Cu 0.229975 0.272538 0.5 622 63.546 1.7689e-05 -3.54002 63.546000 Cu 0.299999 0.270031 5.729e-17 624 63.546 1.05636e-05 -3.53999 63.546000 Cu 0.380046 0.28502 1.10623e-17 625 63.546 2.52258e-05 -3.53971 63.546000 Cu 0.370013 0.267528 0.5 626 63.546 5.51756e-06 -3.53992 63.546000 Cu 0.31004 0.287515 0.5 627 63.546 1.60881e-05 -3.53972 63.546000 Cu 0.390053 0.302523 0.5 654 63.546 5.62362e-05 -3.53982 63.546000 Cu 0.440011 0.265031 2.4433e-17 628 63.546 3.17827e-06 -3.53989 63.546000 Cu 0.51998 0.280041 5.99582e-20 629 63.546 3.9642e-06 -3.53982 63.546000 Cu 0.509998 0.262538 0.5 630 63.546 2.58062e-06 -3.53995 63.546000 Cu 0.450019 0.28253 0.5 631 63.546 1.37666e-05 -3.53974 63.546000 Cu 0.589955 0.277547 0.5 635 63.546 1.01111e-05 -3.53991 63.546000 Cu 0.459997 0.300043 1.49895e-19 656 63.546 1.49151e-05 -3.53992 63.546000 Cu 0.529939 0.297552 0.5 658 63.546 2.25872e-05 -3.53997 63.546000 Cu 0.599922 0.295046 1.19916e-19 660 63.546 3.49e-05 -3.53994 63.546000 Cu 0.659955 0.275046 2.99791e-20 633 63.546 1.93263e-05 -3.53999 63.546000 Cu 0.799999 0.270031 3.92726e-18 637 63.546 1.05636e-05 -3.53999 63.546000 Cu 0.729975 0.272538 0.5 639 63.546 1.7689e-05 -3.54002 63.546000 Cu 0.669949 0.292532 0.5 662 63.546 1.77901e-05 -3.53984 63.546000 Cu 0.74 0.290019 2.99791e-20 664 63.546 4.13748e-06 -3.53977 63.546000 Cu 0.940011 0.265031 1.49895e-19 583 63.546 3.17827e-06 -3.53989 63.546000 Cu 0.870013 0.267528 0.5 585 63.546 5.51756e-06 -3.53992 63.546000 Cu 0.880046 0.28502 8.99373e-20 612 63.546 2.52258e-05 -3.53971 63.546000 Cu 0.959997 0.300043 0 613 63.546 1.49151e-05 -3.53992 63.546000 Cu 0.950019 0.28253 0.5 614 63.546 1.37666e-05 -3.53974 63.546000 Cu 0.890053 0.302523 0.5 615 63.546 5.62362e-05 -3.53982 63.546000 Cu 0.81004 0.287515 0.5 666 63.546 1.60881e-05 -3.53972 63.546000 Cu 0.0399074 0.315071 1.19916e-19 644 63.546 6.87401e-05 -3.5402 63.546000 Cu 0.120007 0.330047 2.69812e-19 645 63.546 2.59289e-05 -3.54035 63.546000 Cu 0.109932 0.312547 0.5 646 63.546 3.97382e-05 -3.54021 63.546000 Cu 0.0498919 0.332584 0.5 647 63.546 0.000111924 -3.54043 63.546000 Cu 0.179985 0.310016 8.27423e-18 648 63.546 3.00239e-05 -3.54005 63.546000 Cu 0.190094 0.327513 0.5 651 63.546 5.6e-05 -3.54012 63.546000 Cu 0.130137 0.347534 0.5 675 63.546 7.65992e-05 -3.54019 63.546000 Cu 0.200233 0.345017 1.79875e-19 677 63.546 0.000253067 -3.53979 63.546000 Cu 0.260102 0.325001 1.19916e-19 649 63.546 0.00015047 -3.53986 63.546000 Cu 0.250041 0.307499 0.5 650 63.546 6.49632e-05 -3.53987 63.546000 Cu 0.320073 0.305002 6.3106e-17 652 63.546 9.15515e-05 -3.53979 63.546000 Cu 0.399978 0.32005 1.45099e-17 653 63.546 1.78577e-05 -3.53983 63.546000 Cu 0.330053 0.322517 0.5 655 63.546 0.000114622 -3.53977 63.546000 Cu 0.270171 0.342532 0.5 679 63.546 0.000226825 -3.53958 63.546000 Cu 0.339995 0.340066 1.08524e-17 681 63.546 5.97293e-05 -3.53968 63.546000 Cu 0.539907 0.315071 8.99373e-20 657 63.546 6.87401e-05 -3.5402 63.546000 Cu 0.469921 0.317573 0.5 659 63.546 4.2601e-05 -3.54003 63.546000 Cu 0.409853 0.337595 0.5 683 63.546 8.28026e-05 -3.53999 63.546000 Cu 0.479815 0.335103 0 685 63.546 0.000161563 -3.54029 63.546000 Cu 0.549892 0.332584 0.5 687 63.546 0.000111924 -3.54043 63.546000 Cu 0.679985 0.310016 4.10414e-17 661 63.546 3.00239e-05 -3.54005 63.546000 Cu 0.609932 0.312547 0.5 663 63.546 3.97382e-05 -3.54021 63.546000 Cu 0.750041 0.307499 0.5 667 63.546 6.49632e-05 -3.53987 63.546000 Cu 0.620007 0.330047 3.79235e-17 689 63.546 2.59289e-05 -3.54035 63.546000 Cu 0.700233 0.345017 8.21127e-17 690 63.546 0.000253067 -3.53979 63.546000 Cu 0.690094 0.327513 0.5 691 63.546 5.6e-05 -3.54012 63.546000 Cu 0.630137 0.347534 0.5 692 63.546 7.65992e-05 -3.54019 63.546000 Cu 0.760102 0.325001 3.8733e-17 693 63.546 0.00015047 -3.53986 63.546000 Cu 0.770171 0.342532 0.5 696 63.546 0.000226825 -3.53958 63.546000 Cu 0.899978 0.32005 1.19916e-19 640 63.546 1.78577e-05 -3.53983 63.546000 Cu 0.979815 0.335103 4.19707e-18 641 63.546 0.000161563 -3.54029 63.546000 Cu 0.969921 0.317573 0.5 642 63.546 4.2601e-05 -3.54003 63.546000 Cu 0.909853 0.337595 0.5 643 63.546 8.28026e-05 -3.53999 63.546000 Cu 0.820073 0.305002 9.11364e-18 665 63.546 9.15515e-05 -3.53979 63.546000 Cu 0.839995 0.340066 3.18977e-17 694 63.546 5.97293e-05 -3.53968 63.546000 Cu 0.830053 0.322517 0.5 695 63.546 0.000114622 -3.53977 63.546000 Cu 0.0599342 0.350078 2.69812e-19 673 63.546 0.000131572 -3.54058 63.546000 Cu 0.140335 0.365008 2.09854e-19 674 63.546 0.000498877 -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 0.000413062 -3.54006 63.546000 Cu 0.0804072 0.384962 2.69812e-19 703 63.546 0.000931407 -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 1.9996e-17 678 63.546 0.000186648 -3.53921 63.546000 Cu 0.210342 0.362538 0.5 680 63.546 0.000553857 -3.53934 63.546000 Cu 0.349924 0.357647 0.5 684 63.546 8.84955e-05 -3.53962 63.546000 Cu 0.220396 0.380102 3.2977e-19 707 63.546 0.000860561 -3.53901 63.546000 Cu 0.290073 0.377705 0.5 709 63.546 0.000206349 -3.53925 63.546000 Cu 0.359764 0.37525 1.13921e-18 711 63.546 0.000705095 -3.53979 63.546000 Cu 0.419759 0.35516 4.26902e-17 682 63.546 0.000356462 -3.54029 63.546000 Cu 0.559934 0.350078 0 686 63.546 0.000131572 -3.54058 63.546000 Cu 0.489769 0.35263 0.5 688 63.546 0.000400727 -3.54067 63.546000 Cu 0.439721 0.39021 1.9996e-17 712 63.546 0.00177206 -3.54053 63.546000 Cu 0.429677 0.372711 0.5 713 63.546 0.00109304 -3.54044 63.546000 Cu 0.499846 0.370119 1.9996e-17 715 63.546 0.000448426 -3.54063 63.546000 Cu 0.580407 0.384962 4.62277e-17 716 63.546 0.000931407 -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 0.000413062 -3.54006 63.546000 Cu 0.640335 0.365008 3.95424e-17 719 63.546 0.000498877 -3.53985 63.546000 Cu 0.720396 0.380102 1.9996e-17 720 63.546 0.000860561 -3.53901 63.546000 Cu 0.710342 0.362538 0.5 721 63.546 0.000553857 -3.53934 63.546000 Cu 0.650539 0.382496 0.5 722 63.546 0.00149362 -3.53925 63.546000 Cu 0.780162 0.360098 3.59749e-18 723 63.546 0.000186648 -3.53921 63.546000 Cu 0.790073 0.377705 0.5 725 63.546 0.000206349 -3.53925 63.546000 Cu 0.999846 0.370119 4.66175e-17 670 63.546 0.000448426 -3.54063 63.546000 Cu 0.859764 0.37525 1.9996e-17 668 63.546 0.000705095 -3.53979 63.546000 Cu 0.919759 0.35516 9.95306e-18 669 63.546 0.000356462 -3.54029 63.546000 Cu 0.989769 0.35263 0.5 671 63.546 0.000400727 -3.54067 63.546000 Cu 0.929677 0.372711 0.5 672 63.546 0.00109304 -3.54044 63.546000 Cu 0.939721 0.39021 1.9996e-17 699 63.546 0.00177206 -3.54053 63.546000 Cu 0.849924 0.357647 0.5 724 63.546 8.84955e-05 -3.53962 63.546000 Cu 0.02053 0.404919 2.99791e-20 700 63.546 0.00264613 -3.53829 63.546000 Cu 0.160577 0.400024 1.19916e-19 704 63.546 0.0032415 -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 0.0125069 -3.53481 63.546000 Cu 0.100747 0.419888 5.99582e-20 732 63.546 0.0145085 -3.5343 63.546000 Cu 0.170051 0.417664 0.5 734 63.546 0.00413529 -3.53764 63.546000 Cu 0.299857 0.395377 3.5825e-17 708 63.546 0.00148349 -3.54058 63.546000 Cu 0.230239 0.397738 0.5 710 63.546 0.000971025 -3.53944 63.546000 Cu 0.36964 0.392859 0.5 714 63.546 0.00280524 -3.54079 63.546000 Cu 0.239568 0.415455 1.19916e-19 736 63.546 0.00377124 -3.54117 63.546000 Cu 0.319173 0.430543 1.37904e-18 737 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 2.09854e-19 740 63.546 0.0060115 -3.54244 63.546000 Cu 0.390658 0.427783 0.5 743 63.546 0.0110926 -3.54297 63.546000 Cu 0.461551 0.425004 1.9996e-17 741 63.546 0.00507487 -3.53899 63.546000 Cu 0.450215 0.40764 0.5 742 63.546 0.00146365 -3.5402 63.546000 Cu 0.52053 0.404919 2.1465e-17 744 63.546 0.00264613 -3.53829 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 0.0125069 -3.53481 63.546000 Cu 0.600747 0.419888 2.09854e-19 745 63.546 0.0145085 -3.5343 63.546000 Cu 0.660577 0.400024 5.99582e-20 748 63.546 0.0032415 -3.53845 63.546000 Cu 0.739568 0.415455 1.9996e-17 749 63.546 0.00377124 -3.54117 63.546000 Cu 0.730239 0.397738 0.5 750 63.546 0.000971025 -3.53944 63.546000 Cu 0.670051 0.417664 0.5 751 63.546 0.00413529 -3.53764 63.546000 Cu 0.799857 0.395377 4.37695e-17 752 63.546 0.00148349 -3.54058 63.546000 Cu 0.748074 0.433155 0.5 778 63.546 0.0241205 -3.54256 63.546000 Cu 0.879848 0.410413 2.99791e-20 697 63.546 0.0060115 -3.54244 63.546000 Cu 0.86964 0.392859 0.5 698 63.546 0.00280524 -3.54079 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 2.99791e-20 728 63.546 0.00507487 -3.53899 63.546000 Cu 0.809526 0.413056 0.5 753 63.546 0.00931231 -3.54321 63.546000 Cu 0.819173 0.430543 2.99791e-20 780 63.546 0.0234435 -3.5446 63.546000 Cu 0.0429155 0.439978 1.08524e-17 729 63.546 0.0412059 -3.52703 63.546000 Cu 0.178511 0.435486 1.19916e-19 733 63.546 0.0169778 -3.53417 63.546000 Cu 0.110419 0.437705 0.5 735 63.546 0.0316731 -3.52467 63.546000 Cu 0.0642536 0.476748 1.37904e-18 757 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 1.9996e-17 760 63.546 0.0522934 -3.4993 63.546000 Cu 0.194415 0.472179 0 761 63.546 0.897906 -3.41655 63.546000 Cu 0.185982 0.453555 0.5 762 63.546 0.155854 -3.50994 63.546000 Cu 0.131764 0.475845 0.5 763 63.546 0.39979 -3.46835 63.546000 Cu 0.25608 0.450611 8.99373e-20 764 63.546 0.0954568 -3.53503 63.546000 Cu 0.339121 0.463934 3.2977e-19 765 63.546 0.043061 -3.51401 63.546000 Cu 0.32872 0.447568 0.5 766 63.546 0.0269266 -3.53672 63.546000 Cu 0.26402 0.467429 0.5 767 63.546 0.84733 -3.44731 63.546000 Cu 0.402133 0.444804 1.9996e-17 768 63.546 0.0268531 -3.53693 63.546000 Cu 0.485746 0.459658 1.82872e-17 769 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 0.542916 0.439978 1.79875e-19 772 63.546 0.0412059 -3.52703 63.546000 Cu 0.55463 0.458247 0.5 775 63.546 0.109523 -3.52187 63.546000 Cu 0.494265 0.47727 0.5 793 63.546 0.174361 -3.53116 63.546000 Cu 0.564254 0.476748 3.03688e-17 795 63.546 0.216975 -3.52702 63.546000 Cu 0.423299 0.477816 1.09723e-17 791 63.546 0.36633 -3.49863 63.546000 Cu 0.76402 0.467429 0.5 11 63.546 0.84733 -3.44731 63.546000 Cu 0.694415 0.472179 1.01539e-16 387 63.546 0.897906 -3.41655 63.546000 Cu 0.631764 0.475845 0.5 398 63.546 0.39979 -3.46835 63.546000 Cu 0.620111 0.456164 6.49647e-17 773 63.546 0.0522934 -3.4993 63.546000 Cu 0.610419 0.437705 0.5 774 63.546 0.0316731 -3.52467 63.546000 Cu 0.678511 0.435486 1.24713e-17 776 63.546 0.0169778 -3.53417 63.546000 Cu 0.75608 0.450611 2.99791e-20 777 63.546 0.0954568 -3.53503 63.546000 Cu 0.685982 0.453555 0.5 779 63.546 0.155854 -3.50994 63.546000 Cu 0.839121 0.463934 2.09854e-19 3 63.546 0.043061 -3.51401 63.546000 Cu 0.902133 0.444804 1.73279e-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 4.19707e-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 0.82872 0.447568 0.5 781 63.546 0.0269266 -3.53672 63.546000 Cu 0.923299 0.477816 2.99791e-20 754 63.546 0.36633 -3.49863 63.546000 Cu 0.0640766 0.513204 3.39663e-17 6 63.546 0.213323 -3.5267 63.546000 Cu 0.131663 0.514058 0.5 8 63.546 0.439159 -3.46365 63.546000 Cu 0.194157 0.517774 2.95594e-17 10 63.546 1.0043 -3.40621 63.546000 Cu 0.0679561 0.494962 0.5 785 63.546 0.25528 -3.52827 63.546000 Cu 0.141299 0.494978 0 786 63.546 1.67867 -3.4993 63.546000 Cu 0.275291 0.506372 2.39833e-19 12 63.546 9.27142 -3.28998 63.546000 Cu 0.34647 0.509838 0.5 14 63.546 4.37656 -3.43685 63.546000 Cu 0.214023 0.494634 0.5 787 63.546 7.9073 -3.44886 63.546000 Cu 0.275972 0.483373 1.45698e-17 788 63.546 9.14654 -3.28703 63.546000 Cu 0.358938 0.494945 1.9996e-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 0.423106 0.512092 5.66305e-17 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 0.564077 0.513204 9.18559e-17 20 63.546 0.213323 -3.5267 63.546000 Cu 0.567956 0.494962 0.5 397 63.546 0.25528 -3.52827 63.546000 Cu 0.496959 0.494971 1.9996e-17 792 63.546 0.123309 -3.53848 63.546000 Cu 0.42711 0.494953 0.5 794 63.546 0.476237 -3.51321 63.546000 Cu 0.775291 0.506372 1.19916e-19 2 63.546 9.27142 -3.28998 63.546000 Cu 0.714023 0.494634 0.5 9 63.546 7.9073 -3.44886 63.546000 Cu 0.631663 0.514058 0.5 22 63.546 0.439159 -3.46365 63.546000 Cu 0.694157 0.517774 1.9996e-17 24 63.546 1.0043 -3.40621 63.546000 Cu 0.775972 0.483373 5.39324e-17 385 63.546 9.14654 -3.28703 63.546000 Cu 0.641299 0.494978 8.99373e-20 796 63.546 1.67867 -3.4993 63.546000 Cu 0.996959 0.494971 1.9996e-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 4.57781e-17 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 1.9996e-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 0.042429 0.549928 1.81373e-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 2.34736e-17 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 0.178225 0.554437 3.93026e-17 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 0.338563 0.525884 3.0129e-17 13 63.546 0.0391559 -3.5148 63.546000 Cu 0.263635 0.5224 0.5 15 63.546 0.930502 -3.44519 63.546000 Cu 0.255797 0.539293 2.69812e-19 40 63.546 0.0874012 -3.53587 63.546000 Cu 0.318814 0.559366 1.53793e-17 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 -3.54235 63.546000 Cu 0.390247 0.562107 0.5 47 63.546 0.0111998 -3.54296 63.546000 Cu 0.401562 0.545073 1.11282e-16 44 63.546 0.0235719 -3.53766 63.546000 Cu 0.485331 0.530271 1.9996e-17 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 0.554313 0.531671 0.5 23 63.546 0.111507 -3.52166 63.546000 Cu 0.461107 0.564884 4.23904e-17 45 63.546 0.00460634 -3.53893 63.546000 Cu 0.473161 0.547536 0.5 46 63.546 0.0409272 -3.53767 63.546000 Cu 0.542429 0.549928 5.99582e-20 48 63.546 0.0391834 -3.52684 63.546000 Cu 0.619835 0.533789 3.2977e-19 21 63.546 0.0577297 -3.49924 63.546000 Cu 0.755797 0.539293 1.9996e-17 25 63.546 0.0874012 -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 0.610066 0.552197 0.5 50 63.546 0.0300152 -3.52518 63.546000 Cu 0.678225 0.554437 1.49895e-19 52 63.546 0.016159 -3.53422 63.546000 Cu 0.747807 0.556779 0.5 54 63.546 0.0203824 -3.54235 63.546000 Cu 0.838563 0.525884 9.26354e-17 28 63.546 0.0391559 -3.5148 63.546000 Cu 0.901562 0.545073 1.9996e-17 29 63.546 0.0235719 -3.53766 63.546000 Cu 0.912145 0.528349 0.5 30 63.546 0.0641952 -3.53043 63.546000 Cu 0.828273 0.542305 0.5 31 63.546 0.0266121 -3.53759 63.546000 Cu 0.985331 0.530271 7.12903e-17 32 63.546 0.156844 -3.52406 63.546000 Cu 0.973161 0.547536 0.5 35 63.546 0.0409272 -3.53767 63.546000 Cu 0.818814 0.559366 1.9996e-17 56 63.546 0.0223915 -3.54437 63.546000 Cu 0.890247 0.562107 0.5 58 63.546 0.0111998 -3.54296 63.546000 Cu 0.961107 0.564884 1.9996e-17 60 63.546 0.00460634 -3.53893 63.546000 Cu 0.0201992 0.584966 4.34697e-17 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 5.19837e-17 64 63.546 0.0139731 -3.53467 63.546000 Cu 0.0904138 0.587514 0.5 65 63.546 0.00424657 -3.53808 63.546000 Cu 0.160376 0.589886 2.69812e-19 66 63.546 0.0033961 -3.53866 63.546000 Cu 0.169743 0.572243 0.5 67 63.546 0.00354797 -3.53776 63.546000 Cu 0.00984423 0.602342 0.5 90 63.546 0.000555759 -3.54001 63.546000 Cu 0.0802012 0.604925 3.89728e-19 92 63.546 0.000604268 -3.53951 63.546000 Cu 0.150397 0.607407 0.5 95 63.546 0.00144111 -3.53916 63.546000 Cu 0.239345 0.574475 4.89858e-17 68 63.546 0.00303404 -3.54113 63.546000 Cu 0.299722 0.59455 8.8888e-17 69 63.546 0.00126378 -3.54027 63.546000 Cu 0.309295 0.576875 0.5 70 63.546 0.00796296 -3.54279 63.546000 Cu 0.230106 0.592187 0.5 71 63.546 0.00117471 -3.53957 63.546000 Cu 0.379542 0.579492 4.89558e-17 72 63.546 0.00619223 -3.54223 63.546000 Cu 0.369498 0.597063 0.5 75 63.546 0.00227381 -3.54073 63.546000 Cu 0.530971 0.567561 0.5 51 63.546 0.0122319 -3.53517 63.546000 Cu 0.439548 0.599692 3.16879e-17 73 63.546 0.00177823 -3.54052 63.546000 Cu 0.449878 0.582245 0.5 74 63.546 0.00184335 -3.53998 63.546000 Cu 0.520199 0.584966 2.63816e-18 76 63.546 0.00225908 -3.53833 63.546000 Cu 0.580201 0.604925 1.9996e-17 77 63.546 0.000604268 -3.53951 63.546000 Cu 0.590414 0.587514 0.5 78 63.546 0.00424657 -3.53808 63.546000 Cu 0.509844 0.602342 0.5 79 63.546 0.000555759 -3.54001 63.546000 Cu 0.600436 0.57001 1.19916e-19 49 63.546 0.0139731 -3.53467 63.546000 Cu 0.739345 0.574475 1.49895e-19 53 63.546 0.00303404 -3.54113 63.546000 Cu 0.669743 0.572243 0.5 55 63.546 0.00354797 -3.53776 63.546000 Cu 0.660376 0.589886 5.99582e-20 80 63.546 0.0033961 -3.53866 63.546000 Cu 0.730106 0.592187 0.5 82 63.546 0.00117471 -3.53957 63.546000 Cu 0.650397 0.607407 0.5 83 63.546 0.00144111 -3.53916 63.546000 Cu 0.799722 0.59455 1.9996e-17 84 63.546 0.00126378 -3.54027 63.546000 Cu 0.879542 0.579492 1.9996e-17 57 63.546 0.00619223 -3.54223 63.546000 Cu 0.809295 0.576875 0.5 59 63.546 0.00796296 -3.54279 63.546000 Cu 0.949878 0.582245 0.5 63 63.546 0.00184335 -3.53998 63.546000 Cu 0.869498 0.597063 0.5 86 63.546 0.00227381 -3.54073 63.546000 Cu 0.939548 0.599692 3.89728e-19 88 63.546 0.00177823 -3.54052 63.546000 Cu 0.0700368 0.622357 0.5 93 63.546 0.000138055 -3.54033 63.546000 Cu 0.140194 0.624889 4.02919e-17 94 63.546 0.000258028 -3.53974 63.546000 Cu 0.0599139 0.639844 1.79875e-19 120 63.546 9.53589e-05 -3.54053 63.546000 Cu 0.130026 0.64238 0.5 122 63.546 3.53636e-05 -3.5401 63.546000 Cu 0.200101 0.644897 7.97144e-17 124 63.546 8.34195e-05 -3.53971 63.546000 Cu 0.220293 0.60982 1.9996e-17 96 63.546 0.00109049 -3.53907 63.546000 Cu 0.280085 0.629843 1.48996e-17 97 63.546 0.000316282 -3.53932 63.546000 Cu 0.289982 0.612227 0.5 98 63.546 0.00023963 -3.53945 63.546000 Cu 0.210188 0.627379 0.5 99 63.546 0.000413456 -3.53934 63.546000 Cu 0.359701 0.614688 4.25703e-18 100 63.546 0.00049498 -3.54003 63.546000 Cu 0.349918 0.632301 0.5 103 63.546 8.26196e-05 -3.53967 63.546000 Cu 0.270089 0.647393 0.5 126 63.546 0.000113112 -3.53954 63.546000 Cu 0.340007 0.649876 1.9996e-17 128 63.546 6.18718e-05 -3.53968 63.546000 Cu 0.419817 0.634784 8.99373e-20 101 63.546 0.000185623 -3.54026 63.546000 Cu 0.429636 0.617218 0.5 102 63.546 0.000815819 -3.54054 63.546000 Cu 0.499809 0.61979 3.3037e-17 104 63.546 0.000412293 -3.54065 63.546000 Cu 0.559914 0.639844 0 105 63.546 9.53589e-05 -3.54053 63.546000 Cu 0.570037 0.622357 0.5 106 63.546 0.000138055 -3.54033 63.546000 Cu 0.489812 0.637303 0.5 107 63.546 0.000257523 -3.54061 63.546000 Cu 0.720293 0.60982 8.99373e-20 81 63.546 0.00109049 -3.53907 63.546000 Cu 0.789982 0.612227 0.5 87 63.546 0.00023963 -3.53945 63.546000 Cu 0.640194 0.624889 1.9996e-17 108 63.546 0.000258028 -3.53974 63.546000 Cu 0.700101 0.644897 4.41592e-17 109 63.546 8.34195e-05 -3.53971 63.546000 Cu 0.710188 0.627379 0.5 110 63.546 0.000413456 -3.53934 63.546000 Cu 0.630026 0.64238 0.5 111 63.546 3.53636e-05 -3.5401 63.546000 Cu 0.780085 0.629843 1.19916e-19 112 63.546 0.000316282 -3.53932 63.546000 Cu 0.770089 0.647393 0.5 115 63.546 0.000113112 -3.53954 63.546000 Cu 0.859701 0.614688 1.9996e-17 85 63.546 0.00049498 -3.54003 63.546000 Cu 0.999809 0.61979 2.99791e-19 89 63.546 0.000412293 -3.54065 63.546000 Cu 0.929636 0.617218 0.5 91 63.546 0.000815819 -3.54054 63.546000 Cu 0.840007 0.649876 7.40783e-17 113 63.546 6.18718e-05 -3.53968 63.546000 Cu 0.849918 0.632301 0.5 114 63.546 8.26196e-05 -3.53967 63.546000 Cu 0.919817 0.634784 3.59749e-19 116 63.546 0.000185623 -3.54026 63.546000 Cu 0.989812 0.637303 0.5 118 63.546 0.000257523 -3.54061 63.546000 Cu 0.119971 0.659886 2.99791e-20 121 63.546 1.98861e-05 -3.54024 63.546000 Cu 0.049886 0.657363 0.5 123 63.546 7.27666e-05 -3.54036 63.546000 Cu 0.190036 0.662411 0.5 127 63.546 1.48872e-05 -3.54008 63.546000 Cu 0.0399325 0.674896 1.79875e-19 148 63.546 2.46505e-05 -3.54014 63.546000 Cu 0.0999317 0.694936 7.28492e-18 149 63.546 1.57729e-05 -3.53999 63.546000 Cu 0.109951 0.677409 0.5 150 63.546 1.39284e-05 -3.54023 63.546000 Cu 0.0299455 0.692428 0.5 151 63.546 8.65581e-06 -3.53992 63.546000 Cu 0.179973 0.679931 2.99791e-20 152 63.546 6.22748e-06 -3.54018 63.546000 Cu 0.260037 0.664926 5.36925e-17 125 63.546 3.72007e-05 -3.53993 63.546000 Cu 0.399948 0.669914 1.19916e-19 129 63.546 2.8305e-05 -3.53983 63.546000 Cu 0.329997 0.667427 0.5 131 63.546 5.32448e-05 -3.53982 63.546000 Cu 0.250004 0.68245 0.5 154 63.546 2.57625e-05 -3.54002 63.546000 Cu 0.32002 0.684954 2.53923e-17 156 63.546 2.95537e-05 -3.53985 63.546000 Cu 0.390015 0.687445 0.5 158 63.546 1.47565e-05 -3.53979 63.546000 Cu 0.409902 0.652359 0.5 130 63.546 2.21299e-05 -3.54001 63.546000 Cu 0.479849 0.654852 9.1736e-18 132 63.546 7.49171e-05 -3.5403 63.546000 Cu 0.539932 0.674896 2.09854e-19 133 63.546 2.46505e-05 -3.54014 63.546000 Cu 0.549886 0.657363 0.5 134 63.546 7.27666e-05 -3.54036 63.546000 Cu 0.469932 0.6724 0.5 135 63.546 1.22056e-05 -3.53997 63.546000 Cu 0.459982 0.689932 2.39833e-19 160 63.546 4.7861e-06 -3.53982 63.546000 Cu 0.529945 0.692428 0.5 162 63.546 8.65581e-06 -3.53992 63.546000 Cu 0.599932 0.694936 3.06686e-17 164 63.546 1.57729e-05 -3.53999 63.546000 Cu 0.619971 0.659886 1.68782e-17 136 63.546 1.98861e-05 -3.54024 63.546000 Cu 0.679973 0.679931 1.19916e-19 137 63.546 6.22748e-06 -3.54018 63.546000 Cu 0.690036 0.662411 0.5 138 63.546 1.48872e-05 -3.54008 63.546000 Cu 0.609951 0.677409 0.5 139 63.546 1.39284e-05 -3.54023 63.546000 Cu 0.760037 0.664926 1.80174e-17 140 63.546 3.72007e-05 -3.53993 63.546000 Cu 0.750004 0.68245 0.5 143 63.546 2.57625e-05 -3.54002 63.546000 Cu 0.979849 0.654852 2.09854e-19 117 63.546 7.49171e-05 -3.5403 63.546000 Cu 0.909902 0.652359 0.5 119 63.546 2.21299e-05 -3.54001 63.546000 Cu 0.82002 0.684954 1.9996e-17 141 63.546 2.95537e-05 -3.53985 63.546000 Cu 0.829997 0.667427 0.5 142 63.546 5.32448e-05 -3.53982 63.546000 Cu 0.899948 0.669914 1.49895e-19 144 63.546 2.8305e-05 -3.53983 63.546000 Cu 0.959982 0.689932 2.09854e-19 145 63.546 4.7861e-06 -3.53982 63.546000 Cu 0.969932 0.6724 0.5 146 63.546 1.22056e-05 -3.53997 63.546000 Cu 0.890015 0.687445 0.5 147 63.546 1.47565e-05 -3.53979 63.546000 Cu 0.169954 0.697449 0.5 155 63.546 1.14748e-05 -3.53999 63.546000 Cu 0.0199678 0.709954 2.99791e-20 176 63.546 3.02216e-06 -3.53984 63.546000 Cu 0.0799919 0.729974 1.19916e-19 177 63.546 4.06889e-06 -3.53998 63.546000 Cu 0.0899512 0.712453 0.5 178 63.546 9.05767e-06 -3.53986 63.546000 Cu 0.0100014 0.727477 0.5 179 63.546 2.1869e-06 -3.5399 63.546000 Cu 0.159964 0.714958 0 180 63.546 8.37385e-06 -3.53988 63.546000 Cu 0.149989 0.732475 0.5 183 63.546 8.73831e-06 -3.54005 63.546000 Cu 0.239999 0.699961 0 153 63.546 6.23768e-06 -3.53992 63.546000 Cu 0.380036 0.704966 9.41643e-17 157 63.546 1.62432e-05 -3.53983 63.546000 Cu 0.310034 0.702467 0.5 159 63.546 1.53316e-05 -3.53987 63.546000 Cu 0.219994 0.734981 1.79875e-19 181 63.546 1.13366e-05 -3.54008 63.546000 Cu 0.229989 0.717466 0.5 182 63.546 5.82563e-06 -3.53988 63.546000 Cu 0.300011 0.719975 5.99582e-20 184 63.546 3.65494e-06 -3.53987 63.546000 Cu 0.370019 0.72248 0.5 186 63.546 3.74326e-06 -3.53985 63.546000 Cu 0.290002 0.737491 0.5 187 63.546 1.00985e-05 -3.54008 63.546000 Cu 0.519968 0.709954 2.09854e-19 161 63.546 3.02216e-06 -3.53984 63.546000 Cu 0.450005 0.707459 0.5 163 63.546 3.63958e-06 -3.53983 63.546000 Cu 0.589951 0.712453 0.5 167 63.546 9.05767e-06 -3.53986 63.546000 Cu 0.440013 0.724981 1.60988e-17 188 63.546 3.60873e-06 -3.53986 63.546000 Cu 0.510001 0.727477 0.5 190 63.546 2.1869e-06 -3.5399 63.546000 Cu 0.579992 0.729974 1.39403e-17 192 63.546 4.06889e-06 -3.53998 63.546000 Cu 0.659964 0.714958 2.09854e-19 165 63.546 8.37385e-06 -3.53988 63.546000 Cu 0.669954 0.697449 0.5 166 63.546 1.14748e-05 -3.53999 63.546000 Cu 0.739999 0.699961 1.9996e-17 168 63.546 6.23768e-06 -3.53992 63.546000 Cu 0.729989 0.717466 0.5 171 63.546 5.82563e-06 -3.53988 63.546000 Cu 0.649989 0.732475 0.5 194 63.546 8.73831e-06 -3.54005 63.546000 Cu 0.719994 0.734981 2.96793e-18 196 63.546 1.13366e-05 -3.54008 63.546000 Cu 0.790002 0.737491 0.5 198 63.546 1.00985e-05 -3.54008 63.546000 Cu 0.800011 0.719975 1.49895e-19 169 63.546 3.65494e-06 -3.53987 63.546000 Cu 0.810034 0.702467 0.5 170 63.546 1.53316e-05 -3.53987 63.546000 Cu 0.880036 0.704966 1.9996e-17 172 63.546 1.62432e-05 -3.53983 63.546000 Cu 0.940013 0.724981 1.26212e-17 173 63.546 3.60873e-06 -3.53986 63.546000 Cu 0.950005 0.707459 0.5 174 63.546 3.63958e-06 -3.53983 63.546000 Cu 0.870019 0.72248 0.5 175 63.546 3.74326e-06 -3.53985 63.546000 Cu 0.0600082 0.765028 7.4558e-17 205 63.546 2.36988e-06 -3.53997 63.546000 Cu 0.070011 0.747501 0.5 206 63.546 1.69898e-06 -3.54006 63.546000 Cu 0.130012 0.76753 0.5 208 63.546 4.03867e-06 -3.54 63.546000 Cu 0.140014 0.750003 1.49895e-19 209 63.546 2.32796e-06 -3.54015 63.546000 Cu 0.050009 0.782554 0.5 234 63.546 7.78946e-06 -3.53983 63.546000 Cu 1.1668e-05 0.745002 1.427e-17 204 63.546 8.3958e-07 -3.54 63.546000 Cu 0.200029 0.770038 1.81973e-17 210 63.546 1.04481e-05 -3.54006 63.546000 Cu 0.360009 0.739998 1.19916e-19 185 63.546 6.43734e-06 -3.54004 63.546000 Cu 0.210021 0.752511 0.5 211 63.546 1.26227e-06 -3.54023 63.546000 Cu 0.280028 0.755021 5.27632e-18 212 63.546 7.84806e-07 -3.54025 63.546000 Cu 0.340068 0.775059 5.32429e-17 213 63.546 2.03659e-05 -3.54004 63.546000 Cu 0.35003 0.757529 0.5 214 63.546 1.7144e-06 -3.5402 63.546000 Cu 0.270052 0.772549 0.5 215 63.546 1.95495e-05 -3.54008 63.546000 Cu 0.500012 0.745002 2.10453e-17 189 63.546 8.3958e-07 -3.54 63.546000 Cu 0.430012 0.742502 0.5 191 63.546 2.52627e-06 -3.54 63.546000 Cu 0.570011 0.747501 0.5 195 63.546 1.69898e-06 -3.54006 63.546000 Cu 0.420025 0.760031 8.81385e-18 216 63.546 2.34244e-06 -3.54009 63.546000 Cu 0.48004 0.780059 5.13242e-17 217 63.546 2.1832e-06 -3.53989 63.546000 Cu 0.490015 0.76253 0.5 218 63.546 2.40502e-06 -3.54 63.546000 Cu 0.410064 0.777562 0.5 219 63.546 9.17174e-06 -3.53996 63.546000 Cu 0.560008 0.765028 1.9996e-17 220 63.546 2.36988e-06 -3.53997 63.546000 Cu 0.550009 0.782554 0.5 223 63.546 7.78946e-06 -3.53983 63.546000 Cu 0.640014 0.750003 1.19916e-19 193 63.546 2.32796e-06 -3.54015 63.546000 Cu 0.780028 0.755021 2.09854e-19 197 63.546 7.84806e-07 -3.54025 63.546000 Cu 0.710021 0.752511 0.5 199 63.546 1.26227e-06 -3.54023 63.546000 Cu 0.630012 0.76753 0.5 222 63.546 4.03867e-06 -3.54 63.546000 Cu 0.700029 0.770038 1.79875e-19 224 63.546 1.04481e-05 -3.54006 63.546000 Cu 0.770052 0.772549 0.5 226 63.546 1.95495e-05 -3.54008 63.546000 Cu 0.860009 0.739998 1.19916e-19 200 63.546 6.43734e-06 -3.54004 63.546000 Cu 0.920025 0.760031 8.79287e-17 201 63.546 2.34244e-06 -3.54009 63.546000 Cu 0.930012 0.742502 0.5 202 63.546 2.52627e-06 -3.54 63.546000 Cu 0.85003 0.757529 0.5 203 63.546 1.7144e-06 -3.5402 63.546000 Cu 0.990015 0.76253 0.5 207 63.546 2.40502e-06 -3.54 63.546000 Cu 0.840068 0.775059 2.863e-17 228 63.546 2.03659e-05 -3.54004 63.546000 Cu 0.910064 0.777562 0.5 230 63.546 9.17174e-06 -3.53996 63.546000 Cu 0.98004 0.780059 4.83862e-17 232 63.546 2.1832e-06 -3.53989 63.546000 Cu 0.0400314 0.800084 8.99373e-20 233 63.546 7.25978e-06 -3.53987 63.546000 Cu 0.119992 0.785049 3.74739e-18 236 63.546 1.43581e-05 -3.53981 63.546000 Cu 0.109992 0.80257 0.5 237 63.546 3.29983e-05 -3.53981 63.546000 Cu 0.179986 0.805058 2.39833e-19 238 63.546 5.21611e-05 -3.53981 63.546000 Cu 0.190005 0.78755 0.5 239 63.546 8.54761e-06 -3.5398 63.546000 Cu 0.0300931 0.817625 0.5 262 63.546 2.08527e-05 -3.53993 63.546000 Cu 0.100051 0.820107 8.81385e-18 264 63.546 1.41431e-05 -3.5398 63.546000 Cu 0.170004 0.822585 0.5 267 63.546 7.53319e-05 -3.53979 63.546000 Cu 0.260044 0.790058 1.79875e-19 240 63.546 3.01275e-06 -3.5398 63.546000 Cu 0.320063 0.810077 5.99582e-20 241 63.546 1.99673e-05 -3.53998 63.546000 Cu 0.330087 0.792572 0.5 242 63.546 1.64291e-05 -3.53983 63.546000 Cu 0.250019 0.807559 0.5 243 63.546 3.90808e-05 -3.53987 63.546000 Cu 0.390099 0.812604 0.5 247 63.546 2.53191e-05 -3.54007 63.546000 Cu 0.239977 0.825079 1.49895e-19 268 63.546 8.19044e-05 -3.53992 63.546000 Cu 0.400104 0.795085 1.49895e-19 244 63.546 2.64182e-05 -3.53987 63.546000 Cu 0.46011 0.815124 8.99373e-20 245 63.546 3.9487e-05 -3.54005 63.546000 Cu 0.470082 0.79759 0.5 246 63.546 1.25725e-05 -3.53989 63.546000 Cu 0.540031 0.800084 1.9996e-17 248 63.546 7.25978e-06 -3.53987 63.546000 Cu 0.530093 0.817625 0.5 251 63.546 2.08527e-05 -3.53993 63.546000 Cu 0.600051 0.820107 5.99582e-20 249 63.546 1.41431e-05 -3.5398 63.546000 Cu 0.619992 0.785049 1.85571e-17 221 63.546 1.43581e-05 -3.53981 63.546000 Cu 0.760044 0.790058 5.5941e-17 225 63.546 3.01275e-06 -3.5398 63.546000 Cu 0.690005 0.78755 0.5 227 63.546 8.54761e-06 -3.5398 63.546000 Cu 0.609992 0.80257 0.5 250 63.546 3.29983e-05 -3.53981 63.546000 Cu 0.679986 0.805058 1.19916e-19 252 63.546 5.21611e-05 -3.53981 63.546000 Cu 0.739977 0.825079 1.49895e-19 253 63.546 8.19044e-05 -3.53992 63.546000 Cu 0.750019 0.807559 0.5 254 63.546 3.90808e-05 -3.53987 63.546000 Cu 0.670004 0.822585 0.5 255 63.546 7.53319e-05 -3.53979 63.546000 Cu 0.900104 0.795085 7.41083e-17 229 63.546 2.64182e-05 -3.53987 63.546000 Cu 0.830087 0.792572 0.5 231 63.546 1.64291e-05 -3.53983 63.546000 Cu 0.970082 0.79759 0.5 235 63.546 1.25725e-05 -3.53989 63.546000 Cu 0.820063 0.810077 2.74009e-17 256 63.546 1.99673e-05 -3.53998 63.546000 Cu 0.890099 0.812604 0.5 258 63.546 2.53191e-05 -3.54007 63.546000 Cu 0.96011 0.815124 1.27111e-17 260 63.546 3.9487e-05 -3.54005 63.546000 Cu 0.020183 0.835168 5.36626e-18 261 63.546 7.93205e-05 -3.5402 63.546000 Cu 0.0901528 0.837661 0.5 265 63.546 4.29363e-05 -3.53994 63.546000 Cu 0.160049 0.84014 1.9996e-17 266 63.546 5.81451e-05 -3.53967 63.546000 Cu 0.0102515 0.852715 0.5 290 63.546 0.000223082 -3.54064 63.546000 Cu 0.0802597 0.855238 6.29561e-18 292 63.546 0.000194485 -3.54029 63.546000 Cu 0.150127 0.857726 0.5 295 63.546 6.95064e-05 -3.53967 63.546000 Cu 0.299895 0.845118 1.61887e-18 269 63.546 0.000120984 -3.53986 63.546000 Cu 0.309985 0.827595 0.5 270 63.546 2.4789e-05 -3.54014 63.546000 Cu 0.229926 0.842619 0.5 271 63.546 0.000156079 -3.53962 63.546000 Cu 0.380047 0.830125 2.09854e-19 272 63.546 1.45603e-05 -3.5403 63.546000 Cu 0.369973 0.847639 0.5 275 63.546 3.25729e-05 -3.54024 63.546000 Cu 0.219945 0.860187 0 296 63.546 0.00022089 -3.53928 63.546000 Cu 0.289822 0.862647 0.5 298 63.546 0.000420508 -3.53938 63.546000 Cu 0.359856 0.865136 2.99791e-20 300 63.546 0.0002543 -3.53989 63.546000 Cu 0.440127 0.850176 5.99582e-20 273 63.546 8.37208e-05 -3.54058 63.546000 Cu 0.450128 0.832654 0.5 274 63.546 6.00616e-05 -3.54032 63.546000 Cu 0.520183 0.835168 1.19916e-19 276 63.546 7.93205e-05 -3.5402 63.546000 Cu 0.58026 0.855238 3.34866e-17 277 63.546 0.000194485 -3.54029 63.546000 Cu 0.590153 0.837661 0.5 278 63.546 4.29363e-05 -3.53994 63.546000 Cu 0.510251 0.852715 0.5 279 63.546 0.000223082 -3.54064 63.546000 Cu 0.430041 0.867669 0.5 302 63.546 0.000114267 -3.54042 63.546000 Cu 0.660049 0.84014 1.49895e-19 280 63.546 5.81451e-05 -3.53967 63.546000 Cu 0.719945 0.860187 4.61078e-17 281 63.546 0.00022089 -3.53928 63.546000 Cu 0.729926 0.842619 0.5 282 63.546 0.000156079 -3.53962 63.546000 Cu 0.650127 0.857726 0.5 283 63.546 6.95064e-05 -3.53967 63.546000 Cu 0.799895 0.845118 1.07625e-17 284 63.546 0.000120984 -3.53986 63.546000 Cu 0.789822 0.862647 0.5 287 63.546 0.000420508 -3.53938 63.546000 Cu 0.880047 0.830125 5.92387e-17 257 63.546 1.45603e-05 -3.5403 63.546000 Cu 0.809985 0.827595 0.5 259 63.546 2.4789e-05 -3.54014 63.546000 Cu 0.950128 0.832654 0.5 263 63.546 6.00616e-05 -3.54032 63.546000 Cu 0.859856 0.865136 0 285 63.546 0.0002543 -3.53989 63.546000 Cu 0.869973 0.847639 0.5 286 63.546 3.25729e-05 -3.54024 63.546000 Cu 0.940127 0.850176 2.99791e-20 288 63.546 8.37208e-05 -3.54058 63.546000 Cu 0.930041 0.867669 0.5 291 63.546 0.000114267 -3.54042 63.546000 Cu 0.0704062 0.872811 0.5 293 63.546 0.000791712 -3.54046 63.546000 Cu 0.140332 0.875342 1.49895e-19 294 63.546 0.000476915 -3.53984 63.546000 Cu 0.0604898 0.890339 8.99373e-20 320 63.546 0.00182252 -3.54052 63.546000 Cu 0.120463 0.910543 4.49686e-18 321 63.546 0.00591455 -3.5422 63.546000 Cu 0.130542 0.892968 0.5 322 63.546 0.002334 -3.54066 63.546000 Cu 0.0501145 0.907791 0.5 323 63.546 0.00169606 -3.54016 63.546000 Cu 0.000267515 0.870238 1.44199e-17 289 63.546 0.000425207 -3.54067 63.546000 Cu 0.200329 0.89548 2.56621e-17 324 63.546 0.00116142 -3.5405 63.546000 Cu 0.27978 0.880211 1.73879e-17 297 63.546 0.000957712 -3.53914 63.546000 Cu 0.210056 0.877801 0.5 299 63.546 0.000221281 -3.53939 63.546000 Cu 0.34968 0.882628 0.5 303 63.546 0.00134268 -3.53923 63.546000 Cu 0.269983 0.897852 0.5 326 63.546 0.000988347 -3.53956 63.546000 Cu 0.339668 0.900156 4.17609e-17 328 63.546 0.00338102 -3.5385 63.546000 Cu 0.419845 0.885113 1.01329e-17 301 63.546 0.000571583 -3.53954 63.546000 Cu 0.500268 0.870238 8.99373e-20 304 63.546 0.000425207 -3.54067 63.546000 Cu 0.56049 0.890339 2.99791e-20 305 63.546 0.00182252 -3.54052 63.546000 Cu 0.570406 0.872811 0.5 306 63.546 0.000791712 -3.54046 63.546000 Cu 0.490176 0.887691 0.5 307 63.546 0.000487799 -3.54006 63.546000 Cu 0.409619 0.90253 0.5 330 63.546 0.00404653 -3.53788 63.546000 Cu 0.479784 0.905077 1.79875e-19 332 63.546 0.00212536 -3.53826 63.546000 Cu 0.550114 0.907791 0.5 334 63.546 0.00169606 -3.54016 63.546000 Cu 0.640332 0.875342 5.99582e-20 308 63.546 0.000476915 -3.53984 63.546000 Cu 0.700329 0.89548 2.99791e-20 309 63.546 0.00116142 -3.5405 63.546000 Cu 0.710056 0.877801 0.5 310 63.546 0.000221281 -3.53939 63.546000 Cu 0.630542 0.892968 0.5 311 63.546 0.002334 -3.54066 63.546000 Cu 0.77978 0.880211 2.12252e-17 312 63.546 0.000957712 -3.53914 63.546000 Cu 0.769983 0.897852 0.5 315 63.546 0.000988347 -3.53956 63.546000 Cu 0.620463 0.910543 2.32937e-17 336 63.546 0.00591455 -3.5422 63.546000 Cu 0.839668 0.900156 3.38764e-18 313 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 3.2947e-17 316 63.546 0.000571583 -3.53954 63.546000 Cu 0.979784 0.905077 1.49895e-19 317 63.546 0.00212536 -3.53826 63.546000 Cu 0.990176 0.887691 0.5 318 63.546 0.000487799 -3.54006 63.546000 Cu 0.909619 0.90253 0.5 319 63.546 0.00404653 -3.53788 63.546000 Cu 0.190744 0.913165 0.5 327 63.546 0.00787036 -3.54285 63.546000 Cu 0.0388965 0.925157 2.09854e-19 348 63.546 0.00449901 -3.53919 63.546000 Cu 0.0984766 0.944976 1.19916e-19 349 63.546 0.0233854 -3.53766 63.546000 Cu 0.1098 0.927935 0.5 350 63.546 0.0108874 -3.54299 63.546000 Cu 0.026873 0.942509 0.5 351 63.546 0.0402617 -3.53776 63.546000 Cu 0.181201 0.930674 3.71741e-18 352 63.546 0.021416 -3.54445 63.546000 Cu 0.17175 0.947756 0.5 355 63.546 0.0280453 -3.53769 63.546000 Cu 0.26072 0.915562 1.19916e-19 325 63.546 0.00283861 -3.54104 63.546000 Cu 0.39957 0.920039 1.9996e-17 329 63.546 0.0133395 -3.53448 63.546000 Cu 0.330284 0.917799 0.5 331 63.546 0.00336179 -3.53773 63.546000 Cu 0.244203 0.95075 7.79456e-17 353 63.546 0.0862662 -3.53579 63.546000 Cu 0.25218 0.933266 0.5 354 63.546 0.0201169 -3.54222 63.546000 Cu 0.321737 0.935607 3.55552e-17 356 63.546 0.0155332 -3.53425 63.546000 Cu 0.38017 0.956257 5.99582e-20 357 63.546 0.0580879 -3.49931 63.546000 Cu 0.38995 0.937852 0.5 358 63.546 0.0294569 -3.52518 63.546000 Cu 0.314251 0.953673 0.5 359 63.546 0.149351 -3.50936 63.546000 Cu 0.538896 0.925157 1.9996e-17 333 63.546 0.00449901 -3.53919 63.546000 Cu 0.468973 0.922479 0.5 335 63.546 0.0124932 -3.53501 63.546000 Cu 0.45757 0.940124 8.99373e-20 360 63.546 0.0387344 -3.52703 63.546000 Cu 0.526873 0.942509 0.5 362 63.546 0.0402617 -3.53776 63.546000 Cu 0.598477 0.944976 2.64416e-17 364 63.546 0.0233854 -3.53766 63.546000 Cu 0.690744 0.913165 0.5 338 63.546 0.00787036 -3.54285 63.546000 Cu 0.681201 0.930674 5.03948e-17 337 63.546 0.021416 -3.54445 63.546000 Cu 0.6098 0.927935 0.5 339 63.546 0.0108874 -3.54299 63.546000 Cu 0.76072 0.915562 2.99791e-20 340 63.546 0.00283861 -3.54104 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 6.5954e-18 368 63.546 0.0862662 -3.53579 63.546000 Cu 0.821737 0.935607 1.19916e-19 341 63.546 0.0155332 -3.53425 63.546000 Cu 0.830284 0.917799 0.5 342 63.546 0.00336179 -3.53773 63.546000 Cu 0.89957 0.920039 1.49596e-17 344 63.546 0.0133395 -3.53448 63.546000 Cu 0.95757 0.940124 2.66814e-17 345 63.546 0.0387344 -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 0.0294569 -3.52518 63.546000 Cu 0.814251 0.953673 0.5 370 63.546 0.149351 -3.50936 63.546000 Cu 0.88017 0.956257 5.99582e-20 372 63.546 0.0580879 -3.49931 63.546000 Cu 0.0147162 0.95979 2.45828e-18 376 63.546 0.152974 -3.52422 63.546000 Cu 0.0769438 0.977975 1.79875e-19 377 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 0.175621 -3.53029 63.546000 Cu 0.161465 0.964174 8.24425e-18 380 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 0.0728582 0.995117 0.5 401 63.546 0.4782 -3.51313 63.546000 Cu 0.141051 0.99512 9.77018e-17 402 63.546 6.22687 -3.22467 63.546000 Cu 0.00302653 0.995084 3.20476e-17 400 63.546 0.123259 -3.53841 63.546000 Cu 0.358663 0.995065 2.40432e-17 410 63.546 1.68844 -3.49901 63.546000 Cu 0.285944 0.995484 0.5 411 63.546 7.93642 -3.44829 63.546000 Cu 0.224738 0.983686 9.65327e-18 381 63.546 9.28705 -3.29087 63.546000 Cu 0.236404 0.967661 0.5 382 63.546 0.94433 -3.4451 63.546000 Cu 0.30586 0.972276 4.42192e-17 384 63.546 1.01631 -3.40524 63.546000 Cu 0.368377 0.975996 0.5 386 63.546 0.440431 -3.46296 63.546000 Cu 0.514716 0.95979 1.9996e-17 361 63.546 0.152974 -3.52422 63.546000 Cu 0.445718 0.958385 0.5 363 63.546 0.110805 -3.52174 63.546000 Cu 0.587799 0.961699 0.5 367 63.546 0.0658574 -3.53044 63.546000 Cu 0.435916 0.976852 3.59749e-17 388 63.546 0.214793 -3.52638 63.546000 Cu 0.503027 0.995084 8.99373e-20 389 63.546 0.123259 -3.53841 63.546000 Cu 0.505947 0.9774 0.5 390 63.546 0.175621 -3.53029 63.546000 Cu 0.43204 0.995102 0.5 391 63.546 0.254778 -3.5282 63.546000 Cu 0.576944 0.977975 6.96714e-17 392 63.546 0.375167 -3.49698 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 0.661465 0.964174 1.19916e-19 365 63.546 0.0378756 -3.51471 63.546000 Cu 0.736404 0.967661 0.5 371 63.546 0.94433 -3.4451 63.546000 Cu 0.641051 0.99512 1.9996e-17 393 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 0.724738 0.983686 1.49895e-19 396 63.546 9.28705 -3.29087 63.546000 Cu 0.858663 0.995065 3.99921e-17 403 63.546 1.68844 -3.49901 63.546000 Cu 0.80586 0.972276 5.54613e-17 369 63.546 1.01631 -3.40524 63.546000 Cu 0.935916 0.976852 2.39833e-19 373 63.546 0.214793 -3.52638 63.546000 Cu 0.945718 0.958385 0.5 374 63.546 0.110805 -3.52174 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