Number of particles = 796 A = 1 Angstrom (basic length-scale) H0(1,1) = 25.5932 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 102.532 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60761 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 0.0555795 0.0332068 0 423 63.546 0.907871 -3.43136 63.546000 Cu 0.034932 0.0109264 0.5 424 63.546 8.65339 -3.55211 63.546000 Cu 0.106402 0.00980544 3.53426e-17 426 63.546 2.4361 -3.52249 63.546000 Cu 0.117879 0.0291762 0.5 429 63.546 0.471229 -3.47366 63.546000 Cu 0.185565 0.0283027 1 427 63.546 0.233069 -3.52057 63.546000 Cu 0.180895 0.00993936 0.5 428 63.546 0.407399 -3.52476 63.546000 Cu 0.252666 0.00999816 1 430 63.546 0.171613 -3.53388 63.546000 Cu 0.326602 0.0273382 1.21776e-16 431 63.546 0.333266 -3.50704 63.546000 Cu 0.323112 0.0100162 0.5 432 63.546 0.492206 -3.50014 63.546000 Cu 0.25565 0.0277893 0.5 433 63.546 0.161595 -3.52888 63.546000 Cu 0.391674 0.0100526 2.4307e-16 434 63.546 6.42194 -3.2171 63.546000 Cu 0.474141 0.0218528 7.24883e-17 435 63.546 8.99128 -3.31258 63.546000 Cu 0.403139 0.0253484 0.5 437 63.546 4.38159 -3.46015 63.546000 Cu 0.485854 0.0381636 0.5 464 63.546 0.84849 -3.45489 63.546000 Cu 0.606402 0.00980544 5.085e-17 402 63.546 2.4361 -3.52249 63.546000 Cu 0.534932 0.0109264 0.5 403 63.546 8.65339 -3.55211 63.546000 Cu 0.55558 0.0332068 5.09702e-17 410 63.546 0.907871 -3.43136 63.546000 Cu 0.617879 0.0291762 0.5 412 63.546 0.471229 -3.47366 63.546000 Cu 0.680895 0.00993936 0.5 405 63.546 0.407399 -3.52476 63.546000 Cu 0.685565 0.0283027 2.90915e-17 414 63.546 0.233069 -3.52057 63.546000 Cu 0.752666 0.00999816 2.90915e-17 404 63.546 0.171613 -3.53388 63.546000 Cu 0.823112 0.0100162 0.5 407 63.546 0.492206 -3.50014 63.546000 Cu 0.75565 0.0277893 0.5 416 63.546 0.161595 -3.52888 63.546000 Cu 0.826602 0.0273382 1 418 63.546 0.333266 -3.50704 63.546000 Cu 0.891674 0.0100526 1 406 63.546 6.42194 -3.2171 63.546000 Cu 0.903139 0.0253484 0.5 420 63.546 4.38159 -3.46015 63.546000 Cu 0.974141 0.0218528 1 422 63.546 8.99128 -3.31258 63.546000 Cu 0.985854 0.0381636 0.5 425 63.546 0.84849 -3.45489 63.546000 Cu 0.0713946 0.0701592 1 451 63.546 0.0226235 -3.53339 63.546000 Cu 0.064046 0.0520103 0.5 452 63.546 0.185392 -3.51057 63.546000 Cu 0.130213 0.0493139 1.68779e-16 454 63.546 0.0820838 -3.50199 63.546000 Cu 0.139735 0.0678469 0.5 457 63.546 0.0369477 -3.52234 63.546000 Cu 0.00164655 0.0725788 0.5 453 63.546 0.0229544 -3.54095 63.546000 Cu 0.207431 0.0655538 1.21776e-16 455 63.546 0.0409088 -3.52577 63.546000 Cu 0.195634 0.0470613 0.5 456 63.546 0.107542 -3.52701 63.546000 Cu 0.264211 0.0456575 1.9234e-18 458 63.546 0.152337 -3.52424 63.546000 Cu 0.276182 0.0631576 0.5 461 63.546 0.0417629 -3.53822 63.546000 Cu 0.218398 0.0832208 0.5 485 63.546 0.0124128 -3.53032 63.546000 Cu 0.288019 0.0806171 4.49596e-17 487 63.546 0.00631869 -3.53487 63.546000 Cu 0.410468 0.0417674 1.70582e-16 462 63.546 0.0813947 -3.51395 63.546000 Cu 0.347229 0.060828 2.90915e-17 459 63.546 0.0357743 -3.53724 63.546000 Cu 0.336885 0.0438887 0.5 460 63.546 0.0714708 -3.53914 63.546000 Cu 0.493741 0.0551718 2.90915e-17 463 63.546 0.102816 -3.53897 63.546000 Cu 0.420807 0.0581874 0.5 465 63.546 0.0239458 -3.53601 63.546000 Cu 0.358642 0.0778713 0.5 489 63.546 0.0106345 -3.543 63.546000 Cu 0.430236 0.0751584 1.21415e-16 491 63.546 0.0205237 -3.54383 63.546000 Cu 0.501647 0.0725788 0.5 493 63.546 0.0229544 -3.54095 63.546000 Cu 0.630213 0.0493139 1.57839e-16 411 63.546 0.0820838 -3.50199 63.546000 Cu 0.564046 0.0520103 0.5 413 63.546 0.185392 -3.51057 63.546000 Cu 0.571395 0.0701592 1 438 63.546 0.0226235 -3.53339 63.546000 Cu 0.639735 0.0678469 0.5 440 63.546 0.0369477 -3.52234 63.546000 Cu 0.764211 0.0456575 1.44255e-17 415 63.546 0.152337 -3.52424 63.546000 Cu 0.695634 0.0470613 0.5 417 63.546 0.107542 -3.52701 63.546000 Cu 0.707431 0.0655538 2.90915e-17 442 63.546 0.0409088 -3.52577 63.546000 Cu 0.788019 0.0806171 2.90915e-17 443 63.546 0.00631869 -3.53487 63.546000 Cu 0.776182 0.0631576 0.5 444 63.546 0.0417629 -3.53822 63.546000 Cu 0.718398 0.0832208 0.5 445 63.546 0.0124128 -3.53032 63.546000 Cu 0.910468 0.0417674 1 419 63.546 0.0813947 -3.51395 63.546000 Cu 0.836885 0.0438887 0.5 421 63.546 0.0714708 -3.53914 63.546000 Cu 0.847229 0.060828 1 446 63.546 0.0357743 -3.53724 63.546000 Cu 0.930236 0.0751584 1 447 63.546 0.0205237 -3.54383 63.546000 Cu 0.920807 0.0581874 0.5 448 63.546 0.0239458 -3.53601 63.546000 Cu 0.858642 0.0778713 0.5 449 63.546 0.0106345 -3.543 63.546000 Cu 0.993741 0.0551718 1 450 63.546 0.102816 -3.53897 63.546000 Cu 0.0888692 0.105451 2.90915e-17 480 63.546 0.0022161 -3.53793 63.546000 Cu 0.0797046 0.087897 0.5 481 63.546 0.0034442 -3.53504 63.546000 Cu 0.149077 0.0856421 2.90915e-17 483 63.546 0.0119006 -3.52989 63.546000 Cu 0.158816 0.103107 0.5 486 63.546 0.00345614 -3.5362 63.546000 Cu 0.0986948 0.122929 0.5 511 63.546 0.00117014 -3.53948 63.546000 Cu 0.00990196 0.0901457 1 479 63.546 0.0036363 -3.54057 63.546000 Cu 0.0190607 0.107744 0.5 482 63.546 0.00108933 -3.5399 63.546000 Cu 0.168832 0.120487 6.74394e-17 513 63.546 0.000881812 -3.53972 63.546000 Cu 0.228886 0.100611 2.90915e-17 484 63.546 0.00274142 -3.53589 63.546000 Cu 0.299094 0.0979382 0.5 490 63.546 0.00106917 -3.53816 63.546000 Cu 0.239148 0.117939 0.5 515 63.546 0.000364737 -3.53999 63.546000 Cu 0.309441 0.115299 4.20745e-18 517 63.546 0.00128615 -3.5403 63.546000 Cu 0.369392 0.0951864 1.71904e-16 488 63.546 0.004645 -3.5418 63.546000 Cu 0.439746 0.0925432 0.5 494 63.546 0.00917362 -3.54348 63.546000 Cu 0.379505 0.112652 0.5 519 63.546 0.00233911 -3.5409 63.546000 Cu 0.449313 0.110121 2.90915e-17 521 63.546 0.00167645 -3.54077 63.546000 Cu 0.509902 0.0901457 2.90915e-17 492 63.546 0.0036363 -3.54057 63.546000 Cu 0.519061 0.107744 0.5 522 63.546 0.00108933 -3.5399 63.546000 Cu 0.649077 0.0856421 2.90915e-17 439 63.546 0.0119006 -3.52989 63.546000 Cu 0.579705 0.087897 0.5 441 63.546 0.0034442 -3.53504 63.546000 Cu 0.588869 0.105451 2.90915e-17 467 63.546 0.0022161 -3.53793 63.546000 Cu 0.658816 0.103107 0.5 469 63.546 0.00345614 -3.5362 63.546000 Cu 0.598695 0.122929 0.5 470 63.546 0.00117014 -3.53948 63.546000 Cu 0.668832 0.120487 1 468 63.546 0.000881812 -3.53972 63.546000 Cu 0.728886 0.100611 2.90915e-17 471 63.546 0.00274142 -3.53589 63.546000 Cu 0.809441 0.115299 1 472 63.546 0.00128615 -3.5403 63.546000 Cu 0.799094 0.0979382 0.5 473 63.546 0.00106917 -3.53816 63.546000 Cu 0.739148 0.117939 0.5 474 63.546 0.000364737 -3.53999 63.546000 Cu 0.869392 0.0951864 2.40426e-19 475 63.546 0.004645 -3.5418 63.546000 Cu 0.949313 0.110121 2.90915e-17 476 63.546 0.00167645 -3.54077 63.546000 Cu 0.939746 0.0925432 0.5 477 63.546 0.00917362 -3.54348 63.546000 Cu 0.879505 0.112652 0.5 478 63.546 0.00233911 -3.5409 63.546000 Cu 0.0287779 0.125307 2.90915e-17 509 63.546 0.000693684 -3.53921 63.546000 Cu 0.108758 0.14037 5.80628e-17 510 63.546 0.000453364 -3.53968 63.546000 Cu 0.0387695 0.142818 0.5 512 63.546 0.00034613 -3.53907 63.546000 Cu 0.0488502 0.160296 1 538 63.546 0.000136642 -3.53958 63.546000 Cu 0.118848 0.157805 0.5 540 63.546 0.000168391 -3.54008 63.546000 Cu 0.178948 0.137875 0.5 516 63.546 0.000186481 -3.54079 63.546000 Cu 0.189014 0.155275 2.63266e-17 542 63.546 8.34692e-05 -3.54076 63.546000 Cu 0.249256 0.135316 1 514 63.546 0.000331285 -3.54124 63.546000 Cu 0.319395 0.13274 0.5 520 63.546 0.000737441 -3.5408 63.546000 Cu 0.25921 0.152741 0.5 544 63.546 0.000262666 -3.54063 63.546000 Cu 0.329277 0.150222 2.90915e-17 546 63.546 0.000265744 -3.53999 63.546000 Cu 0.389322 0.130194 5.46968e-17 518 63.546 0.00050065 -3.54043 63.546000 Cu 0.459069 0.127711 0.5 523 63.546 0.000248079 -3.53959 63.546000 Cu 0.409043 0.165226 1 547 63.546 4.58259e-05 -3.53949 63.546000 Cu 0.399135 0.147727 0.5 548 63.546 0.000105746 -3.53958 63.546000 Cu 0.468941 0.145258 1 550 63.546 0.000150248 -3.5392 63.546000 Cu 0.478942 0.16276 0.5 551 63.546 5.81863e-05 -3.53952 63.546000 Cu 0.528778 0.125307 4.70032e-17 466 63.546 0.000693684 -3.53921 63.546000 Cu 0.54885 0.160296 7.57341e-18 495 63.546 0.000136642 -3.53958 63.546000 Cu 0.53877 0.142818 0.5 496 63.546 0.00034613 -3.53907 63.546000 Cu 0.608758 0.14037 4.62819e-17 497 63.546 0.000453364 -3.53968 63.546000 Cu 0.618848 0.157805 0.5 500 63.546 0.000168391 -3.54008 63.546000 Cu 0.689014 0.155275 2.90915e-17 498 63.546 8.34692e-05 -3.54076 63.546000 Cu 0.678948 0.137875 0.5 499 63.546 0.000186481 -3.54079 63.546000 Cu 0.749256 0.135316 1 501 63.546 0.000331285 -3.54124 63.546000 Cu 0.829277 0.150222 7.63351e-17 502 63.546 0.000265744 -3.53999 63.546000 Cu 0.819395 0.13274 0.5 503 63.546 0.000737441 -3.5408 63.546000 Cu 0.75921 0.152741 0.5 504 63.546 0.000262666 -3.54063 63.546000 Cu 0.889322 0.130194 2.90915e-17 505 63.546 0.00050065 -3.54043 63.546000 Cu 0.968941 0.145258 2.90915e-17 506 63.546 0.000150248 -3.5392 63.546000 Cu 0.959069 0.127711 0.5 507 63.546 0.000248079 -3.53959 63.546000 Cu 0.899135 0.147727 0.5 508 63.546 0.000105746 -3.53958 63.546000 Cu 0.909043 0.165226 1 534 63.546 4.58259e-05 -3.53949 63.546000 Cu 0.978942 0.16276 0.5 536 63.546 5.81863e-05 -3.53952 63.546000 Cu 0.128947 0.175248 2.90915e-17 539 63.546 3.28753e-05 -3.54018 63.546000 Cu 0.0589171 0.17776 0.5 541 63.546 0.000102888 -3.53979 63.546000 Cu 0.0689232 0.195203 2.90915e-17 566 63.546 2.07343e-05 -3.53985 63.546000 Cu 0.138984 0.192691 0.5 568 63.546 1.86769e-05 -3.53973 63.546000 Cu 0.269077 0.170196 2.90915e-17 543 63.546 9.1465e-05 -3.54026 63.546000 Cu 0.199035 0.172713 0.5 545 63.546 9.39826e-05 -3.54067 63.546000 Cu 0.208985 0.190177 2.90915e-17 570 63.546 2.54229e-05 -3.53998 63.546000 Cu 0.288965 0.205138 2.43792e-16 571 63.546 3.43211e-05 -3.53987 63.546000 Cu 0.278997 0.187667 0.5 572 63.546 2.67046e-05 -3.54007 63.546000 Cu 0.218987 0.207635 0.5 573 63.546 4.43347e-05 -3.53984 63.546000 Cu 0.33908 0.167703 0.5 549 63.546 3.58131e-05 -3.53979 63.546000 Cu 0.348974 0.185178 2.44272e-16 574 63.546 1.75782e-05 -3.53994 63.546000 Cu 0.428893 0.200176 3.57032e-17 575 63.546 4.93195e-05 -3.53958 63.546000 Cu 0.418951 0.182704 0.5 576 63.546 8.68881e-06 -3.53964 63.546000 Cu 0.35894 0.20265 0.5 577 63.546 2.29557e-05 -3.53995 63.546000 Cu 0.488901 0.180241 1.22016e-16 578 63.546 7.56951e-05 -3.53965 63.546000 Cu 0.498881 0.197697 0.5 579 63.546 6.45076e-05 -3.53962 63.546000 Cu 0.568923 0.195203 1.21655e-16 524 63.546 2.07343e-05 -3.53985 63.546000 Cu 0.558917 0.17776 0.5 525 63.546 0.000102888 -3.53979 63.546000 Cu 0.628947 0.175248 8.85968e-17 526 63.546 3.28753e-05 -3.54018 63.546000 Cu 0.638984 0.192691 0.5 529 63.546 1.86769e-05 -3.53973 63.546000 Cu 0.708985 0.190177 1 527 63.546 2.54229e-05 -3.53998 63.546000 Cu 0.699035 0.172713 0.5 528 63.546 9.39826e-05 -3.54067 63.546000 Cu 0.769077 0.170196 1 530 63.546 9.1465e-05 -3.54026 63.546000 Cu 0.778997 0.187667 0.5 533 63.546 2.67046e-05 -3.54007 63.546000 Cu 0.718987 0.207635 0.5 556 63.546 4.43347e-05 -3.53984 63.546000 Cu 0.788965 0.205138 0 558 63.546 3.43211e-05 -3.53987 63.546000 Cu 0.848974 0.185178 1 531 63.546 1.75782e-05 -3.53994 63.546000 Cu 0.83908 0.167703 0.5 532 63.546 3.58131e-05 -3.53979 63.546000 Cu 0.988901 0.180241 1 535 63.546 7.56951e-05 -3.53965 63.546000 Cu 0.918951 0.182704 0.5 537 63.546 8.68881e-06 -3.53964 63.546000 Cu 0.85894 0.20265 0.5 560 63.546 2.29557e-05 -3.53995 63.546000 Cu 0.928893 0.200176 1 562 63.546 4.93195e-05 -3.53958 63.546000 Cu 0.998881 0.197697 0.5 564 63.546 6.45076e-05 -3.53962 63.546000 Cu 0.148986 0.210146 2.90915e-17 567 63.546 2.71428e-05 -3.53992 63.546000 Cu 0.0789907 0.212653 0.5 569 63.546 1.11753e-05 -3.54023 63.546000 Cu 0.0890871 0.230109 1 596 63.546 2.51107e-06 -3.54013 63.546000 Cu 0.159096 0.227605 0.5 598 63.546 8.06475e-06 -3.54027 63.546000 Cu 0.0991681 0.247564 0.5 599 63.546 1.22198e-05 -3.53998 63.546000 Cu 0.00895121 0.215147 0 563 63.546 1.65036e-05 -3.54012 63.546000 Cu 0.0190556 0.232608 0.5 594 63.546 7.76444e-06 -3.54018 63.546000 Cu 0.169215 0.245066 2.40426e-19 597 63.546 5.53123e-05 -3.54018 63.546000 Cu 0.229095 0.225104 2.90915e-17 600 63.546 2.07713e-05 -3.54025 63.546000 Cu 0.309144 0.240092 6.22702e-17 601 63.546 2.41711e-05 -3.5399 63.546000 Cu 0.299027 0.222611 0.5 602 63.546 1.22416e-05 -3.54013 63.546000 Cu 0.239189 0.24258 0.5 603 63.546 3.03565e-05 -3.53982 63.546000 Cu 0.36897 0.220127 2.00395e-16 604 63.546 3.06752e-05 -3.54016 63.546000 Cu 0.449066 0.2351 1 605 63.546 5.5611e-06 -3.53992 63.546000 Cu 0.43895 0.217638 0.5 606 63.546 2.29984e-05 -3.53986 63.546000 Cu 0.379097 0.237599 0.5 607 63.546 7.66037e-06 -3.53994 63.546000 Cu 0.508951 0.215147 4.8566e-17 608 63.546 1.65036e-05 -3.54012 63.546000 Cu 0.519056 0.232608 0.5 609 63.546 7.76444e-06 -3.54018 63.546000 Cu 0.589087 0.230109 4.47192e-17 552 63.546 2.51107e-06 -3.54013 63.546000 Cu 0.578991 0.212653 0.5 553 63.546 1.11753e-05 -3.54023 63.546000 Cu 0.648986 0.210146 1 554 63.546 2.71428e-05 -3.53992 63.546000 Cu 0.659096 0.227605 0.5 557 63.546 8.06475e-06 -3.54027 63.546000 Cu 0.599168 0.247564 0.5 582 63.546 1.22198e-05 -3.53998 63.546000 Cu 0.669215 0.245066 2.90915e-17 584 63.546 5.53123e-05 -3.54018 63.546000 Cu 0.729095 0.225104 1 555 63.546 2.07713e-05 -3.54025 63.546000 Cu 0.799027 0.222611 0.5 561 63.546 1.22416e-05 -3.54013 63.546000 Cu 0.739189 0.24258 0.5 586 63.546 3.03565e-05 -3.53982 63.546000 Cu 0.809144 0.240092 6.01064e-19 588 63.546 2.41711e-05 -3.5399 63.546000 Cu 0.86897 0.220127 0 559 63.546 3.06752e-05 -3.54016 63.546000 Cu 0.93895 0.217638 0.5 565 63.546 2.29984e-05 -3.53986 63.546000 Cu 0.879097 0.237599 0.5 590 63.546 7.66037e-06 -3.53994 63.546000 Cu 0.949066 0.2351 0 592 63.546 5.5611e-06 -3.53992 63.546000 Cu 0.029173 0.250065 1 593 63.546 6.8855e-06 -3.53981 63.546000 Cu 0.0492713 0.285006 2.90915e-17 623 63.546 3.32905e-05 -3.54004 63.546000 Cu 0.0392599 0.26753 0.5 624 63.546 2.24364e-05 -3.54007 63.546000 Cu 0.109216 0.265028 1 626 63.546 1.00882e-05 -3.5402 63.546000 Cu 0.119251 0.282503 0.5 629 63.546 1.12015e-05 -3.54012 63.546000 Cu 0.189236 0.279998 2.90915e-17 627 63.546 5.50923e-06 -3.53991 63.546000 Cu 0.179204 0.262531 0.5 628 63.546 1.05288e-05 -3.54017 63.546000 Cu 0.249218 0.26004 1 630 63.546 5.5846e-06 -3.53961 63.546000 Cu 0.329221 0.275014 1 631 63.546 3.93097e-06 -3.54014 63.546000 Cu 0.319215 0.257554 0.5 632 63.546 1.73863e-05 -3.53985 63.546000 Cu 0.259211 0.277501 0.5 633 63.546 7.76343e-06 -3.53967 63.546000 Cu 0.38923 0.255061 6.58766e-17 634 63.546 4.16947e-05 -3.53988 63.546000 Cu 0.469279 0.27003 5.69809e-17 635 63.546 4.4843e-05 -3.54014 63.546000 Cu 0.459177 0.252567 0.5 636 63.546 6.31366e-06 -3.5398 63.546000 Cu 0.399257 0.272527 0.5 637 63.546 2.73398e-05 -3.54021 63.546000 Cu 0.409215 0.289987 8.19851e-17 662 63.546 2.21373e-06 -3.54028 63.546000 Cu 0.479258 0.287498 0.5 664 63.546 1.77086e-05 -3.54028 63.546000 Cu 0.529173 0.250065 2.90915e-17 580 63.546 6.8855e-06 -3.53981 63.546000 Cu 0.609216 0.265028 2.90915e-17 581 63.546 1.00882e-05 -3.5402 63.546000 Cu 0.53926 0.26753 0.5 583 63.546 2.24364e-05 -3.54007 63.546000 Cu 0.549271 0.285006 1 610 63.546 3.32905e-05 -3.54004 63.546000 Cu 0.619251 0.282503 0.5 612 63.546 1.12015e-05 -3.54012 63.546000 Cu 0.679204 0.262531 0.5 587 63.546 1.05288e-05 -3.54017 63.546000 Cu 0.689236 0.279998 1 614 63.546 5.50923e-06 -3.53991 63.546000 Cu 0.749218 0.26004 1 585 63.546 5.5846e-06 -3.53961 63.546000 Cu 0.819215 0.257554 0.5 591 63.546 1.73863e-05 -3.53985 63.546000 Cu 0.759211 0.277501 0.5 616 63.546 7.76343e-06 -3.53967 63.546000 Cu 0.829221 0.275014 2.90915e-17 618 63.546 3.93097e-06 -3.54014 63.546000 Cu 0.88923 0.255061 0 589 63.546 4.16947e-05 -3.53988 63.546000 Cu 0.959177 0.252567 0.5 595 63.546 6.31366e-06 -3.5398 63.546000 Cu 0.909215 0.289987 1 619 63.546 2.21373e-06 -3.54028 63.546000 Cu 0.899257 0.272527 0.5 620 63.546 2.73398e-05 -3.54021 63.546000 Cu 0.969279 0.27003 1 622 63.546 4.4843e-05 -3.54014 63.546000 Cu 0.979258 0.287498 0.5 625 63.546 1.77086e-05 -3.54028 63.546000 Cu 0.0691588 0.319915 1.21776e-16 651 63.546 1.0968e-05 -3.5397 63.546000 Cu 0.0592332 0.302465 0.5 652 63.546 1.75968e-05 -3.53978 63.546000 Cu 0.129247 0.299965 1.21535e-16 654 63.546 1.42491e-05 -3.54004 63.546000 Cu 0.139204 0.317426 0.5 657 63.546 4.60688e-05 -3.53973 63.546000 Cu 0.209196 0.314936 1.22136e-16 655 63.546 2.86513e-05 -3.53995 63.546000 Cu 0.19925 0.297461 0.5 656 63.546 2.90179e-05 -3.53993 63.546000 Cu 0.269199 0.294966 8.65532e-17 658 63.546 1.07372e-05 -3.53973 63.546000 Cu 0.279165 0.312442 0.5 661 63.546 5.432e-06 -3.53988 63.546000 Cu 0.21909 0.332405 0.5 685 63.546 4.18212e-05 -3.53983 63.546000 Cu 0.289089 0.329918 2.90915e-17 687 63.546 4.21817e-05 -3.54 63.546000 Cu 0.349129 0.309945 2.90915e-17 659 63.546 9.76207e-06 -3.53989 63.546000 Cu 0.339183 0.292478 0.5 660 63.546 7.93817e-06 -3.53999 63.546000 Cu 0.489199 0.304957 2.90915e-17 663 63.546 6.57215e-06 -3.53997 63.546000 Cu 0.41914 0.30745 0.5 665 63.546 8.60977e-06 -3.54012 63.546000 Cu 0.359066 0.327414 0.5 689 63.546 1.03297e-05 -3.54025 63.546000 Cu 0.429084 0.324908 2.90915e-17 691 63.546 1.20174e-05 -3.54013 63.546000 Cu 0.499101 0.32241 0.5 693 63.546 7.24793e-06 -3.53981 63.546000 Cu 0.629247 0.299965 2.90915e-17 611 63.546 1.42491e-05 -3.54004 63.546000 Cu 0.559233 0.302465 0.5 613 63.546 1.75968e-05 -3.53978 63.546000 Cu 0.569159 0.319915 3.66649e-17 638 63.546 1.0968e-05 -3.5397 63.546000 Cu 0.639204 0.317426 0.5 640 63.546 4.60688e-05 -3.53973 63.546000 Cu 0.769199 0.294966 1 615 63.546 1.07372e-05 -3.53973 63.546000 Cu 0.69925 0.297461 0.5 617 63.546 2.90179e-05 -3.53993 63.546000 Cu 0.709196 0.314936 1 642 63.546 2.86513e-05 -3.53995 63.546000 Cu 0.789089 0.329918 2.90915e-17 643 63.546 4.21817e-05 -3.54 63.546000 Cu 0.779165 0.312442 0.5 644 63.546 5.432e-06 -3.53988 63.546000 Cu 0.71909 0.332405 0.5 645 63.546 4.18212e-05 -3.53983 63.546000 Cu 0.839183 0.292478 0.5 621 63.546 7.93817e-06 -3.53999 63.546000 Cu 0.849129 0.309945 2.90915e-17 646 63.546 9.76207e-06 -3.53989 63.546000 Cu 0.929084 0.324908 1 647 63.546 1.20174e-05 -3.54013 63.546000 Cu 0.91914 0.30745 0.5 648 63.546 8.60977e-06 -3.54012 63.546000 Cu 0.859066 0.327414 0.5 649 63.546 1.03297e-05 -3.54025 63.546000 Cu 0.989199 0.304957 1 650 63.546 6.57215e-06 -3.53997 63.546000 Cu 0.999101 0.32241 0.5 653 63.546 7.24793e-06 -3.53981 63.546000 Cu 0.0888886 0.354832 1 680 63.546 9.41409e-05 -3.53973 63.546000 Cu 0.0790269 0.337364 0.5 681 63.546 4.09196e-05 -3.53977 63.546000 Cu 0.149058 0.334879 2.90915e-17 683 63.546 4.02578e-05 -3.53967 63.546000 Cu 0.158851 0.352357 0.5 686 63.546 2.87784e-05 -3.54017 63.546000 Cu 0.0986765 0.372329 0.5 711 63.546 8.67389e-05 -3.53944 63.546000 Cu 0.00900412 0.339863 1 679 63.546 1.22035e-05 -3.53975 63.546000 Cu 0.0189111 0.357321 0.5 682 63.546 7.19169e-05 -3.53957 63.546000 Cu 0.0288458 0.3748 1 709 63.546 0.000247813 -3.53909 63.546000 Cu 0.168564 0.36985 1 713 63.546 0.000112477 -3.54051 63.546000 Cu 0.228874 0.349877 2.90915e-17 684 63.546 2.44599e-05 -3.54039 63.546000 Cu 0.298922 0.34739 0.5 690 63.546 6.54242e-05 -3.54031 63.546000 Cu 0.238607 0.367356 0.5 715 63.546 0.000164242 -3.54097 63.546000 Cu 0.308718 0.364845 2.90915e-17 717 63.546 0.000125871 -3.54058 63.546000 Cu 0.368983 0.344885 2.90915e-17 688 63.546 5.16889e-05 -3.54031 63.546000 Cu 0.438998 0.342372 0.5 694 63.546 5.67555e-06 -3.53982 63.546000 Cu 0.378865 0.362331 0.5 719 63.546 4.80091e-05 -3.53989 63.546000 Cu 0.448925 0.359823 4.65223e-17 721 63.546 3.80355e-05 -3.53935 63.546000 Cu 0.509004 0.339863 1 692 63.546 1.22035e-05 -3.53975 63.546000 Cu 0.518911 0.357321 0.5 722 63.546 7.19169e-05 -3.53957 63.546000 Cu 0.649058 0.334879 2.90915e-17 639 63.546 4.02578e-05 -3.53967 63.546000 Cu 0.579027 0.337364 0.5 641 63.546 4.09196e-05 -3.53977 63.546000 Cu 0.588889 0.354832 1.0723e-16 667 63.546 9.41409e-05 -3.53973 63.546000 Cu 0.658851 0.352357 0.5 669 63.546 2.87784e-05 -3.54017 63.546000 Cu 0.598676 0.372329 0.5 670 63.546 8.67389e-05 -3.53944 63.546000 Cu 0.528846 0.3748 2.90915e-17 666 63.546 0.000247813 -3.53909 63.546000 Cu 0.668564 0.36985 1 668 63.546 0.000112477 -3.54051 63.546000 Cu 0.728874 0.349877 9.08809e-17 671 63.546 2.44599e-05 -3.54039 63.546000 Cu 0.808718 0.364845 2.90915e-17 672 63.546 0.000125871 -3.54058 63.546000 Cu 0.798922 0.34739 0.5 673 63.546 6.54242e-05 -3.54031 63.546000 Cu 0.738607 0.367356 0.5 674 63.546 0.000164242 -3.54097 63.546000 Cu 0.868983 0.344885 1 675 63.546 5.16889e-05 -3.54031 63.546000 Cu 0.948925 0.359823 1 676 63.546 3.80355e-05 -3.53935 63.546000 Cu 0.938998 0.342372 0.5 677 63.546 5.67555e-06 -3.53982 63.546000 Cu 0.878865 0.362331 0.5 678 63.546 4.80091e-05 -3.53989 63.546000 Cu 0.108383 0.389863 2.90915e-17 710 63.546 0.000257354 -3.53929 63.546000 Cu 0.0386526 0.392318 0.5 712 63.546 0.000222205 -3.53904 63.546000 Cu 0.0483532 0.409904 1 738 63.546 0.000639695 -3.54056 63.546000 Cu 0.118072 0.407405 0.5 740 63.546 0.00181249 -3.54029 63.546000 Cu 0.178258 0.387352 0.5 716 63.546 0.000674295 -3.5407 63.546000 Cu 0.18804 0.404814 1 742 63.546 0.00188312 -3.54016 63.546000 Cu 0.248368 0.38481 1 714 63.546 0.000510828 -3.54123 63.546000 Cu 0.318626 0.382267 0.5 720 63.546 0.000130261 -3.54059 63.546000 Cu 0.258328 0.402199 0.5 744 63.546 0.000445524 -3.53998 63.546000 Cu 0.328668 0.399644 2.90915e-17 746 63.546 0.000405986 -3.53963 63.546000 Cu 0.388827 0.379755 2.34415e-17 718 63.546 0.000140232 -3.53984 63.546000 Cu 0.458909 0.37727 0.5 723 63.546 0.000257374 -3.53929 63.546000 Cu 0.408794 0.414617 2.90915e-17 747 63.546 0.00207956 -3.53784 63.546000 Cu 0.398884 0.397175 0.5 748 63.546 0.000823171 -3.53944 63.546000 Cu 0.468858 0.394746 2.90915e-17 750 63.546 0.000704708 -3.53938 63.546000 Cu 0.47865 0.412287 0.5 751 63.546 0.000977844 -3.54002 63.546000 Cu 0.548353 0.409904 2.90915e-17 695 63.546 0.000639695 -3.54056 63.546000 Cu 0.538653 0.392318 0.5 696 63.546 0.000222205 -3.53904 63.546000 Cu 0.608383 0.389863 2.90915e-17 697 63.546 0.000257354 -3.53929 63.546000 Cu 0.618072 0.407405 0.5 700 63.546 0.00181249 -3.54029 63.546000 Cu 0.68804 0.404814 2.90915e-17 698 63.546 0.00188312 -3.54016 63.546000 Cu 0.678258 0.387352 0.5 699 63.546 0.000674295 -3.5407 63.546000 Cu 0.748368 0.38481 2.90915e-17 701 63.546 0.000510828 -3.54123 63.546000 Cu 0.828668 0.399644 4.43585e-17 702 63.546 0.000405986 -3.53963 63.546000 Cu 0.818626 0.382267 0.5 703 63.546 0.000130261 -3.54059 63.546000 Cu 0.758328 0.402199 0.5 704 63.546 0.000445524 -3.53998 63.546000 Cu 0.888827 0.379755 1.21535e-16 705 63.546 0.000140232 -3.53984 63.546000 Cu 0.968858 0.394746 1.21896e-16 706 63.546 0.000704708 -3.53938 63.546000 Cu 0.958909 0.37727 0.5 707 63.546 0.000257374 -3.53929 63.546000 Cu 0.898884 0.397175 0.5 708 63.546 0.000823171 -3.53944 63.546000 Cu 0.908794 0.414617 2.90915e-17 734 63.546 0.00207956 -3.53784 63.546000 Cu 0.97865 0.412287 0.5 736 63.546 0.000977844 -3.54002 63.546000 Cu 0.128104 0.424926 2.90915e-17 739 63.546 0.00537085 -3.54207 63.546000 Cu 0.0579966 0.427515 0.5 741 63.546 0.00674274 -3.54341 63.546000 Cu 0.0675849 0.444969 2.90915e-17 766 63.546 0.0192308 -3.54412 63.546000 Cu 0.138901 0.442295 0.5 768 63.546 0.0108511 -3.5434 63.546000 Cu 0.268533 0.419522 3.89489e-17 743 63.546 0.0021379 -3.53669 63.546000 Cu 0.198306 0.422198 0.5 745 63.546 0.00182866 -3.53885 63.546000 Cu 0.209443 0.439536 1.22016e-16 770 63.546 0.00412882 -3.53575 63.546000 Cu 0.290541 0.454482 1 771 63.546 0.0397971 -3.52536 63.546000 Cu 0.279176 0.436884 0.5 772 63.546 0.0108144 -3.53122 63.546000 Cu 0.221587 0.45696 0.5 773 63.546 0.0360444 -3.53861 63.546000 Cu 0.338741 0.417 0.5 749 63.546 0.00251575 -3.53674 63.546000 Cu 0.348695 0.434419 0 774 63.546 0.0111374 -3.53054 63.546000 Cu 0.426878 0.449822 2.90915e-17 775 63.546 0.0185888 -3.53442 63.546000 Cu 0.41819 0.432128 0.5 776 63.546 0.00348964 -3.53541 63.546000 Cu 0.358409 0.452145 0.5 777 63.546 0.0367711 -3.52354 63.546000 Cu 0.488 0.429884 1.5844e-16 778 63.546 0.00210296 -3.54082 63.546000 Cu 0.496529 0.447477 0.5 779 63.546 0.0155333 -3.5411 63.546000 Cu 0.567585 0.444969 2.90915e-17 724 63.546 0.0192308 -3.54412 63.546000 Cu 0.557997 0.427515 0.5 725 63.546 0.00674274 -3.54341 63.546000 Cu 0.628104 0.424926 5.56585e-17 726 63.546 0.00537085 -3.54207 63.546000 Cu 0.638901 0.442295 0.5 729 63.546 0.0108511 -3.5434 63.546000 Cu 0.709443 0.439536 3.65447e-17 727 63.546 0.00412882 -3.53575 63.546000 Cu 0.698306 0.422198 0.5 728 63.546 0.00182866 -3.53885 63.546000 Cu 0.768533 0.419522 2.90915e-17 730 63.546 0.0021379 -3.53669 63.546000 Cu 0.779176 0.436884 0.5 733 63.546 0.0108144 -3.53122 63.546000 Cu 0.721587 0.45696 0.5 756 63.546 0.0360444 -3.53861 63.546000 Cu 0.790541 0.454482 0 758 63.546 0.0397971 -3.52536 63.546000 Cu 0.848695 0.434419 2.90915e-17 731 63.546 0.0111374 -3.53054 63.546000 Cu 0.838741 0.417 0.5 732 63.546 0.00251575 -3.53674 63.546000 Cu 0.988 0.429884 2.90915e-17 735 63.546 0.00210296 -3.54082 63.546000 Cu 0.91819 0.432128 0.5 737 63.546 0.00348964 -3.53541 63.546000 Cu 0.858409 0.452145 0.5 760 63.546 0.0367711 -3.52354 63.546000 Cu 0.926878 0.449822 1 762 63.546 0.0185888 -3.53442 63.546000 Cu 0.996529 0.447477 0.5 764 63.546 0.0155333 -3.5411 63.546000 Cu 0.15039 0.459374 2.90915e-17 767 63.546 0.0272668 -3.53809 63.546000 Cu 0.0770273 0.462043 0.5 769 63.546 0.0249134 -3.53708 63.546000 Cu 0.087445 0.478565 2.15181e-17 789 63.546 0.0631567 -3.51753 63.546000 Cu 0.161089 0.476289 0.5 791 63.546 0.0640219 -3.53895 63.546000 Cu 0.094951 0.49498 0.5 792 63.546 4.69113 -3.45972 63.546000 Cu 0.00466853 0.464941 2.90915e-17 763 63.546 0.0797587 -3.54054 63.546000 Cu 0.0125528 0.482101 0.5 788 63.546 1.09412 -3.45376 63.546000 Cu 0.0233703 0.498688 2.90915e-17 787 63.546 9.44117 -3.33368 63.546000 Cu 0.172487 0.492732 1 790 63.546 0.379427 -3.50119 63.546000 Cu 0.23406 0.474361 2.90915e-17 793 63.546 0.146353 -3.52088 63.546000 Cu 0.313384 0.491539 1 794 63.546 0.193472 -3.52028 63.546000 Cu 0.302886 0.472879 0.5 795 63.546 0.107189 -3.52657 63.546000 Cu 0.243486 0.492184 0.5 796 63.546 0.163305 -3.52602 63.546000 Cu 0.381385 0.490661 0.5 9 63.546 0.540056 -3.46956 63.546000 Cu 0.434697 0.467903 0.5 11 63.546 0.159301 -3.5061 63.546000 Cu 0.443466 0.486558 1.02421e-16 394 63.546 1.23255 -3.40979 63.546000 Cu 0.368392 0.470583 1.21896e-16 400 63.546 0.0859002 -3.50479 63.546000 Cu 0.512553 0.482101 0.5 1 63.546 1.09412 -3.45376 63.546000 Cu 0.504669 0.464941 2.90915e-17 3 63.546 0.0797587 -3.54054 63.546000 Cu 0.587445 0.478565 7.86192e-17 752 63.546 0.0631567 -3.51753 63.546000 Cu 0.577027 0.462043 0.5 753 63.546 0.0249134 -3.53708 63.546000 Cu 0.65039 0.459374 1 754 63.546 0.0272668 -3.53809 63.546000 Cu 0.661089 0.476289 0.5 757 63.546 0.0640219 -3.53895 63.546000 Cu 0.594951 0.49498 0.5 781 63.546 4.69113 -3.45972 63.546000 Cu 0.52337 0.498688 9.92958e-17 780 63.546 9.44117 -3.33368 63.546000 Cu 0.672487 0.492732 1 782 63.546 0.379427 -3.50119 63.546000 Cu 0.73406 0.474361 1 755 63.546 0.146353 -3.52088 63.546000 Cu 0.802886 0.472879 0.5 761 63.546 0.107189 -3.52657 63.546000 Cu 0.743486 0.492184 0.5 783 63.546 0.163305 -3.52602 63.546000 Cu 0.813384 0.491539 1 784 63.546 0.193472 -3.52028 63.546000 Cu 0.868392 0.470583 1 759 63.546 0.0859002 -3.50479 63.546000 Cu 0.934697 0.467903 0.5 765 63.546 0.159301 -3.5061 63.546000 Cu 0.881385 0.490661 0.5 785 63.546 0.540056 -3.46956 63.546000 Cu 0.943466 0.486558 2.90915e-17 786 63.546 1.23255 -3.40979 63.546000 Cu 0.108315 0.510078 3.60638e-19 2 63.546 6.42057 -3.21715 63.546000 Cu 0.0258246 0.52183 1.20213e-19 24 63.546 9.02421 -3.31302 63.546000 Cu 0.0968674 0.525354 0.5 26 63.546 4.39039 -3.45947 63.546000 Cu 0.0141296 0.538173 0.5 27 63.546 0.862086 -3.45551 63.546000 Cu 0.2474 0.510011 0 4 63.546 0.17203 -3.53376 63.546000 Cu 0.176975 0.510037 0.5 5 63.546 0.494353 -3.50103 63.546000 Cu 0.173456 0.527361 1 28 63.546 0.337832 -3.50733 63.546000 Cu 0.244387 0.527814 0.5 30 63.546 0.161606 -3.52857 63.546000 Cu 0.319152 0.509949 0.5 7 63.546 0.406408 -3.52502 63.546000 Cu 0.314432 0.528333 1 32 63.546 0.228664 -3.52061 63.546000 Cu 0.393614 0.509816 1 6 63.546 2.42288 -3.52181 63.546000 Cu 0.465054 0.510846 0.5 8 63.546 8.64306 -3.55119 63.546000 Cu 0.382137 0.529194 0.5 34 63.546 0.47428 -3.47282 63.546000 Cu 0.444386 0.533225 1.17929e-16 36 63.546 0.92537 -3.43042 63.546000 Cu 0.525825 0.52183 2.28404e-17 10 63.546 9.02421 -3.31302 63.546000 Cu 0.608315 0.510078 5.28936e-18 12 63.546 6.42057 -3.21715 63.546000 Cu 0.596867 0.525354 0.5 15 63.546 4.39039 -3.45947 63.546000 Cu 0.51413 0.538173 0.5 39 63.546 0.862086 -3.45551 63.546000 Cu 0.673456 0.527361 8.6433e-17 13 63.546 0.337832 -3.50733 63.546000 Cu 0.676975 0.510037 0.5 14 63.546 0.494353 -3.50103 63.546000 Cu 0.7474 0.510011 2.90915e-17 16 63.546 0.17203 -3.53376 63.546000 Cu 0.744387 0.527814 0.5 19 63.546 0.161606 -3.52857 63.546000 Cu 0.814432 0.528333 2.90915e-17 17 63.546 0.228664 -3.52061 63.546000 Cu 0.819152 0.509949 0.5 18 63.546 0.406408 -3.52502 63.546000 Cu 0.893614 0.509816 2.90915e-17 20 63.546 2.42288 -3.52181 63.546000 Cu 0.944386 0.533225 1 21 63.546 0.92537 -3.43042 63.546000 Cu 0.965054 0.510846 0.5 22 63.546 8.64306 -3.55119 63.546000 Cu 0.882137 0.529194 0.5 23 63.546 0.47428 -3.47282 63.546000 Cu 0.089533 0.541777 1 25 63.546 0.0809457 -3.5143 63.546000 Cu 0.00626557 0.555184 2.40426e-19 52 63.546 0.104038 -3.53855 63.546000 Cu 0.0697852 0.575173 1 53 63.546 0.0213132 -3.54382 63.546000 Cu 0.0791811 0.558194 0.5 54 63.546 0.0246046 -3.53571 63.546000 Cu 0.141373 0.577884 0.5 59 63.546 0.0107795 -3.54301 63.546000 Cu 0.163147 0.543911 0.5 31 63.546 0.0719934 -3.53916 63.546000 Cu 0.152789 0.560843 1 56 63.546 0.035362 -3.53724 63.546000 Cu 0.235826 0.545692 1.22016e-16 29 63.546 0.153399 -3.52422 63.546000 Cu 0.304408 0.547098 0.5 35 63.546 0.108124 -3.52724 63.546000 Cu 0.212024 0.580639 2.90915e-17 57 63.546 0.00619391 -3.5349 63.546000 Cu 0.223865 0.563187 0.5 58 63.546 0.0420142 -3.53826 63.546000 Cu 0.292644 0.565593 5.93851e-17 60 63.546 0.0419013 -3.5259 63.546000 Cu 0.281676 0.583255 0.5 63 63.546 0.0126591 -3.53035 63.546000 Cu 0.369841 0.549348 2.90915e-17 33 63.546 0.0825594 -3.50188 63.546000 Cu 0.435991 0.552036 0.5 37 63.546 0.185509 -3.50977 63.546000 Cu 0.360348 0.56789 0.5 62 63.546 0.0377463 -3.52253 63.546000 Cu 0.428698 0.570197 1 64 63.546 0.0224851 -3.53351 63.546000 Cu 0.498419 0.572604 0.5 67 63.546 0.02281 -3.54091 63.546000 Cu 0.589533 0.541777 1.84406e-16 40 63.546 0.0809457 -3.5143 63.546000 Cu 0.506266 0.555184 5.22926e-17 38 63.546 0.104038 -3.53855 63.546000 Cu 0.579181 0.558194 0.5 43 63.546 0.0246046 -3.53571 63.546000 Cu 0.569785 0.575173 2.90915e-17 68 63.546 0.0213132 -3.54382 63.546000 Cu 0.641373 0.577884 0.5 70 63.546 0.0107795 -3.54301 63.546000 Cu 0.652789 0.560843 3.19766e-17 41 63.546 0.035362 -3.53724 63.546000 Cu 0.663147 0.543911 0.5 42 63.546 0.0719934 -3.53916 63.546000 Cu 0.735826 0.545692 2.90915e-17 44 63.546 0.153399 -3.52422 63.546000 Cu 0.792644 0.565593 3.48617e-18 45 63.546 0.0419013 -3.5259 63.546000 Cu 0.804408 0.547098 0.5 46 63.546 0.108124 -3.52724 63.546000 Cu 0.723865 0.563187 0.5 47 63.546 0.0420142 -3.53826 63.546000 Cu 0.712024 0.580639 1 72 63.546 0.00619391 -3.5349 63.546000 Cu 0.781676 0.583255 0.5 74 63.546 0.0126591 -3.53035 63.546000 Cu 0.998419 0.572604 0.5 55 63.546 0.02281 -3.54091 63.546000 Cu 0.869841 0.549348 3.60638e-19 48 63.546 0.0825594 -3.50188 63.546000 Cu 0.928698 0.570197 1 49 63.546 0.0224851 -3.53351 63.546000 Cu 0.935991 0.552036 0.5 50 63.546 0.185509 -3.50977 63.546000 Cu 0.860348 0.56789 0.5 51 63.546 0.0377463 -3.52253 63.546000 Cu 0.0508091 0.610154 1 81 63.546 0.00155913 -3.5407 63.546000 Cu 0.0603411 0.592568 0.5 82 63.546 0.00917375 -3.54337 63.546000 Cu 0.130656 0.5952 2.40426e-19 84 63.546 0.00519224 -3.54186 63.546000 Cu 0.120605 0.612677 0.5 87 63.546 0.00226407 -3.54094 63.546000 Cu 0.190641 0.615319 2.94521e-17 85 63.546 0.00137035 -3.54033 63.546000 Cu 0.20096 0.597953 0.5 86 63.546 0.00112169 -3.53818 63.546000 Cu 0.271182 0.600637 1 88 63.546 0.00260531 -3.5358 63.546000 Cu 0.260917 0.617958 0.5 91 63.546 0.00036843 -3.53994 63.546000 Cu 0.331244 0.620512 1 89 63.546 0.000781887 -3.53974 63.546000 Cu 0.351027 0.585685 6.02266e-17 61 63.546 0.012476 -3.52997 63.546000 Cu 0.420413 0.58794 0.5 65 63.546 0.00367017 -3.53511 63.546000 Cu 0.341288 0.603143 0.5 90 63.546 0.00365028 -3.53619 63.546000 Cu 0.411257 0.605493 1 92 63.546 0.00249788 -3.53791 63.546000 Cu 0.401426 0.622961 0.5 93 63.546 0.00128066 -3.53947 63.546000 Cu 0.490211 0.590182 1 66 63.546 0.00346145 -3.54058 63.546000 Cu 0.481076 0.607784 0.5 95 63.546 0.00114403 -3.53982 63.546000 Cu 0.630656 0.5952 1 69 63.546 0.00519224 -3.54186 63.546000 Cu 0.560341 0.592568 0.5 71 63.546 0.00917375 -3.54337 63.546000 Cu 0.550809 0.610154 2.90915e-17 96 63.546 0.00155913 -3.5407 63.546000 Cu 0.620605 0.612677 0.5 98 63.546 0.00226407 -3.54094 63.546000 Cu 0.771182 0.600637 1 73 63.546 0.00260531 -3.5358 63.546000 Cu 0.70096 0.597953 0.5 75 63.546 0.00112169 -3.53818 63.546000 Cu 0.690641 0.615319 2.90915e-17 100 63.546 0.00137035 -3.54033 63.546000 Cu 0.760917 0.617958 0.5 102 63.546 0.00036843 -3.53994 63.546000 Cu 0.831244 0.620512 1 104 63.546 0.000781887 -3.53974 63.546000 Cu 0.990211 0.590182 0 80 63.546 0.00346145 -3.54058 63.546000 Cu 0.981076 0.607784 0.5 83 63.546 0.00114403 -3.53982 63.546000 Cu 0.851027 0.585685 0 76 63.546 0.012476 -3.52997 63.546000 Cu 0.911257 0.605493 1 77 63.546 0.00249788 -3.53791 63.546000 Cu 0.920413 0.58794 0.5 78 63.546 0.00367017 -3.53511 63.546000 Cu 0.841288 0.603143 0.5 79 63.546 0.00365028 -3.53619 63.546000 Cu 0.901426 0.622961 0.5 106 63.546 0.00128066 -3.53947 63.546000 Cu 0.0311892 0.645291 2.90915e-17 109 63.546 0.000193685 -3.53936 63.546000 Cu 0.041085 0.627744 0.5 110 63.546 0.000280729 -3.53946 63.546000 Cu 0.110811 0.630222 1 112 63.546 0.000452289 -3.54021 63.546000 Cu 0.100982 0.647758 0.5 115 63.546 0.000111687 -3.53973 63.546000 Cu 0.0211397 0.66279 0.5 138 63.546 9.03151e-05 -3.53959 63.546000 Cu 0.0910527 0.665259 1 140 63.546 8.31372e-05 -3.53948 63.546000 Cu 0.170825 0.650251 1 113 63.546 0.000253737 -3.53997 63.546000 Cu 0.180698 0.632764 0.5 114 63.546 0.000759117 -3.54063 63.546000 Cu 0.250814 0.635337 2.90915e-17 116 63.546 0.000388359 -3.54116 63.546000 Cu 0.240872 0.652762 0.5 119 63.546 0.000279949 -3.54063 63.546000 Cu 0.311067 0.655292 1 117 63.546 0.000125347 -3.54086 63.546000 Cu 0.321117 0.637892 0.5 118 63.546 0.000140838 -3.54085 63.546000 Cu 0.471369 0.625342 1 94 63.546 0.000851105 -3.53907 63.546000 Cu 0.391341 0.640391 2.90915e-17 120 63.546 0.000422997 -3.53975 63.546000 Cu 0.451221 0.660318 2.90915e-17 121 63.546 0.000110105 -3.53969 63.546000 Cu 0.461355 0.642846 0.5 122 63.546 0.00040809 -3.53909 63.546000 Cu 0.381225 0.657821 0.5 123 63.546 0.000136765 -3.54019 63.546000 Cu 0.610811 0.630222 2.90915e-17 97 63.546 0.000452289 -3.54021 63.546000 Cu 0.541085 0.627744 0.5 99 63.546 0.000280729 -3.53946 63.546000 Cu 0.531189 0.645291 2.90915e-17 124 63.546 0.000193685 -3.53936 63.546000 Cu 0.591053 0.665259 2.90915e-17 125 63.546 8.31372e-05 -3.53948 63.546000 Cu 0.600982 0.647758 0.5 126 63.546 0.000111687 -3.53973 63.546000 Cu 0.52114 0.66279 0.5 127 63.546 9.03151e-05 -3.53959 63.546000 Cu 0.750814 0.635337 1 101 63.546 0.000388359 -3.54116 63.546000 Cu 0.680698 0.632764 0.5 103 63.546 0.000759117 -3.54063 63.546000 Cu 0.670825 0.650251 2.90915e-17 128 63.546 0.000253737 -3.53997 63.546000 Cu 0.740872 0.652762 0.5 130 63.546 0.000279949 -3.54063 63.546000 Cu 0.821117 0.637892 0.5 107 63.546 0.000140838 -3.54085 63.546000 Cu 0.811067 0.655292 2.90915e-17 132 63.546 0.000125347 -3.54086 63.546000 Cu 0.971369 0.625342 2.90915e-17 108 63.546 0.000851105 -3.53907 63.546000 Cu 0.891341 0.640391 2.90915e-17 105 63.546 0.000422997 -3.53975 63.546000 Cu 0.961355 0.642846 0.5 111 63.546 0.00040809 -3.53909 63.546000 Cu 0.881225 0.657821 0.5 134 63.546 0.000136765 -3.54019 63.546000 Cu 0.951221 0.660318 1 136 63.546 0.000110105 -3.53969 63.546000 Cu 0.0111527 0.680261 7.36904e-17 137 63.546 7.40985e-05 -3.53938 63.546000 Cu 0.0811326 0.682723 0.5 143 63.546 9.46919e-06 -3.53939 63.546000 Cu 0.00120225 0.697705 0.5 166 63.546 5.55864e-05 -3.53962 63.546000 Cu 0.0711989 0.700186 6.07075e-17 168 63.546 5.56319e-05 -3.53965 63.546000 Cu 0.14116 0.702667 0.5 170 63.546 2.97049e-05 -3.53993 63.546000 Cu 0.151134 0.685199 2.90915e-17 141 63.546 2.88221e-05 -3.53992 63.546000 Cu 0.161022 0.667731 0.5 142 63.546 2.88406e-05 -3.5398 63.546000 Cu 0.231025 0.670219 1 144 63.546 8.53654e-05 -3.54039 63.546000 Cu 0.291099 0.690201 1 145 63.546 1.25106e-05 -3.53995 63.546000 Cu 0.301048 0.672736 0.5 146 63.546 9.16862e-05 -3.54066 63.546000 Cu 0.221115 0.687695 0.5 147 63.546 2.09841e-05 -3.54009 63.546000 Cu 0.211127 0.705159 1 172 63.546 2.54205e-05 -3.53974 63.546000 Cu 0.281118 0.707662 0.5 174 63.546 3.3084e-05 -3.53978 63.546000 Cu 0.371099 0.675266 1 148 63.546 4.10622e-05 -3.54016 63.546000 Cu 0.431137 0.695217 1 149 63.546 1.03322e-05 -3.53988 63.546000 Cu 0.441128 0.677778 0.5 150 63.546 9.98054e-05 -3.53978 63.546000 Cu 0.361085 0.692712 0.5 151 63.546 2.32123e-05 -3.53975 63.546000 Cu 0.511153 0.680261 5.63798e-17 152 63.546 7.40985e-05 -3.53938 63.546000 Cu 0.571199 0.700186 1.00137e-16 153 63.546 5.56319e-05 -3.53965 63.546000 Cu 0.581133 0.682723 0.5 154 63.546 9.46919e-06 -3.53939 63.546000 Cu 0.501202 0.697705 0.5 155 63.546 5.55864e-05 -3.53962 63.546000 Cu 0.64116 0.702667 0.5 159 63.546 2.97049e-05 -3.53993 63.546000 Cu 0.661022 0.667731 0.5 131 63.546 2.88406e-05 -3.5398 63.546000 Cu 0.651134 0.685199 1 156 63.546 2.88221e-05 -3.53992 63.546000 Cu 0.731025 0.670219 2.90915e-17 129 63.546 8.53654e-05 -3.54039 63.546000 Cu 0.801048 0.672736 0.5 135 63.546 9.16862e-05 -3.54066 63.546000 Cu 0.711127 0.705159 1 157 63.546 2.54205e-05 -3.53974 63.546000 Cu 0.721115 0.687695 0.5 158 63.546 2.09841e-05 -3.54009 63.546000 Cu 0.791099 0.690201 1 160 63.546 1.25106e-05 -3.53995 63.546000 Cu 0.781118 0.707662 0.5 163 63.546 3.3084e-05 -3.53978 63.546000 Cu 0.871099 0.675266 2.90915e-17 133 63.546 4.10622e-05 -3.54016 63.546000 Cu 0.941128 0.677778 0.5 139 63.546 9.98054e-05 -3.53978 63.546000 Cu 0.861085 0.692712 0.5 162 63.546 2.32123e-05 -3.53975 63.546000 Cu 0.931137 0.695217 1 164 63.546 1.03322e-05 -3.53988 63.546000 Cu 0.131103 0.720138 3.99106e-17 169 63.546 1.02806e-05 -3.54018 63.546000 Cu 0.061133 0.71765 0.5 171 63.546 1.51835e-05 -3.54006 63.546000 Cu 0.051011 0.735114 5.52979e-17 196 63.546 5.76548e-06 -3.54012 63.546000 Cu 0.120986 0.73761 0.5 198 63.546 1.51173e-05 -3.54018 63.546000 Cu 0.271016 0.725116 5.52979e-18 173 63.546 2.50193e-05 -3.5401 63.546000 Cu 0.201056 0.722626 0.5 175 63.546 5.5447e-06 -3.54 63.546000 Cu 0.190961 0.740096 4.56809e-17 200 63.546 1.23328e-05 -3.54015 63.546000 Cu 0.260934 0.742584 0.5 202 63.546 1.81835e-05 -3.54008 63.546000 Cu 0.330907 0.745074 2.90915e-17 204 63.546 5.86569e-05 -3.54027 63.546000 Cu 0.351123 0.710167 1 176 63.546 3.25487e-05 -3.53994 63.546000 Cu 0.411043 0.730125 8.53511e-17 177 63.546 7.59577e-06 -3.53995 63.546000 Cu 0.421134 0.712667 0.5 178 63.546 2.79217e-05 -3.54033 63.546000 Cu 0.341045 0.727619 0.5 179 63.546 9.30776e-06 -3.54012 63.546000 Cu 0.400939 0.747575 0.5 206 63.546 1.33761e-05 -3.53984 63.546000 Cu 0.491153 0.715159 2.90915e-17 180 63.546 3.07489e-05 -3.54026 63.546000 Cu 0.481037 0.732622 0.5 183 63.546 5.39515e-06 -3.54013 63.546000 Cu 0.551011 0.735114 1 181 63.546 5.76548e-06 -3.54012 63.546000 Cu 0.561133 0.71765 0.5 182 63.546 1.51835e-05 -3.54006 63.546000 Cu 0.631103 0.720138 1 184 63.546 1.02806e-05 -3.54018 63.546000 Cu 0.620986 0.73761 0.5 187 63.546 1.51173e-05 -3.54018 63.546000 Cu 0.690961 0.740096 1.34759e-16 185 63.546 1.23328e-05 -3.54015 63.546000 Cu 0.701056 0.722626 0.5 186 63.546 5.5447e-06 -3.54 63.546000 Cu 0.771016 0.725116 1 188 63.546 2.50193e-05 -3.5401 63.546000 Cu 0.760934 0.742584 0.5 191 63.546 1.81835e-05 -3.54008 63.546000 Cu 0.830907 0.745074 8.42692e-17 189 63.546 5.86569e-05 -3.54027 63.546000 Cu 0.991153 0.715159 2.90915e-17 165 63.546 3.07489e-05 -3.54026 63.546000 Cu 0.981037 0.732622 0.5 194 63.546 5.39515e-06 -3.54013 63.546000 Cu 0.851123 0.710167 2.90915e-17 161 63.546 3.25487e-05 -3.53994 63.546000 Cu 0.921134 0.712667 0.5 167 63.546 2.79217e-05 -3.54033 63.546000 Cu 0.841045 0.727619 0.5 190 63.546 9.30776e-06 -3.54012 63.546000 Cu 0.911043 0.730125 2.90915e-17 192 63.546 7.59577e-06 -3.53995 63.546000 Cu 0.900939 0.747575 0.5 195 63.546 1.33761e-05 -3.53984 63.546000 Cu 0.110902 0.755069 7.69362e-18 197 63.546 2.79882e-05 -3.53974 63.546000 Cu 0.0409407 0.752579 0.5 199 63.546 1.49086e-05 -3.53981 63.546000 Cu 0.0308912 0.770033 1.6926e-16 224 63.546 1.32196e-05 -3.53986 63.546000 Cu 0.0909403 0.789983 1.94745e-17 225 63.546 2.16569e-06 -3.54021 63.546000 Cu 0.100904 0.772525 0.5 226 63.546 8.5322e-06 -3.53986 63.546000 Cu 0.0209104 0.787489 0.5 227 63.546 6.19939e-06 -3.5401 63.546000 Cu 0.25091 0.760047 2.90915e-17 201 63.546 5.06208e-06 -3.5397 63.546000 Cu 0.180924 0.757559 0.5 203 63.546 7.77468e-06 -3.53983 63.546000 Cu 0.170914 0.775012 1.77194e-16 228 63.546 8.52504e-06 -3.53989 63.546000 Cu 0.240913 0.777503 0.5 230 63.546 6.36576e-06 -3.53964 63.546000 Cu 0.320904 0.762539 0.5 207 63.546 3.11415e-06 -3.54013 63.546000 Cu 0.310913 0.78 5.34947e-17 232 63.546 2.56843e-06 -3.53981 63.546000 Cu 0.470928 0.750079 6.03468e-17 209 63.546 1.3066e-05 -3.53982 63.546000 Cu 0.390891 0.765033 7.93404e-17 205 63.546 1.18773e-05 -3.54014 63.546000 Cu 0.460881 0.767533 0.5 208 63.546 2.11673e-05 -3.54003 63.546000 Cu 0.380903 0.782501 0.5 234 63.546 6.67164e-06 -3.54009 63.546000 Cu 0.450902 0.784999 9.48479e-17 236 63.546 8.25013e-06 -3.54017 63.546000 Cu 0.530891 0.770033 1 210 63.546 1.32196e-05 -3.53986 63.546000 Cu 0.540941 0.752579 0.5 211 63.546 1.49086e-05 -3.53981 63.546000 Cu 0.610902 0.755069 2.90915e-17 212 63.546 2.79882e-05 -3.53974 63.546000 Cu 0.600904 0.772525 0.5 215 63.546 8.5322e-06 -3.53986 63.546000 Cu 0.52091 0.787489 0.5 239 63.546 6.19939e-06 -3.5401 63.546000 Cu 0.59094 0.789983 0 240 63.546 2.16569e-06 -3.54021 63.546000 Cu 0.670914 0.775012 1 213 63.546 8.52504e-06 -3.53989 63.546000 Cu 0.680924 0.757559 0.5 214 63.546 7.77468e-06 -3.53983 63.546000 Cu 0.75091 0.760047 1.21896e-16 216 63.546 5.06208e-06 -3.5397 63.546000 Cu 0.740913 0.777503 0.5 219 63.546 6.36576e-06 -3.53964 63.546000 Cu 0.810913 0.78 1.21535e-16 217 63.546 2.56843e-06 -3.53981 63.546000 Cu 0.820904 0.762539 0.5 218 63.546 3.11415e-06 -3.54013 63.546000 Cu 0.970928 0.750079 1 193 63.546 1.3066e-05 -3.53982 63.546000 Cu 0.890891 0.765033 1.11317e-16 220 63.546 1.18773e-05 -3.54014 63.546000 Cu 0.950902 0.784999 6.79202e-17 221 63.546 8.25013e-06 -3.54017 63.546000 Cu 0.960881 0.767533 0.5 222 63.546 2.11673e-05 -3.54003 63.546000 Cu 0.880903 0.782501 0.5 223 63.546 6.67164e-06 -3.54009 63.546000 Cu 0.01097 0.804949 1.21415e-16 252 63.546 2.95557e-06 -3.53992 63.546000 Cu 0.0710796 0.824901 2.90915e-17 253 63.546 8.28456e-06 -3.54016 63.546000 Cu 0.0809882 0.807441 0.5 254 63.546 5.86808e-06 -3.54011 63.546000 Cu 0.00105716 0.822406 0.5 255 63.546 4.35532e-06 -3.53987 63.546000 Cu 0.141081 0.827401 0.5 259 63.546 9.95387e-06 -3.54029 63.546000 Cu 0.16096 0.792475 0.5 231 63.546 3.69779e-06 -3.5401 63.546000 Cu 0.151035 0.809937 1.21415e-16 256 63.546 1.20639e-05 -3.54 63.546000 Cu 0.230953 0.794963 1.21655e-16 229 63.546 7.40336e-06 -3.53984 63.546000 Cu 0.30093 0.797456 0.5 235 63.546 2.08924e-05 -3.53999 63.546000 Cu 0.211077 0.829903 2.19989e-17 257 63.546 3.49419e-05 -3.53996 63.546000 Cu 0.221017 0.812433 0.5 258 63.546 1.73218e-06 -3.53978 63.546000 Cu 0.290984 0.814927 2.90915e-17 260 63.546 1.7796e-05 -3.53989 63.546000 Cu 0.281083 0.832392 0.5 263 63.546 3.34936e-05 -3.53987 63.546000 Cu 0.370947 0.79996 2.90915e-17 233 63.546 4.22048e-06 -3.54002 63.546000 Cu 0.440954 0.802459 0.5 237 63.546 9.28447e-06 -3.53989 63.546000 Cu 0.36098 0.817415 0.5 262 63.546 3.20789e-05 -3.53976 63.546000 Cu 0.431021 0.81991 2.90915e-17 264 63.546 3.38859e-06 -3.53966 63.546000 Cu 0.51097 0.804949 1 238 63.546 2.95557e-06 -3.53992 63.546000 Cu 0.580988 0.807441 0.5 243 63.546 5.86808e-06 -3.54011 63.546000 Cu 0.501057 0.822406 0.5 267 63.546 4.35532e-06 -3.53987 63.546000 Cu 0.57108 0.824901 8.04224e-17 268 63.546 8.28456e-06 -3.54016 63.546000 Cu 0.641081 0.827401 0.5 270 63.546 9.95387e-06 -3.54029 63.546000 Cu 0.651035 0.809937 2.90915e-17 241 63.546 1.20639e-05 -3.54 63.546000 Cu 0.66096 0.792475 0.5 242 63.546 3.69779e-06 -3.5401 63.546000 Cu 0.730953 0.794963 2.90915e-17 244 63.546 7.40336e-06 -3.53984 63.546000 Cu 0.790984 0.814927 2.4884e-17 245 63.546 1.7796e-05 -3.53989 63.546000 Cu 0.80093 0.797456 0.5 246 63.546 2.08924e-05 -3.53999 63.546000 Cu 0.721017 0.812433 0.5 247 63.546 1.73218e-06 -3.53978 63.546000 Cu 0.711077 0.829903 1.21415e-16 272 63.546 3.49419e-05 -3.53996 63.546000 Cu 0.781083 0.832392 0.5 274 63.546 3.34936e-05 -3.53987 63.546000 Cu 0.870947 0.79996 1.62768e-16 248 63.546 4.22048e-06 -3.54002 63.546000 Cu 0.931021 0.81991 8.21053e-17 249 63.546 3.38859e-06 -3.53966 63.546000 Cu 0.940954 0.802459 0.5 250 63.546 9.28447e-06 -3.53989 63.546000 Cu 0.86098 0.817415 0.5 251 63.546 3.20789e-05 -3.53976 63.546000 Cu 0.0512013 0.859816 4.17138e-17 281 63.546 4.10899e-05 -3.53941 63.546000 Cu 0.0611673 0.842367 0.5 282 63.546 1.45043e-05 -3.53987 63.546000 Cu 0.131176 0.844874 0 284 63.546 5.2686e-05 -3.54038 63.546000 Cu 0.121281 0.862322 0.5 287 63.546 5.09382e-05 -3.53996 63.546000 Cu 0.191436 0.864833 2.90915e-17 285 63.546 0.000148608 -3.54065 63.546000 Cu 0.201242 0.847374 0.5 286 63.546 3.99021e-05 -3.54038 63.546000 Cu 0.271277 0.849865 5.63798e-17 288 63.546 2.48496e-05 -3.54048 63.546000 Cu 0.261533 0.867348 0.5 291 63.546 0.000155006 -3.5411 63.546000 Cu 0.33157 0.869849 2.90915e-17 289 63.546 0.00013207 -3.54052 63.546000 Cu 0.351109 0.834872 8.94383e-17 261 63.546 3.66026e-05 -3.53983 63.546000 Cu 0.421116 0.83736 0.5 265 63.546 4.57448e-05 -3.53965 63.546000 Cu 0.341306 0.852355 0.5 290 63.546 3.05435e-05 -3.54018 63.546000 Cu 0.411248 0.85483 2.90915e-17 292 63.546 9.20779e-05 -3.53947 63.546000 Cu 0.401442 0.872329 0.5 293 63.546 8.6393e-05 -3.53936 63.546000 Cu 0.471259 0.874799 5.52979e-17 294 63.546 0.000274319 -3.53923 63.546000 Cu 0.491142 0.839858 2.90915e-17 266 63.546 1.02143e-05 -3.53981 63.546000 Cu 0.48121 0.857315 0.5 295 63.546 0.000101044 -3.53954 63.546000 Cu 0.631176 0.844874 6.70787e-17 269 63.546 5.2686e-05 -3.54038 63.546000 Cu 0.561167 0.842367 0.5 271 63.546 1.45043e-05 -3.53987 63.546000 Cu 0.551201 0.859816 5.58989e-17 296 63.546 4.10899e-05 -3.53941 63.546000 Cu 0.621281 0.862322 0.5 298 63.546 5.09382e-05 -3.53996 63.546000 Cu 0.771277 0.849865 1.31032e-16 273 63.546 2.48496e-05 -3.54048 63.546000 Cu 0.701242 0.847374 0.5 275 63.546 3.99021e-05 -3.54038 63.546000 Cu 0.691436 0.864833 1 300 63.546 0.000148608 -3.54065 63.546000 Cu 0.761533 0.867348 0.5 302 63.546 0.000155006 -3.5411 63.546000 Cu 0.83157 0.869849 1.82723e-17 304 63.546 0.00013207 -3.54052 63.546000 Cu 0.991142 0.839858 1.09754e-16 280 63.546 1.02143e-05 -3.53981 63.546000 Cu 0.98121 0.857315 0.5 283 63.546 0.000101044 -3.53954 63.546000 Cu 0.851109 0.834872 1 276 63.546 3.66026e-05 -3.53983 63.546000 Cu 0.911248 0.85483 2.90915e-17 277 63.546 9.20779e-05 -3.53947 63.546000 Cu 0.921116 0.83736 0.5 278 63.546 4.57448e-05 -3.53965 63.546000 Cu 0.841306 0.852355 0.5 279 63.546 3.05435e-05 -3.54018 63.546000 Cu 0.901442 0.872329 0.5 306 63.546 8.6393e-05 -3.53936 63.546000 Cu 0.971259 0.874799 3.60638e-19 308 63.546 0.000274319 -3.53923 63.546000 Cu 0.0312458 0.894742 2.40426e-19 309 63.546 0.000734752 -3.53939 63.546000 Cu 0.0412025 0.877261 0.5 310 63.546 0.000308842 -3.53944 63.546000 Cu 0.111296 0.879744 4.84458e-17 312 63.546 0.000149364 -3.53979 63.546000 Cu 0.1012 0.897166 0.5 315 63.546 0.000911057 -3.5394 63.546000 Cu 0.0214367 0.912287 0.5 338 63.546 0.00105223 -3.53981 63.546000 Cu 0.0912836 0.914609 1 340 63.546 0.00217887 -3.53777 63.546000 Cu 0.171413 0.899632 0 313 63.546 0.000479122 -3.53965 63.546000 Cu 0.181492 0.882258 0.5 314 63.546 0.000151981 -3.54053 63.546000 Cu 0.251752 0.884805 0 316 63.546 0.000571455 -3.54118 63.546000 Cu 0.241766 0.90219 0.5 319 63.546 0.000459517 -3.53995 63.546000 Cu 0.312047 0.904817 1 317 63.546 0.00188686 -3.54011 63.546000 Cu 0.321852 0.887354 0.5 318 63.546 0.000725888 -3.54071 63.546000 Cu 0.391714 0.88987 2.90915e-17 320 63.546 0.000293797 -3.53952 63.546000 Cu 0.451762 0.909911 1.22737e-16 321 63.546 0.000712412 -3.54049 63.546000 Cu 0.461449 0.892322 0.5 322 63.546 0.000236438 -3.5392 63.546000 Cu 0.382036 0.907417 0.5 323 63.546 0.00207735 -3.54045 63.546000 Cu 0.611296 0.879744 9.61702e-18 297 63.546 0.000149364 -3.53979 63.546000 Cu 0.541203 0.877261 0.5 299 63.546 0.000308842 -3.53944 63.546000 Cu 0.531246 0.894742 2.64468e-17 324 63.546 0.000734752 -3.53939 63.546000 Cu 0.591284 0.914609 2.90915e-17 325 63.546 0.00217887 -3.53777 63.546000 Cu 0.6012 0.897166 0.5 326 63.546 0.000911057 -3.5394 63.546000 Cu 0.521437 0.912287 0.5 327 63.546 0.00105223 -3.53981 63.546000 Cu 0.751752 0.884805 2.90915e-17 301 63.546 0.000571455 -3.54118 63.546000 Cu 0.681492 0.882258 0.5 303 63.546 0.000151981 -3.54053 63.546000 Cu 0.671413 0.899632 2.90915e-17 328 63.546 0.000479122 -3.53965 63.546000 Cu 0.741766 0.90219 0.5 330 63.546 0.000459517 -3.53995 63.546000 Cu 0.821852 0.887354 0.5 307 63.546 0.000725888 -3.54071 63.546000 Cu 0.812047 0.904817 2.90915e-17 332 63.546 0.00188686 -3.54011 63.546000 Cu 0.891714 0.88987 0 305 63.546 0.000293797 -3.53952 63.546000 Cu 0.961449 0.892322 0.5 311 63.546 0.000236438 -3.5392 63.546000 Cu 0.882036 0.907417 0.5 334 63.546 0.00207735 -3.54045 63.546000 Cu 0.951762 0.909911 0 336 63.546 0.000712412 -3.54049 63.546000 Cu 0.0121035 0.929886 1.87051e-16 337 63.546 0.00219392 -3.54062 63.546000 Cu 0.0818891 0.932123 0.5 343 63.546 0.00364677 -3.53526 63.546000 Cu 0.00360546 0.947484 0.5 366 63.546 0.0161231 -3.54103 63.546000 Cu 0.0732384 0.94982 2.90915e-17 368 63.546 0.0187231 -3.53421 63.546000 Cu 0.141684 0.95214 0.5 370 63.546 0.036776 -3.52368 63.546000 Cu 0.151374 0.934408 1 341 63.546 0.0114644 -3.53062 63.546000 Cu 0.16133 0.91699 0.5 342 63.546 0.00259503 -3.53677 63.546000 Cu 0.23153 0.919513 1 344 63.546 0.00210044 -3.53661 63.546000 Cu 0.290633 0.939525 2.90915e-17 345 63.546 0.00431386 -3.53574 63.546000 Cu 0.301775 0.922194 0.5 346 63.546 0.00177171 -3.53869 63.546000 Cu 0.220907 0.936872 0.5 347 63.546 0.0110956 -3.53127 63.546000 Cu 0.209555 0.954473 1 372 63.546 0.0398762 -3.52533 63.546000 Cu 0.278512 0.956947 0.5 374 63.546 0.0364763 -3.5385 63.546000 Cu 0.371998 0.924931 2.90915e-17 348 63.546 0.00551219 -3.54208 63.546000 Cu 0.432536 0.944975 6.15489e-17 349 63.546 0.0195531 -3.54412 63.546000 Cu 0.442125 0.927525 0.5 350 63.546 0.00727182 -3.54331 63.546000 Cu 0.3612 0.942295 0.5 351 63.546 0.0108057 -3.54347 63.546000 Cu 0.512103 0.929886 5.65e-18 352 63.546 0.00219392 -3.54062 63.546000 Cu 0.573238 0.94982 2.90915e-17 353 63.546 0.0187231 -3.53421 63.546000 Cu 0.581889 0.932123 0.5 354 63.546 0.00364677 -3.53526 63.546000 Cu 0.503605 0.947484 0.5 355 63.546 0.0161231 -3.54103 63.546000 Cu 0.641684 0.95214 0.5 359 63.546 0.036776 -3.52368 63.546000 Cu 0.66133 0.91699 0.5 331 63.546 0.00259503 -3.53677 63.546000 Cu 0.651374 0.934408 1.21535e-16 356 63.546 0.0114644 -3.53062 63.546000 Cu 0.73153 0.919513 4.05117e-17 329 63.546 0.00210044 -3.53661 63.546000 Cu 0.801775 0.922194 0.5 335 63.546 0.00177171 -3.53869 63.546000 Cu 0.709555 0.954473 8.22255e-17 357 63.546 0.0398762 -3.52533 63.546000 Cu 0.720907 0.936872 0.5 358 63.546 0.0110956 -3.53127 63.546000 Cu 0.790633 0.939525 1.21655e-16 360 63.546 0.00431386 -3.53574 63.546000 Cu 0.778512 0.956947 0.5 363 63.546 0.0364763 -3.5385 63.546000 Cu 0.871998 0.924931 1 333 63.546 0.00551219 -3.54208 63.546000 Cu 0.942125 0.927525 0.5 339 63.546 0.00727182 -3.54331 63.546000 Cu 0.8612 0.942295 0.5 362 63.546 0.0108057 -3.54347 63.546000 Cu 0.932536 0.944975 9.41266e-17 364 63.546 0.0195531 -3.54412 63.546000 Cu 0.131722 0.970581 1 369 63.546 0.0859159 -3.5049 63.546000 Cu 0.0654293 0.967906 0.5 371 63.546 0.15963 -3.50588 63.546000 Cu 0.0566174 0.986563 1 395 63.546 1.25074 -3.40834 63.546000 Cu 0.118713 0.990662 0.5 396 63.546 0.54547 -3.46943 63.546000 Cu 0.266035 0.97434 1.21655e-16 373 63.546 0.148247 -3.52101 63.546000 Cu 0.197219 0.97287 0.5 375 63.546 0.107263 -3.52628 63.546000 Cu 0.186723 0.991532 1.21655e-16 397 63.546 0.191853 -3.52017 63.546000 Cu 0.256597 0.992175 0.5 398 63.546 0.163875 -3.52631 63.546000 Cu 0.327614 0.992722 1.21535e-16 399 63.546 0.380149 -3.50024 63.546000 Cu 0.405168 0.994977 0.5 436 63.546 4.70246 -3.45872 63.546000 Cu 0.476785 0.99869 7.69362e-18 401 63.546 9.46299 -3.33489 63.546000 Cu 0.349725 0.959368 1.21535e-16 376 63.546 0.0269313 -3.53816 63.546000 Cu 0.412663 0.978569 9.61702e-18 377 63.546 0.06302 -3.51762 63.546000 Cu 0.423102 0.962048 0.5 378 63.546 0.0249619 -3.53729 63.546000 Cu 0.339022 0.976281 0.5 379 63.546 0.0643074 -3.53927 63.546000 Cu 0.495476 0.964949 1 380 63.546 0.0807863 -3.54086 63.546000 Cu 0.487579 0.982113 0.5 383 63.546 1.10999 -3.45293 63.546000 Cu 0.556617 0.986563 2.90915e-17 381 63.546 1.25074 -3.40834 63.546000 Cu 0.565429 0.967906 0.5 382 63.546 0.15963 -3.50588 63.546000 Cu 0.631722 0.970581 2.90915e-17 384 63.546 0.0859159 -3.5049 63.546000 Cu 0.618713 0.990662 0.5 387 63.546 0.54547 -3.46943 63.546000 Cu 0.686723 0.991532 1 385 63.546 0.191853 -3.52017 63.546000 Cu 0.697219 0.97287 0.5 386 63.546 0.107263 -3.52628 63.546000 Cu 0.766035 0.97434 2.90915e-17 388 63.546 0.148247 -3.52101 63.546000 Cu 0.756597 0.992175 0.5 391 63.546 0.163875 -3.52631 63.546000 Cu 0.827614 0.992722 1.00137e-16 389 63.546 0.380149 -3.50024 63.546000 Cu 0.976785 0.99869 1.20213e-19 408 63.546 9.46299 -3.33489 63.546000 Cu 0.905168 0.994977 0.5 409 63.546 4.70246 -3.45872 63.546000 Cu 0.995476 0.964949 3.10149e-17 365 63.546 0.0807863 -3.54086 63.546000 Cu 0.987579 0.982113 0.5 393 63.546 1.10999 -3.45293 63.546000 Cu 0.849725 0.959368 2.90915e-17 361 63.546 0.0269313 -3.53816 63.546000 Cu 0.923102 0.962048 0.5 367 63.546 0.0249619 -3.53729 63.546000 Cu 0.839022 0.976281 0.5 390 63.546 0.0643074 -3.53927 63.546000 Cu 0.912663 0.978569 2.90915e-17 392 63.546 0.06302 -3.51762