Number of particles = 796 A = 1 Angstrom (basic length-scale) H0(1,1) = 25.5937 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 102.533 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.6075 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 0.0556344 0.0332097 6.01083e-19 423 63.546 0.912061 -3.43091 63.546000 Cu 0.0349691 0.0108883 0.5 424 63.546 8.66715 -3.55231 63.546000 Cu 0.106443 0.00982408 1.28031e-16 426 63.546 2.42445 -3.52247 63.546000 Cu 0.117934 0.0291847 0.5 429 63.546 0.470863 -3.47372 63.546000 Cu 0.185632 0.0283124 7.21299e-19 427 63.546 0.231123 -3.52062 63.546000 Cu 0.180929 0.00994916 0.5 428 63.546 0.405457 -3.52481 63.546000 Cu 0.252691 0.0100043 1.32479e-16 430 63.546 0.171065 -3.5339 63.546000 Cu 0.326657 0.0273399 1.41134e-16 431 63.546 0.333913 -3.50671 63.546000 Cu 0.323129 0.0100207 0.5 432 63.546 0.491824 -3.50013 63.546000 Cu 0.255708 0.0277955 0.5 433 63.546 0.161217 -3.52884 63.546000 Cu 0.391686 0.0100579 2.4404e-16 434 63.546 6.42629 -3.21728 63.546000 Cu 0.474224 0.0218451 3.2218e-17 435 63.546 9.00995 -3.31305 63.546000 Cu 0.403208 0.0253423 0.5 437 63.546 4.38859 -3.4598 63.546000 Cu 0.485932 0.0381558 0.5 464 63.546 0.853248 -3.45477 63.546000 Cu 0.606443 0.00982408 1.22501e-16 402 63.546 2.42445 -3.52247 63.546000 Cu 0.534969 0.0108883 0.5 403 63.546 8.66715 -3.55231 63.546000 Cu 0.555634 0.0332097 1.22621e-16 410 63.546 0.912061 -3.43091 63.546000 Cu 0.617934 0.0291847 0.5 412 63.546 0.470863 -3.47372 63.546000 Cu 0.680929 0.00994916 0.5 405 63.546 0.405457 -3.52481 63.546000 Cu 0.685632 0.0283124 4.14747e-17 414 63.546 0.231123 -3.52062 63.546000 Cu 0.752691 0.0100043 1.2202e-16 404 63.546 0.171065 -3.5339 63.546000 Cu 0.823129 0.0100207 0.5 407 63.546 0.491824 -3.50013 63.546000 Cu 0.755708 0.0277955 0.5 416 63.546 0.161217 -3.52884 63.546000 Cu 0.826657 0.0273399 1.23703e-16 418 63.546 0.333913 -3.50671 63.546000 Cu 0.891686 0.0100579 4.86637e-16 406 63.546 6.42629 -3.21728 63.546000 Cu 0.903208 0.0253423 0.5 420 63.546 4.38859 -3.4598 63.546000 Cu 0.974224 0.0218451 1.22501e-16 422 63.546 9.00995 -3.31305 63.546000 Cu 0.985932 0.0381558 0.5 425 63.546 0.853248 -3.45477 63.546000 Cu 0.0714703 0.0701587 1 451 63.546 0.0225003 -3.53336 63.546000 Cu 0.0641144 0.0520112 0.5 452 63.546 0.18467 -3.51046 63.546000 Cu 0.130278 0.0493183 7.63375e-17 454 63.546 0.0820189 -3.50211 63.546000 Cu 0.139804 0.0678477 0.5 457 63.546 0.0367687 -3.52242 63.546000 Cu 0.00173047 0.072576 0.5 453 63.546 0.0228402 -3.54096 63.546000 Cu 0.207516 0.0655557 1.22982e-16 455 63.546 0.0409021 -3.52582 63.546000 Cu 0.195704 0.0470674 0.5 456 63.546 0.107431 -3.527 63.546000 Cu 0.264285 0.0456635 6.01083e-19 458 63.546 0.152579 -3.52423 63.546000 Cu 0.276274 0.0631585 0.5 461 63.546 0.0416557 -3.53818 63.546000 Cu 0.347329 0.0608254 7.06873e-17 459 63.546 0.0353571 -3.53722 63.546000 Cu 0.336972 0.0438883 0.5 460 63.546 0.0711433 -3.53925 63.546000 Cu 0.410557 0.0417606 1.2202e-16 462 63.546 0.0806359 -3.51401 63.546000 Cu 0.493819 0.0551671 1.13124e-16 463 63.546 0.102476 -3.53908 63.546000 Cu 0.4209 0.0581815 0.5 465 63.546 0.0239357 -3.53602 63.546000 Cu 0.430332 0.0751538 3.6065e-19 491 63.546 0.0205575 -3.54382 63.546000 Cu 0.50173 0.072576 0.5 493 63.546 0.0228402 -3.54096 63.546000 Cu 0.630278 0.0493183 1.22621e-16 411 63.546 0.0820189 -3.50211 63.546000 Cu 0.564114 0.0520112 0.5 413 63.546 0.18467 -3.51046 63.546000 Cu 0.57147 0.0701587 6.15509e-17 438 63.546 0.0225003 -3.53336 63.546000 Cu 0.639804 0.0678477 0.5 440 63.546 0.0367687 -3.52242 63.546000 Cu 0.764285 0.0456635 9.85776e-17 415 63.546 0.152579 -3.52423 63.546000 Cu 0.695704 0.0470674 0.5 417 63.546 0.107431 -3.527 63.546000 Cu 0.707516 0.0655557 0 442 63.546 0.0409021 -3.52582 63.546000 Cu 0.776274 0.0631585 0.5 444 63.546 0.0416557 -3.53818 63.546000 Cu 0.836972 0.0438883 0.5 421 63.546 0.0711433 -3.53925 63.546000 Cu 0.847329 0.0608254 1.22741e-16 446 63.546 0.0353571 -3.53722 63.546000 Cu 0.910557 0.0417606 2.4404e-16 419 63.546 0.0806359 -3.51401 63.546000 Cu 0.930332 0.0751538 1.68063e-16 447 63.546 0.0205575 -3.54382 63.546000 Cu 0.9209 0.0581815 0.5 448 63.546 0.0239357 -3.53602 63.546000 Cu 0.993819 0.0551671 3.6065e-19 450 63.546 0.102476 -3.53908 63.546000 Cu 0.0889601 0.105448 7.21299e-19 480 63.546 0.00221694 -3.53793 63.546000 Cu 0.0797899 0.0878963 0.5 481 63.546 0.00346807 -3.53502 63.546000 Cu 0.149161 0.0856421 1.57484e-17 483 63.546 0.0119508 -3.52991 63.546000 Cu 0.158907 0.103104 0.5 486 63.546 0.00346409 -3.53614 63.546000 Cu 0.00998901 0.0901435 6.01083e-19 479 63.546 0.00360336 -3.54055 63.546000 Cu 0.0191531 0.107742 0.5 482 63.546 0.00108178 -3.53987 63.546000 Cu 0.228978 0.100608 5.36166e-17 484 63.546 0.00272049 -3.53586 63.546000 Cu 0.218488 0.0832202 0.5 485 63.546 0.012441 -3.53036 63.546000 Cu 0.288113 0.0806144 1.22861e-16 487 63.546 0.00626489 -3.53486 63.546000 Cu 0.299193 0.0979331 0.5 490 63.546 0.00108028 -3.53816 63.546000 Cu 0.309539 0.115293 0 517 63.546 0.00130257 -3.54029 63.546000 Cu 0.36949 0.0951822 1 488 63.546 0.00466845 -3.54184 63.546000 Cu 0.358741 0.077867 0.5 489 63.546 0.0106107 -3.54301 63.546000 Cu 0.439842 0.0925393 0.5 494 63.546 0.00918418 -3.54349 63.546000 Cu 0.379602 0.112648 0.5 519 63.546 0.00233062 -3.5409 63.546000 Cu 0.44941 0.110118 1.22501e-16 521 63.546 0.00165909 -3.54077 63.546000 Cu 0.509989 0.0901435 3.6065e-19 492 63.546 0.00360336 -3.54055 63.546000 Cu 0.519153 0.107742 0.5 522 63.546 0.00108178 -3.53987 63.546000 Cu 0.649161 0.0856421 1.62052e-16 439 63.546 0.0119508 -3.52991 63.546000 Cu 0.57979 0.0878963 0.5 441 63.546 0.00346807 -3.53502 63.546000 Cu 0.58896 0.105448 2.40433e-19 467 63.546 0.00221694 -3.53793 63.546000 Cu 0.658907 0.103104 0.5 469 63.546 0.00346409 -3.53614 63.546000 Cu 0.788113 0.0806144 4.11141e-17 443 63.546 0.00626489 -3.53486 63.546000 Cu 0.718488 0.0832202 0.5 445 63.546 0.012441 -3.53036 63.546000 Cu 0.728978 0.100608 2.40433e-19 471 63.546 0.00272049 -3.53586 63.546000 Cu 0.809539 0.115293 3.02946e-17 472 63.546 0.00130257 -3.54029 63.546000 Cu 0.799193 0.0979331 0.5 473 63.546 0.00108028 -3.53816 63.546000 Cu 0.858741 0.077867 0.5 449 63.546 0.0106107 -3.54301 63.546000 Cu 0.86949 0.0951822 7.68184e-17 475 63.546 0.00466845 -3.54184 63.546000 Cu 0.94941 0.110118 7.06873e-17 476 63.546 0.00165909 -3.54077 63.546000 Cu 0.939842 0.0925393 0.5 477 63.546 0.00918418 -3.54349 63.546000 Cu 0.879602 0.112648 0.5 478 63.546 0.00233062 -3.5409 63.546000 Cu 0.0288689 0.125304 1.5568e-16 509 63.546 0.000715374 -3.53916 63.546000 Cu 0.108856 0.140366 2.44641e-16 510 63.546 0.00045428 -3.53971 63.546000 Cu 0.0987874 0.122926 0.5 511 63.546 0.00119309 -3.53952 63.546000 Cu 0.0388627 0.142814 0.5 512 63.546 0.000366542 -3.53906 63.546000 Cu 0.168928 0.120483 1 513 63.546 0.000889115 -3.53972 63.546000 Cu 0.179047 0.13787 0.5 516 63.546 0.000184798 -3.54078 63.546000 Cu 0.249357 0.13531 1.22501e-16 514 63.546 0.000342875 -3.54126 63.546000 Cu 0.239245 0.117933 0.5 515 63.546 0.000355454 -3.54 63.546000 Cu 0.319497 0.132733 0.5 520 63.546 0.000758661 -3.54078 63.546000 Cu 0.25931 0.152735 0.5 544 63.546 0.000264775 -3.54063 63.546000 Cu 0.329374 0.150217 3.6065e-19 546 63.546 0.000258233 -3.54 63.546000 Cu 0.389419 0.130189 1.20217e-18 518 63.546 0.00049234 -3.54042 63.546000 Cu 0.459167 0.127708 0.5 523 63.546 0.000242841 -3.53954 63.546000 Cu 0.399232 0.147723 0.5 548 63.546 0.000103889 -3.53961 63.546000 Cu 0.46904 0.145255 6.01083e-19 550 63.546 0.000153357 -3.53919 63.546000 Cu 0.528869 0.125304 1 466 63.546 0.000715374 -3.53916 63.546000 Cu 0.598787 0.122926 0.5 470 63.546 0.00119309 -3.53952 63.546000 Cu 0.538863 0.142814 0.5 496 63.546 0.000366542 -3.53906 63.546000 Cu 0.608856 0.140366 6.92447e-17 497 63.546 0.00045428 -3.53971 63.546000 Cu 0.668928 0.120483 2.40433e-19 468 63.546 0.000889115 -3.53972 63.546000 Cu 0.679047 0.13787 0.5 499 63.546 0.000184798 -3.54078 63.546000 Cu 0.739245 0.117933 0.5 474 63.546 0.000355454 -3.54 63.546000 Cu 0.749357 0.13531 1.22621e-16 501 63.546 0.000342875 -3.54126 63.546000 Cu 0.829374 0.150217 1.2238e-16 502 63.546 0.000258233 -3.54 63.546000 Cu 0.819497 0.132733 0.5 503 63.546 0.000758661 -3.54078 63.546000 Cu 0.75931 0.152735 0.5 504 63.546 0.000264775 -3.54063 63.546000 Cu 0.889419 0.130189 5.3857e-17 505 63.546 0.00049234 -3.54042 63.546000 Cu 0.96904 0.145255 1.22501e-16 506 63.546 0.000153357 -3.53919 63.546000 Cu 0.959167 0.127708 0.5 507 63.546 0.000242841 -3.53954 63.546000 Cu 0.899232 0.147723 0.5 508 63.546 0.000103889 -3.53961 63.546000 Cu 0.0489555 0.160292 1.20217e-19 538 63.546 0.000135826 -3.53955 63.546000 Cu 0.12906 0.175243 3.6065e-19 539 63.546 3.43057e-05 -3.54017 63.546000 Cu 0.118955 0.1578 0.5 540 63.546 0.000164183 -3.54008 63.546000 Cu 0.0590307 0.177754 0.5 541 63.546 9.32331e-05 -3.53979 63.546000 Cu 0.189118 0.15527 1.02184e-17 542 63.546 8.42429e-05 -3.54076 63.546000 Cu 0.269186 0.17019 4.80866e-19 543 63.546 9.21869e-05 -3.5402 63.546000 Cu 0.199148 0.172708 0.5 545 63.546 9.41892e-05 -3.54065 63.546000 Cu 0.209102 0.190171 2.40433e-19 570 63.546 2.50661e-05 -3.53999 63.546000 Cu 0.279116 0.187661 0.5 572 63.546 2.92039e-05 -3.54005 63.546000 Cu 0.339182 0.167699 0.5 549 63.546 3.74116e-05 -3.53977 63.546000 Cu 0.34909 0.185174 1 574 63.546 1.51319e-05 -3.53991 63.546000 Cu 0.409143 0.165222 3.6065e-19 547 63.546 4.23166e-05 -3.53952 63.546000 Cu 0.479045 0.162756 0.5 551 63.546 6.14545e-05 -3.53948 63.546000 Cu 0.419065 0.1827 0.5 576 63.546 7.66602e-06 -3.53965 63.546000 Cu 0.489013 0.180235 1 578 63.546 6.76613e-05 -3.53966 63.546000 Cu 0.548956 0.160292 2.40433e-19 495 63.546 0.000135826 -3.53955 63.546000 Cu 0.618955 0.1578 0.5 500 63.546 0.000164183 -3.54008 63.546000 Cu 0.559031 0.177754 0.5 525 63.546 9.32331e-05 -3.53979 63.546000 Cu 0.62906 0.175243 1.43298e-16 526 63.546 3.43057e-05 -3.54017 63.546000 Cu 0.689118 0.15527 4.17151e-17 498 63.546 8.42429e-05 -3.54076 63.546000 Cu 0.709102 0.190171 7.92227e-17 527 63.546 2.50661e-05 -3.53999 63.546000 Cu 0.699148 0.172708 0.5 528 63.546 9.41892e-05 -3.54065 63.546000 Cu 0.769186 0.17019 0 530 63.546 9.21869e-05 -3.5402 63.546000 Cu 0.779116 0.187661 0.5 533 63.546 2.92039e-05 -3.54005 63.546000 Cu 0.84909 0.185174 0 531 63.546 1.51319e-05 -3.53991 63.546000 Cu 0.839182 0.167699 0.5 532 63.546 3.74116e-05 -3.53977 63.546000 Cu 0.909143 0.165222 0 534 63.546 4.23166e-05 -3.53952 63.546000 Cu 0.989013 0.180235 1 535 63.546 6.76613e-05 -3.53966 63.546000 Cu 0.979045 0.162756 0.5 536 63.546 6.14545e-05 -3.53948 63.546000 Cu 0.919065 0.1827 0.5 537 63.546 7.66602e-06 -3.53965 63.546000 Cu 0.0690413 0.195199 1 566 63.546 2.16538e-05 -3.53986 63.546000 Cu 0.149106 0.210141 6.8283e-17 567 63.546 2.78396e-05 -3.53992 63.546000 Cu 0.139101 0.192686 0.5 568 63.546 1.8072e-05 -3.53973 63.546000 Cu 0.0791127 0.21265 0.5 569 63.546 1.09368e-05 -3.54018 63.546000 Cu 0.089211 0.230105 4.74855e-17 596 63.546 2.09661e-06 -3.54011 63.546000 Cu 0.159221 0.227601 0.5 598 63.546 8.50864e-06 -3.54025 63.546000 Cu 0.0090756 0.215144 1 563 63.546 1.56322e-05 -3.54008 63.546000 Cu 0.28909 0.205133 1.22501e-16 571 63.546 3.35728e-05 -3.53989 63.546000 Cu 0.219108 0.207629 0.5 573 63.546 4.80147e-05 -3.53989 63.546000 Cu 0.229223 0.225099 0 600 63.546 2.24362e-05 -3.54027 63.546000 Cu 0.299155 0.222607 0.5 602 63.546 1.3222e-05 -3.54015 63.546000 Cu 0.429018 0.200172 1 575 63.546 4.30938e-05 -3.53957 63.546000 Cu 0.359065 0.202646 0.5 577 63.546 1.90806e-05 -3.53992 63.546000 Cu 0.499004 0.197693 0.5 579 63.546 5.77576e-05 -3.53965 63.546000 Cu 0.369099 0.220123 1 604 63.546 2.72734e-05 -3.54013 63.546000 Cu 0.439076 0.217635 0.5 606 63.546 2.25123e-05 -3.53985 63.546000 Cu 0.509076 0.215144 0 608 63.546 1.56322e-05 -3.54008 63.546000 Cu 0.569041 0.195199 7.03267e-17 524 63.546 2.16538e-05 -3.53986 63.546000 Cu 0.639101 0.192686 0.5 529 63.546 1.8072e-05 -3.53973 63.546000 Cu 0.589211 0.230105 1.2202e-16 552 63.546 2.09661e-06 -3.54011 63.546000 Cu 0.579113 0.21265 0.5 553 63.546 1.09368e-05 -3.54018 63.546000 Cu 0.649106 0.210141 5.3857e-17 554 63.546 2.78396e-05 -3.53992 63.546000 Cu 0.659221 0.227601 0.5 557 63.546 8.50864e-06 -3.54025 63.546000 Cu 0.729223 0.225099 0 555 63.546 2.24362e-05 -3.54027 63.546000 Cu 0.719108 0.207629 0.5 556 63.546 4.80147e-05 -3.53989 63.546000 Cu 0.78909 0.205133 1 558 63.546 3.35728e-05 -3.53989 63.546000 Cu 0.799155 0.222607 0.5 561 63.546 1.3222e-05 -3.54015 63.546000 Cu 0.869099 0.220123 1 559 63.546 2.72734e-05 -3.54013 63.546000 Cu 0.859065 0.202646 0.5 560 63.546 1.90806e-05 -3.53992 63.546000 Cu 0.929018 0.200172 1 562 63.546 4.30938e-05 -3.53957 63.546000 Cu 0.999004 0.197693 0.5 564 63.546 5.77576e-05 -3.53965 63.546000 Cu 0.939076 0.217635 0.5 565 63.546 2.25123e-05 -3.53985 63.546000 Cu 0.0293 0.250062 2.40433e-19 593 63.546 6.76842e-06 -3.53984 63.546000 Cu 0.0992968 0.247561 0.5 599 63.546 1.25089e-05 -3.54 63.546000 Cu 0.0393908 0.267528 0.5 624 63.546 2.08259e-05 -3.54007 63.546000 Cu 0.109351 0.265025 1 626 63.546 1.08079e-05 -3.54023 63.546000 Cu 0.0191797 0.232605 0.5 594 63.546 8.29153e-06 -3.54015 63.546000 Cu 0.169348 0.245062 1.20217e-19 597 63.546 6.14276e-05 -3.54016 63.546000 Cu 0.17934 0.262527 0.5 628 63.546 1.05818e-05 -3.54018 63.546000 Cu 0.309275 0.240089 8.70368e-17 601 63.546 2.52328e-05 -3.53989 63.546000 Cu 0.239319 0.242576 0.5 603 63.546 3.03075e-05 -3.53979 63.546000 Cu 0.249352 0.260037 0 630 63.546 6.63001e-06 -3.53961 63.546000 Cu 0.319346 0.257552 0.5 632 63.546 1.85413e-05 -3.53987 63.546000 Cu 0.44919 0.235097 1 605 63.546 6.36406e-06 -3.53988 63.546000 Cu 0.379222 0.237596 0.5 607 63.546 9.51546e-06 -3.53989 63.546000 Cu 0.389361 0.255059 1.20217e-19 634 63.546 4.55934e-05 -3.53987 63.546000 Cu 0.459303 0.252564 0.5 636 63.546 6.94334e-06 -3.5398 63.546000 Cu 0.51918 0.232605 0.5 609 63.546 8.29153e-06 -3.54015 63.546000 Cu 0.5293 0.250062 0 580 63.546 6.76842e-06 -3.53984 63.546000 Cu 0.609351 0.265025 1.06392e-16 581 63.546 1.08079e-05 -3.54023 63.546000 Cu 0.599297 0.247561 0.5 582 63.546 1.25089e-05 -3.54 63.546000 Cu 0.539391 0.267528 0.5 583 63.546 2.08259e-05 -3.54007 63.546000 Cu 0.669348 0.245062 1 584 63.546 6.14276e-05 -3.54016 63.546000 Cu 0.67934 0.262527 0.5 587 63.546 1.05818e-05 -3.54018 63.546000 Cu 0.749352 0.260037 0 585 63.546 6.63001e-06 -3.53961 63.546000 Cu 0.739319 0.242576 0.5 586 63.546 3.03075e-05 -3.53979 63.546000 Cu 0.809275 0.240089 1 588 63.546 2.52328e-05 -3.53989 63.546000 Cu 0.819346 0.257552 0.5 591 63.546 1.85413e-05 -3.53987 63.546000 Cu 0.889361 0.255059 2.10379e-17 589 63.546 4.55934e-05 -3.53987 63.546000 Cu 0.879222 0.237596 0.5 590 63.546 9.51546e-06 -3.53989 63.546000 Cu 0.94919 0.235097 2.40433e-19 592 63.546 6.36406e-06 -3.53988 63.546000 Cu 0.959303 0.252564 0.5 595 63.546 6.94334e-06 -3.5398 63.546000 Cu 0.0494073 0.285004 1 623 63.546 3.15839e-05 -3.54003 63.546000 Cu 0.119386 0.2825 0.5 629 63.546 1.0155e-05 -3.54012 63.546000 Cu 0.0593677 0.302465 0.5 652 63.546 2.22704e-05 -3.53977 63.546000 Cu 0.12938 0.299964 1 654 63.546 1.44639e-05 -3.54002 63.546000 Cu 0.189369 0.279996 1 627 63.546 5.85981e-06 -3.53987 63.546000 Cu 0.329353 0.275014 1 631 63.546 4.1811e-06 -3.54015 63.546000 Cu 0.259343 0.2775 0.5 633 63.546 6.77361e-06 -3.53963 63.546000 Cu 0.199381 0.297459 0.5 656 63.546 3.16731e-05 -3.5399 63.546000 Cu 0.269331 0.294965 0 658 63.546 1.21507e-05 -3.53969 63.546000 Cu 0.339315 0.292478 0.5 660 63.546 8.68826e-06 -3.53997 63.546000 Cu 0.469409 0.270029 0 635 63.546 4.11331e-05 -3.54009 63.546000 Cu 0.39939 0.272527 0.5 637 63.546 2.98001e-05 -3.54022 63.546000 Cu 0.409351 0.289987 0 662 63.546 3.47544e-06 -3.54032 63.546000 Cu 0.489336 0.304958 1 663 63.546 1.10767e-05 -3.53998 63.546000 Cu 0.479399 0.287497 0.5 664 63.546 2.19296e-05 -3.54028 63.546000 Cu 0.419274 0.30745 0.5 665 63.546 7.69273e-06 -3.54016 63.546000 Cu 0.549407 0.285004 0 610 63.546 3.15839e-05 -3.54003 63.546000 Cu 0.62938 0.299964 1.21779e-16 611 63.546 1.44639e-05 -3.54002 63.546000 Cu 0.619386 0.2825 0.5 612 63.546 1.0155e-05 -3.54012 63.546000 Cu 0.559368 0.302465 0.5 613 63.546 2.22704e-05 -3.53977 63.546000 Cu 0.689369 0.279996 0 614 63.546 5.85981e-06 -3.53987 63.546000 Cu 0.769331 0.294965 3.87097e-17 615 63.546 1.21507e-05 -3.53969 63.546000 Cu 0.759343 0.2775 0.5 616 63.546 6.77361e-06 -3.53963 63.546000 Cu 0.699381 0.297459 0.5 617 63.546 3.16731e-05 -3.5399 63.546000 Cu 0.829353 0.275014 0 618 63.546 4.1811e-06 -3.54015 63.546000 Cu 0.839315 0.292478 0.5 621 63.546 8.68826e-06 -3.53997 63.546000 Cu 0.909351 0.289987 1 619 63.546 3.47544e-06 -3.54032 63.546000 Cu 0.89939 0.272527 0.5 620 63.546 2.98001e-05 -3.54022 63.546000 Cu 0.969409 0.270029 8.41516e-19 622 63.546 4.11331e-05 -3.54009 63.546000 Cu 0.979399 0.287497 0.5 625 63.546 2.19296e-05 -3.54028 63.546000 Cu 0.919274 0.30745 0.5 648 63.546 7.69273e-06 -3.54016 63.546000 Cu 0.989336 0.304958 0 650 63.546 1.10767e-05 -3.53998 63.546000 Cu 0.0692887 0.319915 0 651 63.546 1.25047e-05 -3.53964 63.546000 Cu 0.139335 0.317425 0.5 657 63.546 5.20038e-05 -3.53972 63.546000 Cu 0.0791492 0.337363 0.5 681 63.546 4.81456e-05 -3.53974 63.546000 Cu 0.14918 0.334879 1.17812e-17 683 63.546 4.18964e-05 -3.53967 63.546000 Cu 0.00912302 0.339863 2.87318e-17 679 63.546 1.45017e-05 -3.53973 63.546000 Cu 0.209327 0.314936 0 655 63.546 3.23456e-05 -3.53997 63.546000 Cu 0.279294 0.312442 0.5 661 63.546 6.82832e-06 -3.53987 63.546000 Cu 0.219212 0.332406 0.5 685 63.546 4.53779e-05 -3.53983 63.546000 Cu 0.28921 0.329919 7.81408e-18 687 63.546 4.36227e-05 -3.53997 63.546000 Cu 0.349259 0.309946 1 659 63.546 1.05899e-05 -3.53989 63.546000 Cu 0.369094 0.344888 4.70047e-17 688 63.546 5.40582e-05 -3.54032 63.546000 Cu 0.359186 0.327416 0.5 689 63.546 1.12011e-05 -3.54025 63.546000 Cu 0.429206 0.324909 1 691 63.546 1.22851e-05 -3.54011 63.546000 Cu 0.499225 0.32241 0.5 693 63.546 8.31882e-06 -3.53976 63.546000 Cu 0.439113 0.342374 0.5 694 63.546 7.29782e-06 -3.53978 63.546000 Cu 0.509123 0.339863 1 692 63.546 1.45017e-05 -3.53973 63.546000 Cu 0.569289 0.319915 2.94531e-17 638 63.546 1.25047e-05 -3.53964 63.546000 Cu 0.64918 0.334879 1 639 63.546 4.18964e-05 -3.53967 63.546000 Cu 0.639335 0.317425 0.5 640 63.546 5.20038e-05 -3.53972 63.546000 Cu 0.579149 0.337363 0.5 641 63.546 4.81456e-05 -3.53974 63.546000 Cu 0.709327 0.314936 1.21419e-17 642 63.546 3.23456e-05 -3.53997 63.546000 Cu 0.78921 0.329919 6.15509e-17 643 63.546 4.36227e-05 -3.53997 63.546000 Cu 0.779294 0.312442 0.5 644 63.546 6.82832e-06 -3.53987 63.546000 Cu 0.719212 0.332406 0.5 645 63.546 4.53779e-05 -3.53983 63.546000 Cu 0.849259 0.309946 9.52115e-17 646 63.546 1.05899e-05 -3.53989 63.546000 Cu 0.929206 0.324909 7.08076e-17 647 63.546 1.22851e-05 -3.54011 63.546000 Cu 0.859186 0.327416 0.5 649 63.546 1.12011e-05 -3.54025 63.546000 Cu 0.999225 0.32241 0.5 653 63.546 8.31882e-06 -3.53976 63.546000 Cu 0.869094 0.344888 4.46003e-17 675 63.546 5.40582e-05 -3.54032 63.546000 Cu 0.939113 0.342374 0.5 677 63.546 7.29782e-06 -3.53978 63.546000 Cu 0.0890032 0.354833 0 680 63.546 0.000102763 -3.53971 63.546000 Cu 0.15896 0.352359 0.5 686 63.546 2.77149e-05 -3.54013 63.546000 Cu 0.0289506 0.374802 7.21299e-19 709 63.546 0.000252034 -3.53908 63.546000 Cu 0.0987778 0.372332 0.5 711 63.546 8.37442e-05 -3.53947 63.546000 Cu 0.019026 0.357321 0.5 682 63.546 8.27911e-05 -3.53957 63.546000 Cu 0.168669 0.369853 0 713 63.546 0.00011203 -3.54055 63.546000 Cu 0.228983 0.349879 1 684 63.546 2.32271e-05 -3.54036 63.546000 Cu 0.299029 0.347393 0.5 690 63.546 6.96859e-05 -3.54031 63.546000 Cu 0.238709 0.36736 0.5 715 63.546 0.000174931 -3.54094 63.546000 Cu 0.308819 0.364849 1.219e-16 717 63.546 0.000137234 -3.54057 63.546000 Cu 0.318729 0.38227 0.5 720 63.546 0.000131095 -3.54053 63.546000 Cu 0.388933 0.379759 0 718 63.546 0.000143909 -3.53986 63.546000 Cu 0.378971 0.362333 0.5 719 63.546 4.6535e-05 -3.53994 63.546000 Cu 0.449039 0.359824 0 721 63.546 4.06079e-05 -3.53936 63.546000 Cu 0.459017 0.377272 0.5 723 63.546 0.000272109 -3.53934 63.546000 Cu 0.519026 0.357321 0.5 722 63.546 8.27911e-05 -3.53957 63.546000 Cu 0.528951 0.374802 0 666 63.546 0.000252034 -3.53908 63.546000 Cu 0.589003 0.354833 1.08195e-16 667 63.546 0.000102763 -3.53971 63.546000 Cu 0.65896 0.352359 0.5 669 63.546 2.77149e-05 -3.54013 63.546000 Cu 0.598778 0.372332 0.5 670 63.546 8.37442e-05 -3.53947 63.546000 Cu 0.668669 0.369853 1.21779e-16 668 63.546 0.00011203 -3.54055 63.546000 Cu 0.728983 0.349879 1.35364e-16 671 63.546 2.32271e-05 -3.54036 63.546000 Cu 0.808819 0.364849 0 672 63.546 0.000137234 -3.54057 63.546000 Cu 0.799029 0.347393 0.5 673 63.546 6.96859e-05 -3.54031 63.546000 Cu 0.738709 0.36736 0.5 674 63.546 0.000174931 -3.54094 63.546000 Cu 0.818729 0.38227 0.5 703 63.546 0.000131095 -3.54053 63.546000 Cu 0.949039 0.359824 1 676 63.546 4.06079e-05 -3.53936 63.546000 Cu 0.878971 0.362333 0.5 678 63.546 4.6535e-05 -3.53994 63.546000 Cu 0.888933 0.379759 1 705 63.546 0.000143909 -3.53986 63.546000 Cu 0.959017 0.377272 0.5 707 63.546 0.000272109 -3.53934 63.546000 Cu 0.108474 0.389867 0 710 63.546 0.000267462 -3.53932 63.546000 Cu 0.0387473 0.392323 0.5 712 63.546 0.00021751 -3.53897 63.546000 Cu 0.04844 0.40991 0 738 63.546 0.000658702 -3.54052 63.546000 Cu 0.118156 0.407411 0.5 740 63.546 0.00188239 -3.54031 63.546000 Cu 0.178355 0.387358 0.5 716 63.546 0.000706098 -3.54073 63.546000 Cu 0.188135 0.404818 1 742 63.546 0.00187778 -3.54014 63.546000 Cu 0.248468 0.384814 1 714 63.546 0.000529959 -3.54117 63.546000 Cu 0.268629 0.419525 2.40433e-19 743 63.546 0.0021571 -3.53671 63.546000 Cu 0.258425 0.402202 0.5 744 63.546 0.000441417 -3.53997 63.546000 Cu 0.198397 0.422201 0.5 745 63.546 0.00182252 -3.53884 63.546000 Cu 0.328771 0.399647 1 746 63.546 0.000431538 -3.53963 63.546000 Cu 0.338838 0.417005 0.5 749 63.546 0.00253482 -3.53671 63.546000 Cu 0.408887 0.414622 1 747 63.546 0.00208454 -3.5378 63.546000 Cu 0.398984 0.397179 0.5 748 63.546 0.000833723 -3.53943 63.546000 Cu 0.468958 0.39475 1 750 63.546 0.000721137 -3.53938 63.546000 Cu 0.478741 0.412293 0.5 751 63.546 0.000987236 -3.54 63.546000 Cu 0.54844 0.40991 1 695 63.546 0.000658702 -3.54052 63.546000 Cu 0.538747 0.392323 0.5 696 63.546 0.00021751 -3.53897 63.546000 Cu 0.608474 0.389867 0 697 63.546 0.000267462 -3.53932 63.546000 Cu 0.618156 0.407411 0.5 700 63.546 0.00188239 -3.54031 63.546000 Cu 0.688135 0.404818 0 698 63.546 0.00187778 -3.54014 63.546000 Cu 0.678355 0.387358 0.5 699 63.546 0.000706098 -3.54073 63.546000 Cu 0.748468 0.384814 1.2214e-16 701 63.546 0.000529959 -3.54117 63.546000 Cu 0.828771 0.399647 1 702 63.546 0.000431538 -3.53963 63.546000 Cu 0.758425 0.402202 0.5 704 63.546 0.000441417 -3.53997 63.546000 Cu 0.698397 0.422201 0.5 728 63.546 0.00182252 -3.53884 63.546000 Cu 0.768629 0.419525 1 730 63.546 0.0021571 -3.53671 63.546000 Cu 0.838838 0.417005 0.5 732 63.546 0.00253482 -3.53671 63.546000 Cu 0.968958 0.39475 0 706 63.546 0.000721137 -3.53938 63.546000 Cu 0.898984 0.397179 0.5 708 63.546 0.000833723 -3.53943 63.546000 Cu 0.908887 0.414622 1 734 63.546 0.00208454 -3.5378 63.546000 Cu 0.978741 0.412293 0.5 736 63.546 0.000987236 -3.54 63.546000 Cu 0.128195 0.424931 0 739 63.546 0.00535934 -3.54208 63.546000 Cu 0.0580784 0.427522 0.5 741 63.546 0.00686988 -3.54344 63.546000 Cu 0.0676647 0.444974 0 766 63.546 0.0192964 -3.54403 63.546000 Cu 0.150471 0.459376 2.40433e-19 767 63.546 0.0275162 -3.53808 63.546000 Cu 0.138991 0.442299 0.5 768 63.546 0.0108853 -3.54332 63.546000 Cu 0.209532 0.439539 3.81086e-17 770 63.546 0.00416705 -3.53572 63.546000 Cu 0.29061 0.454488 5.92668e-17 771 63.546 0.0398316 -3.52536 63.546000 Cu 0.279261 0.436888 0.5 772 63.546 0.0109034 -3.53123 63.546000 Cu 0.221663 0.456965 0.5 773 63.546 0.0362582 -3.53856 63.546000 Cu 0.348772 0.434423 1 774 63.546 0.01128 -3.53052 63.546000 Cu 0.426936 0.44983 1.22501e-16 775 63.546 0.0186703 -3.53438 63.546000 Cu 0.418269 0.432134 0.5 776 63.546 0.00350008 -3.53545 63.546000 Cu 0.358472 0.452153 0.5 777 63.546 0.0366766 -3.52349 63.546000 Cu 0.488078 0.429891 1 778 63.546 0.0021478 -3.54086 63.546000 Cu 0.496597 0.447485 0.5 779 63.546 0.0158302 -3.54103 63.546000 Cu 0.567665 0.444974 0 724 63.546 0.0192964 -3.54403 63.546000 Cu 0.558078 0.427522 0.5 725 63.546 0.00686988 -3.54344 63.546000 Cu 0.628195 0.424931 1 726 63.546 0.00535934 -3.54208 63.546000 Cu 0.638991 0.442299 0.5 729 63.546 0.0108853 -3.54332 63.546000 Cu 0.650471 0.459376 9.85776e-17 754 63.546 0.0275162 -3.53808 63.546000 Cu 0.709532 0.439539 1 727 63.546 0.00416705 -3.53572 63.546000 Cu 0.779261 0.436888 0.5 733 63.546 0.0109034 -3.53123 63.546000 Cu 0.721663 0.456965 0.5 756 63.546 0.0362582 -3.53856 63.546000 Cu 0.79061 0.454488 6.01083e-19 758 63.546 0.0398316 -3.52536 63.546000 Cu 0.848772 0.434423 1 731 63.546 0.01128 -3.53052 63.546000 Cu 0.988078 0.429891 1 735 63.546 0.0021478 -3.54086 63.546000 Cu 0.918269 0.432134 0.5 737 63.546 0.00350008 -3.53545 63.546000 Cu 0.858472 0.452153 0.5 760 63.546 0.0366766 -3.52349 63.546000 Cu 0.926936 0.44983 1 762 63.546 0.0186703 -3.53438 63.546000 Cu 0.996597 0.447485 0.5 764 63.546 0.0158302 -3.54103 63.546000 Cu 0.0771022 0.462043 0.5 769 63.546 0.0247048 -3.53709 63.546000 Cu 0.0875005 0.478565 2.40433e-19 789 63.546 0.0631131 -3.51747 63.546000 Cu 0.161153 0.476291 0.5 791 63.546 0.0641111 -3.53914 63.546000 Cu 0.0949978 0.494977 0.5 792 63.546 4.68353 -3.45934 63.546000 Cu 0.00471975 0.464944 3.6065e-19 763 63.546 0.0803023 -3.54057 63.546000 Cu 0.0126006 0.482103 0.5 788 63.546 1.08645 -3.45332 63.546000 Cu 0.0234024 0.498673 2.56181e-16 787 63.546 9.42821 -3.33351 63.546000 Cu 0.172494 0.49274 2.76498e-17 790 63.546 0.376036 -3.50112 63.546000 Cu 0.23412 0.474367 7.58567e-17 793 63.546 0.146986 -3.5211 63.546000 Cu 0.313407 0.49155 4.24364e-17 794 63.546 0.194681 -3.52031 63.546000 Cu 0.302932 0.472889 0.5 795 63.546 0.107496 -3.52647 63.546000 Cu 0.243505 0.492191 0.5 796 63.546 0.163442 -3.52624 63.546000 Cu 0.381406 0.490677 0.5 9 63.546 0.539287 -3.46984 63.546000 Cu 0.434735 0.467913 0.5 11 63.546 0.160459 -3.50629 63.546000 Cu 0.443498 0.486574 1.219e-16 394 63.546 1.21952 -3.40992 63.546000 Cu 0.368432 0.470592 8.89603e-18 400 63.546 0.0862771 -3.50472 63.546000 Cu 0.512601 0.482103 0.5 1 63.546 1.08645 -3.45332 63.546000 Cu 0.50472 0.464944 1.21779e-16 3 63.546 0.0803023 -3.54057 63.546000 Cu 0.587501 0.478565 2.43198e-16 752 63.546 0.0631131 -3.51747 63.546000 Cu 0.577102 0.462043 0.5 753 63.546 0.0247048 -3.53709 63.546000 Cu 0.661153 0.476291 0.5 757 63.546 0.0641111 -3.53914 63.546000 Cu 0.594998 0.494977 0.5 781 63.546 4.68353 -3.45934 63.546000 Cu 0.523402 0.498673 0 780 63.546 9.42821 -3.33351 63.546000 Cu 0.672494 0.49274 1.21419e-16 782 63.546 0.376036 -3.50112 63.546000 Cu 0.73412 0.474367 0 755 63.546 0.146986 -3.5211 63.546000 Cu 0.802932 0.472889 0.5 761 63.546 0.107496 -3.52647 63.546000 Cu 0.743505 0.492191 0.5 783 63.546 0.163442 -3.52624 63.546000 Cu 0.813407 0.49155 1.04588e-17 784 63.546 0.194681 -3.52031 63.546000 Cu 0.868432 0.470592 5.68624e-17 759 63.546 0.0862771 -3.50472 63.546000 Cu 0.934735 0.467913 0.5 765 63.546 0.160459 -3.50629 63.546000 Cu 0.881406 0.490677 0.5 785 63.546 0.539287 -3.46984 63.546000 Cu 0.943498 0.486574 1.26107e-16 786 63.546 1.21952 -3.40992 63.546000 Cu 0.108329 0.510078 2.43679e-16 2 63.546 6.4261 -3.21766 63.546000 Cu 0.0257242 0.521833 0 24 63.546 9.03626 -3.31371 63.546000 Cu 0.096797 0.525354 0.5 26 63.546 4.4003 -3.45952 63.546000 Cu 0.0140613 0.538164 0.5 27 63.546 0.865456 -3.45487 63.546000 Cu 0.247378 0.510017 1.07594e-16 4 63.546 0.171891 -3.5339 63.546000 Cu 0.176947 0.51004 0.5 5 63.546 0.493089 -3.50065 63.546000 Cu 0.173404 0.527364 0 28 63.546 0.338671 -3.50706 63.546000 Cu 0.244335 0.52782 0.5 30 63.546 0.16148 -3.5286 63.546000 Cu 0.319123 0.509958 0.5 7 63.546 0.405052 -3.52499 63.546000 Cu 0.314367 0.528342 2.444e-16 32 63.546 0.226859 -3.52057 63.546000 Cu 0.393572 0.509834 0 6 63.546 2.41083 -3.52183 63.546000 Cu 0.465017 0.510812 0.5 8 63.546 8.64374 -3.55139 63.546000 Cu 0.382078 0.529203 0.5 34 63.546 0.47263 -3.47305 63.546000 Cu 0.444347 0.533226 1.42817e-16 36 63.546 0.927316 -3.42972 63.546000 Cu 0.525724 0.521833 2.44641e-16 10 63.546 9.03626 -3.31371 63.546000 Cu 0.608329 0.510078 3.96234e-16 12 63.546 6.4261 -3.21766 63.546000 Cu 0.596797 0.525354 0.5 15 63.546 4.4003 -3.45952 63.546000 Cu 0.514061 0.538164 0.5 39 63.546 0.865456 -3.45487 63.546000 Cu 0.673404 0.527364 2.4416e-16 13 63.546 0.338671 -3.50706 63.546000 Cu 0.676947 0.51004 0.5 14 63.546 0.493089 -3.50065 63.546000 Cu 0.747378 0.510017 2.40433e-19 16 63.546 0.171891 -3.5339 63.546000 Cu 0.744335 0.52782 0.5 19 63.546 0.16148 -3.5286 63.546000 Cu 0.814367 0.528342 5.33762e-17 17 63.546 0.226859 -3.52057 63.546000 Cu 0.819123 0.509958 0.5 18 63.546 0.405052 -3.52499 63.546000 Cu 0.893572 0.509834 1.19615e-16 20 63.546 2.41083 -3.52183 63.546000 Cu 0.944347 0.533226 6.8283e-17 21 63.546 0.927316 -3.42972 63.546000 Cu 0.965017 0.510812 0.5 22 63.546 8.64374 -3.55139 63.546000 Cu 0.882078 0.529203 0.5 23 63.546 0.47263 -3.47305 63.546000 Cu 0.0894496 0.541771 1.2226e-16 25 63.546 0.0801301 -3.5142 63.546000 Cu 0.00618766 0.555181 1.2202e-16 52 63.546 0.10376 -3.53885 63.546000 Cu 0.0696912 0.575169 8.884e-17 53 63.546 0.0214179 -3.54372 63.546000 Cu 0.0790922 0.558191 0.5 54 63.546 0.0245245 -3.53582 63.546000 Cu 0.163067 0.543911 0.5 31 63.546 0.0718386 -3.53921 63.546000 Cu 0.152693 0.560843 1.78882e-16 56 63.546 0.03498 -3.53729 63.546000 Cu 0.235751 0.545698 2.0545e-16 29 63.546 0.153267 -3.52416 63.546000 Cu 0.304337 0.547104 0.5 35 63.546 0.107867 -3.52718 63.546000 Cu 0.223778 0.563189 0.5 58 63.546 0.0419442 -3.53827 63.546000 Cu 0.292564 0.565595 1.20217e-19 60 63.546 0.041908 -3.52596 63.546000 Cu 0.369773 0.549353 2.57384e-16 33 63.546 0.082423 -3.50202 63.546000 Cu 0.435919 0.552038 0.5 37 63.546 0.184987 -3.50985 63.546000 Cu 0.360278 0.56789 0.5 62 63.546 0.0374341 -3.52255 63.546000 Cu 0.42862 0.570197 1.21779e-16 64 63.546 0.0223653 -3.53346 63.546000 Cu 0.498335 0.572601 0.5 67 63.546 0.022757 -3.54086 63.546000 Cu 0.506188 0.555181 2.43919e-16 38 63.546 0.10376 -3.53885 63.546000 Cu 0.58945 0.541771 1.21299e-16 40 63.546 0.0801301 -3.5142 63.546000 Cu 0.579092 0.558191 0.5 43 63.546 0.0245245 -3.53582 63.546000 Cu 0.569691 0.575169 2.4416e-16 68 63.546 0.0214179 -3.54372 63.546000 Cu 0.652693 0.560843 1.2214e-16 41 63.546 0.03498 -3.53729 63.546000 Cu 0.663067 0.543911 0.5 42 63.546 0.0718386 -3.53921 63.546000 Cu 0.735751 0.545698 1.2238e-16 44 63.546 0.153267 -3.52416 63.546000 Cu 0.792564 0.565595 3.6065e-19 45 63.546 0.041908 -3.52596 63.546000 Cu 0.804337 0.547104 0.5 46 63.546 0.107867 -3.52718 63.546000 Cu 0.723778 0.563189 0.5 47 63.546 0.0419442 -3.53827 63.546000 Cu 0.998335 0.572601 0.5 55 63.546 0.022757 -3.54086 63.546000 Cu 0.869773 0.549353 1.35364e-16 48 63.546 0.082423 -3.50202 63.546000 Cu 0.92862 0.570197 0 49 63.546 0.0223653 -3.53346 63.546000 Cu 0.935919 0.552038 0.5 50 63.546 0.184987 -3.50985 63.546000 Cu 0.860278 0.56789 0.5 51 63.546 0.0374341 -3.52255 63.546000 Cu 0.141278 0.577881 0.5 59 63.546 0.0107812 -3.54296 63.546000 Cu 0.0507112 0.610151 1.2238e-16 81 63.546 0.0015494 -3.54072 63.546000 Cu 0.0602447 0.592564 0.5 82 63.546 0.009214 -3.54341 63.546000 Cu 0.130559 0.595196 5.2174e-17 84 63.546 0.00521836 -3.5419 63.546000 Cu 0.120507 0.612673 0.5 87 63.546 0.00227247 -3.5409 63.546000 Cu 0.211932 0.580637 1 57 63.546 0.00614177 -3.53489 63.546000 Cu 0.281591 0.583254 0.5 63 63.546 0.0126848 -3.53037 63.546000 Cu 0.19054 0.615313 1 85 63.546 0.00140038 -3.5403 63.546000 Cu 0.200862 0.597949 0.5 86 63.546 0.00113308 -3.53821 63.546000 Cu 0.271091 0.600634 2.40433e-19 88 63.546 0.00260155 -3.53578 63.546000 Cu 0.350943 0.585686 0 61 63.546 0.0126067 -3.52998 63.546000 Cu 0.420327 0.58794 0.5 65 63.546 0.00371044 -3.53513 63.546000 Cu 0.341196 0.60314 0.5 90 63.546 0.00363524 -3.53612 63.546000 Cu 0.411167 0.60549 0 92 63.546 0.0025061 -3.53789 63.546000 Cu 0.490123 0.59018 0 66 63.546 0.00344276 -3.54057 63.546000 Cu 0.480983 0.607782 0.5 95 63.546 0.00114249 -3.53978 63.546000 Cu 0.630559 0.595196 1 69 63.546 0.00521836 -3.5419 63.546000 Cu 0.641278 0.577881 0.5 70 63.546 0.0107812 -3.54296 63.546000 Cu 0.560245 0.592564 0.5 71 63.546 0.009214 -3.54341 63.546000 Cu 0.550711 0.610151 0 96 63.546 0.0015494 -3.54072 63.546000 Cu 0.620507 0.612673 0.5 98 63.546 0.00227247 -3.5409 63.546000 Cu 0.711932 0.580637 0 72 63.546 0.00614177 -3.53489 63.546000 Cu 0.771091 0.600634 0 73 63.546 0.00260155 -3.53578 63.546000 Cu 0.781591 0.583254 0.5 74 63.546 0.0126848 -3.53037 63.546000 Cu 0.700862 0.597949 0.5 75 63.546 0.00113308 -3.53821 63.546000 Cu 0.69054 0.615313 2.40433e-19 100 63.546 0.00140038 -3.5403 63.546000 Cu 0.990123 0.59018 8.77581e-17 80 63.546 0.00344276 -3.54057 63.546000 Cu 0.980983 0.607782 0.5 83 63.546 0.00114249 -3.53978 63.546000 Cu 0.850943 0.585686 1 76 63.546 0.0126067 -3.52998 63.546000 Cu 0.911167 0.60549 7.57364e-18 77 63.546 0.0025061 -3.53789 63.546000 Cu 0.920327 0.58794 0.5 78 63.546 0.00371044 -3.53513 63.546000 Cu 0.841196 0.60314 0.5 79 63.546 0.00363524 -3.53612 63.546000 Cu 0.031089 0.645288 0 109 63.546 0.000198474 -3.53935 63.546000 Cu 0.0409846 0.627741 0.5 110 63.546 0.000269627 -3.53943 63.546000 Cu 0.11071 0.630217 0 112 63.546 0.000455612 -3.54019 63.546000 Cu 0.100883 0.647753 0.5 115 63.546 0.000110032 -3.53979 63.546000 Cu 0.26082 0.617953 0.5 91 63.546 0.000363178 -3.53996 63.546000 Cu 0.170727 0.650245 2.27209e-17 113 63.546 0.000246953 -3.54 63.546000 Cu 0.180595 0.632757 0.5 114 63.546 0.000787654 -3.54059 63.546000 Cu 0.250712 0.635331 1.20217e-19 116 63.546 0.000398646 -3.54117 63.546000 Cu 0.240769 0.652756 0.5 119 63.546 0.000296854 -3.54065 63.546000 Cu 0.331149 0.620509 1 89 63.546 0.000789731 -3.53979 63.546000 Cu 0.321019 0.637888 0.5 118 63.546 0.00014401 -3.54084 63.546000 Cu 0.401336 0.622959 0.5 93 63.546 0.00131581 -3.53951 63.546000 Cu 0.471274 0.62534 1 94 63.546 0.000862538 -3.539 63.546000 Cu 0.391244 0.640388 1 120 63.546 0.00043045 -3.53974 63.546000 Cu 0.461259 0.642842 0.5 122 63.546 0.000421881 -3.53906 63.546000 Cu 0.61071 0.630217 2.40433e-19 97 63.546 0.000455612 -3.54019 63.546000 Cu 0.540985 0.627741 0.5 99 63.546 0.000269627 -3.53943 63.546000 Cu 0.531089 0.645288 2.40433e-19 124 63.546 0.000198474 -3.53935 63.546000 Cu 0.600883 0.647753 0.5 126 63.546 0.000110032 -3.53979 63.546000 Cu 0.750712 0.635331 2.40433e-19 101 63.546 0.000398646 -3.54117 63.546000 Cu 0.76082 0.617953 0.5 102 63.546 0.000363178 -3.53996 63.546000 Cu 0.680595 0.632757 0.5 103 63.546 0.000787654 -3.54059 63.546000 Cu 0.670727 0.650245 0 128 63.546 0.000246953 -3.54 63.546000 Cu 0.740769 0.652756 0.5 130 63.546 0.000296854 -3.54065 63.546000 Cu 0.831149 0.620509 1.2226e-16 104 63.546 0.000789731 -3.53979 63.546000 Cu 0.821019 0.637888 0.5 107 63.546 0.00014401 -3.54084 63.546000 Cu 0.891244 0.640388 6.67202e-17 105 63.546 0.00043045 -3.53974 63.546000 Cu 0.901336 0.622959 0.5 106 63.546 0.00131581 -3.53951 63.546000 Cu 0.971274 0.62534 1.5544e-16 108 63.546 0.000862538 -3.539 63.546000 Cu 0.961259 0.642842 0.5 111 63.546 0.000421881 -3.53906 63.546000 Cu 0.011038 0.680257 1.15167e-16 137 63.546 6.57495e-05 -3.53938 63.546000 Cu 0.021037 0.662787 0.5 138 63.546 9.25442e-05 -3.53956 63.546000 Cu 0.0909504 0.665256 0 140 63.546 8.36327e-05 -3.5395 63.546000 Cu 0.0810169 0.682719 0.5 143 63.546 8.68689e-06 -3.5394 63.546000 Cu 0.151014 0.685195 1.2202e-16 141 63.546 2.49046e-05 -3.53987 63.546000 Cu 0.160919 0.667727 0.5 142 63.546 3.17213e-05 -3.53977 63.546000 Cu 0.230912 0.670214 1.31517e-16 144 63.546 8.4395e-05 -3.54033 63.546000 Cu 0.290979 0.690196 0 145 63.546 1.20059e-05 -3.53995 63.546000 Cu 0.300933 0.672731 0.5 146 63.546 9.1322e-05 -3.54065 63.546000 Cu 0.220993 0.687689 0.5 147 63.546 1.94022e-05 -3.54008 63.546000 Cu 0.310962 0.655287 1 117 63.546 0.000128475 -3.54086 63.546000 Cu 0.451116 0.660314 6.01083e-19 121 63.546 0.000109872 -3.5397 63.546000 Cu 0.381117 0.657817 0.5 123 63.546 0.000133552 -3.54019 63.546000 Cu 0.370984 0.675262 0 148 63.546 4.30518e-05 -3.54015 63.546000 Cu 0.441014 0.677773 0.5 150 63.546 9.38806e-05 -3.53979 63.546000 Cu 0.59095 0.665256 4.48408e-17 125 63.546 8.36327e-05 -3.5395 63.546000 Cu 0.521037 0.662787 0.5 127 63.546 9.25442e-05 -3.53956 63.546000 Cu 0.511038 0.680257 7.81408e-18 152 63.546 6.57495e-05 -3.53938 63.546000 Cu 0.581017 0.682719 0.5 154 63.546 8.68689e-06 -3.5394 63.546000 Cu 0.660919 0.667727 0.5 131 63.546 3.17213e-05 -3.53977 63.546000 Cu 0.651014 0.685195 0 156 63.546 2.49046e-05 -3.53987 63.546000 Cu 0.730912 0.670214 1.09758e-16 129 63.546 8.4395e-05 -3.54033 63.546000 Cu 0.800933 0.672731 0.5 135 63.546 9.1322e-05 -3.54065 63.546000 Cu 0.720993 0.687689 0.5 158 63.546 1.94022e-05 -3.54008 63.546000 Cu 0.790979 0.690196 1.45462e-17 160 63.546 1.20059e-05 -3.53995 63.546000 Cu 0.810962 0.655287 0 132 63.546 0.000128475 -3.54086 63.546000 Cu 0.870984 0.675262 5.30155e-17 133 63.546 4.30518e-05 -3.54015 63.546000 Cu 0.881117 0.657817 0.5 134 63.546 0.000133552 -3.54019 63.546000 Cu 0.951116 0.660314 1.2214e-16 136 63.546 0.000109872 -3.5397 63.546000 Cu 0.941014 0.677773 0.5 139 63.546 9.38806e-05 -3.53979 63.546000 Cu 0.00107428 0.697702 0.5 166 63.546 4.50014e-05 -3.53962 63.546000 Cu 0.0710708 0.700183 0 168 63.546 4.65467e-05 -3.53966 63.546000 Cu 0.130976 0.720134 1.47746e-16 169 63.546 1.01526e-05 -3.54017 63.546000 Cu 0.141033 0.702664 0.5 170 63.546 2.40983e-05 -3.53991 63.546000 Cu 0.0610053 0.717647 0.5 171 63.546 1.44841e-05 -3.54005 63.546000 Cu 0.211001 0.705155 0 172 63.546 2.37802e-05 -3.53978 63.546000 Cu 0.27089 0.725113 1 173 63.546 2.55631e-05 -3.54012 63.546000 Cu 0.280997 0.707657 0.5 174 63.546 3.60486e-05 -3.53984 63.546000 Cu 0.200929 0.722622 0.5 175 63.546 6.76565e-06 -3.54001 63.546000 Cu 0.431014 0.695213 0 149 63.546 9.88449e-06 -3.53986 63.546000 Cu 0.360964 0.692707 0.5 151 63.546 2.44842e-05 -3.53972 63.546000 Cu 0.351002 0.710163 1.04949e-16 176 63.546 3.47533e-05 -3.53994 63.546000 Cu 0.410919 0.730122 1.2226e-16 177 63.546 8.07798e-06 -3.53994 63.546000 Cu 0.42101 0.712663 0.5 178 63.546 2.77744e-05 -3.5403 63.546000 Cu 0.340921 0.727616 0.5 179 63.546 9.42075e-06 -3.54013 63.546000 Cu 0.491028 0.715155 0 180 63.546 3.15997e-05 -3.54023 63.546000 Cu 0.571071 0.700183 0 153 63.546 4.65467e-05 -3.53966 63.546000 Cu 0.501074 0.697702 0.5 155 63.546 4.50014e-05 -3.53962 63.546000 Cu 0.641033 0.702664 0.5 159 63.546 2.40983e-05 -3.53991 63.546000 Cu 0.561005 0.717647 0.5 182 63.546 1.44841e-05 -3.54005 63.546000 Cu 0.630976 0.720134 1.2202e-16 184 63.546 1.01526e-05 -3.54017 63.546000 Cu 0.711001 0.705155 1.63495e-17 157 63.546 2.37802e-05 -3.53978 63.546000 Cu 0.780997 0.707657 0.5 163 63.546 3.60486e-05 -3.53984 63.546000 Cu 0.700929 0.722622 0.5 186 63.546 6.76565e-06 -3.54001 63.546000 Cu 0.77089 0.725113 8.34303e-17 188 63.546 2.55631e-05 -3.54012 63.546000 Cu 0.991028 0.715155 0 165 63.546 3.15997e-05 -3.54023 63.546000 Cu 0.851002 0.710163 0 161 63.546 3.47533e-05 -3.53994 63.546000 Cu 0.860964 0.692707 0.5 162 63.546 2.44842e-05 -3.53972 63.546000 Cu 0.931014 0.695213 3.23383e-17 164 63.546 9.88449e-06 -3.53986 63.546000 Cu 0.92101 0.712663 0.5 167 63.546 2.77744e-05 -3.5403 63.546000 Cu 0.840921 0.727616 0.5 190 63.546 9.42075e-06 -3.54013 63.546000 Cu 0.910919 0.730122 0 192 63.546 8.07798e-06 -3.53994 63.546000 Cu 0.0508859 0.735111 0 196 63.546 5.69638e-06 -3.54005 63.546000 Cu 0.110773 0.755066 1.28632e-17 197 63.546 2.90027e-05 -3.53972 63.546000 Cu 0.12086 0.737607 0.5 198 63.546 1.62839e-05 -3.54014 63.546000 Cu 0.0408166 0.752576 0.5 199 63.546 1.21698e-05 -3.53979 63.546000 Cu 0.190833 0.740094 0 200 63.546 1.29686e-05 -3.54014 63.546000 Cu 0.250779 0.760044 0 201 63.546 5.65161e-06 -3.53966 63.546000 Cu 0.260805 0.742581 0.5 202 63.546 1.88327e-05 -3.54003 63.546000 Cu 0.180794 0.757557 0.5 203 63.546 7.84234e-06 -3.53981 63.546000 Cu 0.330777 0.74507 0 204 63.546 6.31445e-05 -3.54026 63.546000 Cu 0.320771 0.762537 0.5 207 63.546 4.1339e-06 -3.54012 63.546000 Cu 0.390759 0.765032 0 205 63.546 1.233e-05 -3.54017 63.546000 Cu 0.400813 0.747572 0.5 206 63.546 1.31392e-05 -3.53988 63.546000 Cu 0.460752 0.767532 0.5 208 63.546 1.81525e-05 -3.54004 63.546000 Cu 0.470803 0.750076 0 209 63.546 1.09514e-05 -3.53984 63.546000 Cu 0.480912 0.732619 0.5 183 63.546 6.01809e-06 -3.54009 63.546000 Cu 0.550886 0.735111 2.444e-16 181 63.546 5.69638e-06 -3.54005 63.546000 Cu 0.62086 0.737607 0.5 187 63.546 1.62839e-05 -3.54014 63.546000 Cu 0.540817 0.752576 0.5 211 63.546 1.21698e-05 -3.53979 63.546000 Cu 0.610773 0.755066 1.36085e-16 212 63.546 2.90027e-05 -3.53972 63.546000 Cu 0.690833 0.740094 0 185 63.546 1.29686e-05 -3.54014 63.546000 Cu 0.760805 0.742581 0.5 191 63.546 1.88327e-05 -3.54003 63.546000 Cu 0.680794 0.757557 0.5 214 63.546 7.84234e-06 -3.53981 63.546000 Cu 0.750779 0.760044 0 216 63.546 5.65161e-06 -3.53966 63.546000 Cu 0.830777 0.74507 0 189 63.546 6.31445e-05 -3.54026 63.546000 Cu 0.820771 0.762537 0.5 218 63.546 4.1339e-06 -3.54012 63.546000 Cu 0.980912 0.732619 0.5 194 63.546 6.01809e-06 -3.54009 63.546000 Cu 0.970803 0.750076 0 193 63.546 1.09514e-05 -3.53984 63.546000 Cu 0.900813 0.747572 0.5 195 63.546 1.31392e-05 -3.53988 63.546000 Cu 0.890759 0.765032 3.6065e-19 220 63.546 1.233e-05 -3.54017 63.546000 Cu 0.960752 0.767532 0.5 222 63.546 1.81525e-05 -3.54004 63.546000 Cu 0.0307613 0.770033 1.20217e-19 224 63.546 1.39331e-05 -3.53987 63.546000 Cu 0.0908095 0.789984 5.6622e-17 225 63.546 3.17522e-06 -3.54021 63.546000 Cu 0.100773 0.772525 0.5 226 63.546 9.71217e-06 -3.53991 63.546000 Cu 0.0207739 0.787489 0.5 227 63.546 1.09009e-05 -3.54012 63.546000 Cu 0.0108384 0.804951 1 252 63.546 5.21327e-06 -3.53998 63.546000 Cu 0.0808642 0.807442 0.5 254 63.546 5.07437e-06 -3.54013 63.546000 Cu 0.16083 0.792476 0.5 231 63.546 4.80312e-06 -3.54007 63.546000 Cu 0.170783 0.775011 0 228 63.546 8.80685e-06 -3.53994 63.546000 Cu 0.230823 0.794962 1.20217e-19 229 63.546 9.51389e-06 -3.5398 63.546000 Cu 0.240784 0.777501 0.5 230 63.546 5.81146e-06 -3.53964 63.546000 Cu 0.300797 0.797454 0.5 235 63.546 2.60093e-05 -3.53991 63.546000 Cu 0.310782 0.779998 0 232 63.546 2.49943e-06 -3.53975 63.546000 Cu 0.370813 0.79996 0 233 63.546 5.21826e-06 -3.53997 63.546000 Cu 0.38077 0.782499 0.5 234 63.546 6.31316e-06 -3.54007 63.546000 Cu 0.450766 0.784998 0 236 63.546 9.40934e-06 -3.54017 63.546000 Cu 0.44082 0.80246 0.5 237 63.546 1.57501e-05 -3.53988 63.546000 Cu 0.530761 0.770033 1 210 63.546 1.39331e-05 -3.53987 63.546000 Cu 0.600773 0.772525 0.5 215 63.546 9.71217e-06 -3.53991 63.546000 Cu 0.510838 0.804951 1.20217e-19 238 63.546 5.21327e-06 -3.53998 63.546000 Cu 0.520774 0.787489 0.5 239 63.546 1.09009e-05 -3.54012 63.546000 Cu 0.59081 0.789984 1 240 63.546 3.17522e-06 -3.54021 63.546000 Cu 0.580864 0.807442 0.5 243 63.546 5.07437e-06 -3.54013 63.546000 Cu 0.66083 0.792476 0.5 242 63.546 4.80312e-06 -3.54007 63.546000 Cu 0.670783 0.775011 1 213 63.546 8.80685e-06 -3.53994 63.546000 Cu 0.740784 0.777501 0.5 219 63.546 5.81146e-06 -3.53964 63.546000 Cu 0.730823 0.794962 1 244 63.546 9.51389e-06 -3.5398 63.546000 Cu 0.800797 0.797454 0.5 246 63.546 2.60093e-05 -3.53991 63.546000 Cu 0.810782 0.779998 1.22741e-16 217 63.546 2.49943e-06 -3.53975 63.546000 Cu 0.950766 0.784998 1 221 63.546 9.40934e-06 -3.54017 63.546000 Cu 0.88077 0.782499 0.5 223 63.546 6.31316e-06 -3.54007 63.546000 Cu 0.870813 0.79996 6.01083e-19 248 63.546 5.21826e-06 -3.53997 63.546000 Cu 0.94082 0.80246 0.5 250 63.546 1.57501e-05 -3.53988 63.546000 Cu 0.0709612 0.824903 1.00982e-16 253 63.546 8.168e-06 -3.54016 63.546000 Cu 0.000938629 0.822408 0.5 255 63.546 5.95182e-06 -3.53982 63.546000 Cu 0.140964 0.827404 0.5 259 63.546 1.05648e-05 -3.54034 63.546000 Cu 0.0610548 0.842369 0.5 282 63.546 1.74336e-05 -3.53983 63.546000 Cu 0.131069 0.844878 1 284 63.546 5.74868e-05 -3.54039 63.546000 Cu 0.15091 0.809938 1.39331e-16 256 63.546 1.19692e-05 -3.53998 63.546000 Cu 0.210962 0.829905 1.95953e-17 257 63.546 3.51992e-05 -3.53995 63.546000 Cu 0.220893 0.812433 0.5 258 63.546 2.39902e-06 -3.53975 63.546000 Cu 0.290853 0.814926 2.40433e-19 260 63.546 2.21505e-05 -3.53989 63.546000 Cu 0.280964 0.832394 0.5 263 63.546 3.65273e-05 -3.53988 63.546000 Cu 0.350992 0.834872 6.91245e-17 261 63.546 3.79717e-05 -3.53989 63.546000 Cu 0.360851 0.817413 0.5 262 63.546 3.99729e-05 -3.53976 63.546000 Cu 0.430896 0.81991 7.80205e-17 264 63.546 3.69295e-06 -3.53958 63.546000 Cu 0.421 0.837359 0.5 265 63.546 5.43059e-05 -3.53964 63.546000 Cu 0.491025 0.839859 0 266 63.546 1.11454e-05 -3.53976 63.546000 Cu 0.500939 0.822408 0.5 267 63.546 5.95182e-06 -3.53982 63.546000 Cu 0.570961 0.824903 1 268 63.546 8.168e-06 -3.54016 63.546000 Cu 0.631069 0.844878 1 269 63.546 5.74868e-05 -3.54039 63.546000 Cu 0.640964 0.827404 0.5 270 63.546 1.05648e-05 -3.54034 63.546000 Cu 0.561055 0.842369 0.5 271 63.546 1.74336e-05 -3.53983 63.546000 Cu 0.65091 0.809938 1 241 63.546 1.19692e-05 -3.53998 63.546000 Cu 0.790853 0.814926 1 245 63.546 2.21505e-05 -3.53989 63.546000 Cu 0.720893 0.812433 0.5 247 63.546 2.39902e-06 -3.53975 63.546000 Cu 0.710962 0.829905 3.6065e-19 272 63.546 3.51992e-05 -3.53995 63.546000 Cu 0.780964 0.832394 0.5 274 63.546 3.65273e-05 -3.53988 63.546000 Cu 0.991025 0.839859 1.22741e-16 280 63.546 1.11454e-05 -3.53976 63.546000 Cu 0.930896 0.81991 6.01083e-19 249 63.546 3.69295e-06 -3.53958 63.546000 Cu 0.860851 0.817413 0.5 251 63.546 3.99729e-05 -3.53976 63.546000 Cu 0.850992 0.834872 3.6065e-19 276 63.546 3.79717e-05 -3.53989 63.546000 Cu 0.921 0.837359 0.5 278 63.546 5.43059e-05 -3.53964 63.546000 Cu 0.0510913 0.859817 8.41516e-19 281 63.546 4.47845e-05 -3.53939 63.546000 Cu 0.121178 0.862324 0.5 287 63.546 4.95735e-05 -3.53997 63.546000 Cu 0.0410974 0.877263 0.5 310 63.546 0.000330335 -3.5395 63.546000 Cu 0.111193 0.879747 1 312 63.546 0.000151926 -3.53984 63.546000 Cu 0.191338 0.864836 7.33321e-17 285 63.546 0.000159386 -3.54062 63.546000 Cu 0.201139 0.847377 0.5 286 63.546 4.43528e-05 -3.54034 63.546000 Cu 0.271171 0.849868 2.40433e-19 288 63.546 2.3585e-05 -3.54041 63.546000 Cu 0.261432 0.867351 0.5 291 63.546 0.000165111 -3.54107 63.546000 Cu 0.181388 0.882261 0.5 314 63.546 0.000149088 -3.54048 63.546000 Cu 0.331466 0.869852 1.02184e-16 289 63.546 0.00012956 -3.54056 63.546000 Cu 0.341199 0.852356 0.5 290 63.546 3.10383e-05 -3.54017 63.546000 Cu 0.411136 0.854831 5.48188e-17 292 63.546 9.58458e-05 -3.53947 63.546000 Cu 0.401342 0.872332 0.5 293 63.546 8.40259e-05 -3.53941 63.546000 Cu 0.471157 0.874801 1.14206e-17 294 63.546 0.000275966 -3.53924 63.546000 Cu 0.481098 0.857315 0.5 295 63.546 0.000115499 -3.53952 63.546000 Cu 0.551091 0.859817 2.40433e-19 296 63.546 4.47845e-05 -3.53939 63.546000 Cu 0.611193 0.879747 1.41856e-17 297 63.546 0.000151926 -3.53984 63.546000 Cu 0.621178 0.862324 0.5 298 63.546 4.95735e-05 -3.53997 63.546000 Cu 0.541097 0.877263 0.5 299 63.546 0.000330335 -3.5395 63.546000 Cu 0.771171 0.849868 2.40433e-19 273 63.546 2.3585e-05 -3.54041 63.546000 Cu 0.701139 0.847377 0.5 275 63.546 4.43528e-05 -3.54034 63.546000 Cu 0.691338 0.864836 4.7726e-17 300 63.546 0.000159386 -3.54062 63.546000 Cu 0.761432 0.867351 0.5 302 63.546 0.000165111 -3.54107 63.546000 Cu 0.681388 0.882261 0.5 303 63.546 0.000149088 -3.54048 63.546000 Cu 0.831466 0.869852 7.21299e-19 304 63.546 0.00012956 -3.54056 63.546000 Cu 0.981098 0.857315 0.5 283 63.546 0.000115499 -3.53952 63.546000 Cu 0.911136 0.854831 1.22501e-16 277 63.546 9.58458e-05 -3.53947 63.546000 Cu 0.841199 0.852356 0.5 279 63.546 3.10383e-05 -3.54017 63.546000 Cu 0.901342 0.872332 0.5 306 63.546 8.40259e-05 -3.53941 63.546000 Cu 0.971157 0.874801 8.85996e-17 308 63.546 0.000275966 -3.53924 63.546000 Cu 0.0311454 0.894746 1 309 63.546 0.00074687 -3.53939 63.546000 Cu 0.101104 0.89717 0.5 315 63.546 0.000902378 -3.5394 63.546000 Cu 0.0213492 0.912291 0.5 338 63.546 0.00104241 -3.53977 63.546000 Cu 0.0911902 0.914614 0 340 63.546 0.00220095 -3.5377 63.546000 Cu 0.161233 0.916994 0.5 342 63.546 0.00262912 -3.53671 63.546000 Cu 0.171309 0.899634 1 313 63.546 0.000502634 -3.53959 63.546000 Cu 0.251649 0.884809 1 316 63.546 0.000574794 -3.54116 63.546000 Cu 0.241666 0.902193 0.5 319 63.546 0.000454606 -3.53995 63.546000 Cu 0.231433 0.919516 1 344 63.546 0.00213319 -3.53666 63.546000 Cu 0.30168 0.922197 0.5 346 63.546 0.00174666 -3.5387 63.546000 Cu 0.311955 0.90482 1 317 63.546 0.00190579 -3.5401 63.546000 Cu 0.321755 0.887359 0.5 318 63.546 0.000748291 -3.54075 63.546000 Cu 0.391623 0.889874 1.06151e-16 320 63.546 0.000302073 -3.53954 63.546000 Cu 0.451674 0.909917 2.4404e-16 321 63.546 0.000733147 -3.54046 63.546000 Cu 0.461356 0.892327 0.5 322 63.546 0.000224901 -3.53913 63.546000 Cu 0.381948 0.907421 0.5 323 63.546 0.00211706 -3.54043 63.546000 Cu 0.531145 0.894746 2.444e-16 324 63.546 0.00074687 -3.53939 63.546000 Cu 0.59119 0.914614 8.66761e-17 325 63.546 0.00220095 -3.5377 63.546000 Cu 0.601104 0.89717 0.5 326 63.546 0.000902378 -3.5394 63.546000 Cu 0.521349 0.912291 0.5 327 63.546 0.00104241 -3.53977 63.546000 Cu 0.661233 0.916994 0.5 331 63.546 0.00262912 -3.53671 63.546000 Cu 0.751649 0.884809 1.22621e-16 301 63.546 0.000574794 -3.54116 63.546000 Cu 0.671309 0.899634 3.13765e-17 328 63.546 0.000502634 -3.53959 63.546000 Cu 0.731433 0.919516 4.96494e-17 329 63.546 0.00213319 -3.53666 63.546000 Cu 0.741666 0.902193 0.5 330 63.546 0.000454606 -3.53995 63.546000 Cu 0.80168 0.922197 0.5 335 63.546 0.00174666 -3.5387 63.546000 Cu 0.821755 0.887359 0.5 307 63.546 0.000748291 -3.54075 63.546000 Cu 0.811955 0.90482 6.01083e-19 332 63.546 0.00190579 -3.5401 63.546000 Cu 0.891623 0.889874 1 305 63.546 0.000302073 -3.53954 63.546000 Cu 0.961356 0.892327 0.5 311 63.546 0.000224901 -3.53913 63.546000 Cu 0.881948 0.907421 0.5 334 63.546 0.00211706 -3.54043 63.546000 Cu 0.951674 0.909917 1.22501e-16 336 63.546 0.000733147 -3.54046 63.546000 Cu 0.0120244 0.929893 2.40433e-19 337 63.546 0.00224428 -3.54067 63.546000 Cu 0.0818106 0.932129 0.5 343 63.546 0.00365301 -3.53529 63.546000 Cu 0.00353718 0.947491 0.5 366 63.546 0.0164435 -3.54098 63.546000 Cu 0.0731755 0.949828 1.1637e-16 368 63.546 0.01884 -3.5342 63.546000 Cu 0.141615 0.952148 0.5 370 63.546 0.0367116 -3.52361 63.546000 Cu 0.151292 0.934412 1.20217e-19 341 63.546 0.0115992 -3.53059 63.546000 Cu 0.29054 0.939529 3.6065e-19 345 63.546 0.0043215 -3.53566 63.546000 Cu 0.220816 0.936877 0.5 347 63.546 0.0111181 -3.53126 63.546000 Cu 0.209477 0.95448 2.40433e-19 372 63.546 0.0400218 -3.52541 63.546000 Cu 0.278433 0.95695 0.5 374 63.546 0.0365884 -3.53854 63.546000 Cu 0.371903 0.924935 5.0491e-17 348 63.546 0.0054815 -3.5421 63.546000 Cu 0.432455 0.944979 0 349 63.546 0.0196224 -3.54408 63.546000 Cu 0.442041 0.927531 0.5 350 63.546 0.00738139 -3.54339 63.546000 Cu 0.361104 0.942298 0.5 351 63.546 0.0108308 -3.54339 63.546000 Cu 0.349638 0.959369 1 376 63.546 0.0272022 -3.53818 63.546000 Cu 0.512024 0.929893 1.2214e-16 352 63.546 0.00224428 -3.54067 63.546000 Cu 0.573175 0.949828 1.93308e-16 353 63.546 0.01884 -3.5342 63.546000 Cu 0.581811 0.932129 0.5 354 63.546 0.00365301 -3.53529 63.546000 Cu 0.503537 0.947491 0.5 355 63.546 0.0164435 -3.54098 63.546000 Cu 0.641615 0.952148 0.5 359 63.546 0.0367116 -3.52361 63.546000 Cu 0.651292 0.934412 1.219e-16 356 63.546 0.0115992 -3.53059 63.546000 Cu 0.709477 0.95448 7.41736e-17 357 63.546 0.0400218 -3.52541 63.546000 Cu 0.720816 0.936877 0.5 358 63.546 0.0111181 -3.53126 63.546000 Cu 0.79054 0.939529 3.6065e-19 360 63.546 0.0043215 -3.53566 63.546000 Cu 0.778433 0.95695 0.5 363 63.546 0.0365884 -3.53854 63.546000 Cu 0.871903 0.924935 1.22861e-16 333 63.546 0.0054815 -3.5421 63.546000 Cu 0.942041 0.927531 0.5 339 63.546 0.00738139 -3.54339 63.546000 Cu 0.849638 0.959369 6.01083e-19 361 63.546 0.0272022 -3.53818 63.546000 Cu 0.861104 0.942298 0.5 362 63.546 0.0108308 -3.54339 63.546000 Cu 0.932455 0.944979 1 364 63.546 0.0196224 -3.54408 63.546000 Cu 0.131674 0.970593 2.64476e-18 369 63.546 0.0860504 -3.50472 63.546000 Cu 0.0653853 0.967917 0.5 371 63.546 0.160634 -3.506 63.546000 Cu 0.0565904 0.986578 4.43599e-17 395 63.546 1.23811 -3.40876 63.546000 Cu 0.118689 0.990679 0.5 396 63.546 0.544649 -3.46963 63.546000 Cu 0.265978 0.974349 7.21299e-19 373 63.546 0.148215 -3.52108 63.546000 Cu 0.197164 0.972881 0.5 375 63.546 0.107725 -3.52634 63.546000 Cu 0.1867 0.991544 1 397 63.546 0.192995 -3.5203 63.546000 Cu 0.25658 0.992181 0.5 398 63.546 0.163706 -3.52635 63.546000 Cu 0.327588 0.992723 8.76379e-17 399 63.546 0.379933 -3.50049 63.546000 Cu 0.40512 0.99497 0.5 436 63.546 4.69565 -3.45877 63.546000 Cu 0.476732 0.998679 3.23383e-17 401 63.546 9.44864 -3.33433 63.546000 Cu 0.412601 0.978567 4.80866e-19 377 63.546 0.0630536 -3.51741 63.546000 Cu 0.423022 0.962047 0.5 378 63.546 0.0247301 -3.53732 63.546000 Cu 0.338951 0.976283 0.5 379 63.546 0.0647213 -3.53914 63.546000 Cu 0.495419 0.964951 1.22501e-16 380 63.546 0.0813218 -3.54083 63.546000 Cu 0.487522 0.982112 0.5 383 63.546 1.10159 -3.45269 63.546000 Cu 0.55659 0.986578 1.03747e-16 381 63.546 1.23811 -3.40876 63.546000 Cu 0.565385 0.967917 0.5 382 63.546 0.160634 -3.506 63.546000 Cu 0.631674 0.970593 2.59668e-17 384 63.546 0.0860504 -3.50472 63.546000 Cu 0.618689 0.990679 0.5 387 63.546 0.544649 -3.46963 63.546000 Cu 0.6867 0.991544 1.01823e-16 385 63.546 0.192995 -3.5203 63.546000 Cu 0.697164 0.972881 0.5 386 63.546 0.107725 -3.52634 63.546000 Cu 0.765978 0.974349 3.97917e-17 388 63.546 0.148215 -3.52108 63.546000 Cu 0.75658 0.992181 0.5 391 63.546 0.163706 -3.52635 63.546000 Cu 0.827588 0.992723 1.21779e-16 389 63.546 0.379933 -3.50049 63.546000 Cu 0.976732 0.998679 1.22501e-16 408 63.546 9.44864 -3.33433 63.546000 Cu 0.90512 0.99497 0.5 409 63.546 4.69565 -3.45877 63.546000 Cu 0.995419 0.964951 9.61732e-19 365 63.546 0.0813218 -3.54083 63.546000 Cu 0.987522 0.982112 0.5 393 63.546 1.10159 -3.45269 63.546000 Cu 0.923022 0.962047 0.5 367 63.546 0.0247301 -3.53732 63.546000 Cu 0.838951 0.976283 0.5 390 63.546 0.0647213 -3.53914 63.546000 Cu 0.912601 0.978567 8.90805e-17 392 63.546 0.0630536 -3.51741