Number of particles = 850 A = 1 Angstrom (basic length-scale) H0(1,1) = 26.2922 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 105.9 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61836 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 0.0848347 0.0193471 4.49459e-17 443 63.546 2.69066 -3.41953 63.546000 Cu 0.0713325 0.0049701 0.5 444 63.546 8.13195 -3.38878 63.546000 Cu 0.0114328 0.0222769 0.5 445 63.546 0.873155 -3.4747 63.546000 Cu 0.152664 0.0161229 0.5 447 63.546 9.01378 -3.33982 63.546000 Cu 0.210696 0.0053972 2.42109e-17 446 63.546 8.72806 -3.4129 63.546000 Cu 0.280757 0.00500133 0.5 448 63.546 10.3278 -3.37932 63.546000 Cu 0.169434 0.0301347 1.19856e-19 467 63.546 0.397866 -3.47203 63.546000 Cu 0.236177 0.0252118 0.5 469 63.546 0.635108 -3.47163 63.546000 Cu 0.301294 0.0197401 1 471 63.546 2.34217 -3.41451 63.546000 Cu 0.38654 0.0308932 1 472 63.546 0.373876 -3.48422 63.546000 Cu 0.366301 0.0160502 0.5 473 63.546 9.06895 -3.33241 63.546000 Cu 0.428848 0.00516264 1 475 63.546 8.98203 -3.3824 63.546000 Cu 0.571333 0.0049701 1.51138e-16 425 63.546 8.13195 -3.38878 63.546000 Cu 0.511433 0.0222769 4.14701e-17 476 63.546 0.873155 -3.4747 63.546000 Cu 0.499508 0.0049142 0.5 477 63.546 4.30082 -3.48163 63.546000 Cu 0.450697 0.0253833 0.5 478 63.546 0.528515 -3.4552 63.546000 Cu 0.652664 0.0161229 1 426 63.546 9.01378 -3.33982 63.546000 Cu 0.584835 0.0193471 0.5 427 63.546 2.69066 -3.41953 63.546000 Cu 0.710696 0.0053972 0.5 429 63.546 8.72806 -3.4129 63.546000 Cu 0.669434 0.0301347 0.5 432 63.546 0.397866 -3.47203 63.546000 Cu 0.780757 0.00500133 1 428 63.546 10.3278 -3.37932 63.546000 Cu 0.736177 0.0252118 1 434 63.546 0.635108 -3.47163 63.546000 Cu 0.801294 0.0197401 0.5 436 63.546 2.34217 -3.41451 63.546000 Cu 0.866301 0.0160502 1 438 63.546 9.06895 -3.33241 63.546000 Cu 0.950697 0.0253833 2.25329e-16 439 63.546 0.528515 -3.4552 63.546000 Cu 0.928848 0.00516264 0.5 440 63.546 8.98203 -3.3824 63.546000 Cu 0.88654 0.0308932 0.5 441 63.546 0.373876 -3.48422 63.546000 Cu 0.999508 0.0049142 5.11784e-17 442 63.546 4.30082 -3.48163 63.546000 Cu 0.0976337 0.0355991 0.5 465 63.546 0.437379 -3.51136 63.546000 Cu 0.0326696 0.0388164 1.19856e-19 463 63.546 0.159519 -3.53346 63.546000 Cu 0.119105 0.0507872 1 464 63.546 0.0732832 -3.53246 63.546000 Cu 0.0509865 0.0558466 0.5 466 63.546 0.090631 -3.53279 63.546000 Cu 0.253716 0.0407352 0 468 63.546 0.155448 -3.53583 63.546000 Cu 0.185433 0.0463677 0.5 470 63.546 0.0667583 -3.53322 63.546000 Cu 0.204445 0.0622112 6.10066e-17 498 63.546 0.0180618 -3.53502 63.546000 Cu 0.270311 0.0575371 0.5 500 63.546 0.03472 -3.53679 63.546000 Cu 0.319572 0.0371055 0.5 474 63.546 0.26611 -3.53142 63.546000 Cu 0.338301 0.0524845 1 502 63.546 0.0502423 -3.53028 63.546000 Cu 0.42099 0.0646536 2.39711e-19 503 63.546 0.00851623 -3.53921 63.546000 Cu 0.404555 0.0478245 0.5 504 63.546 0.0727612 -3.52369 63.546000 Cu 0.467831 0.0433802 1 506 63.546 0.0546554 -3.53164 63.546000 Cu 0.550986 0.0558466 3.75148e-17 507 63.546 0.090631 -3.53279 63.546000 Cu 0.53267 0.0388164 0.5 508 63.546 0.159519 -3.53346 63.546000 Cu 0.48675 0.0601003 0.5 509 63.546 0.018471 -3.54021 63.546000 Cu 0.597634 0.0355991 1.4982e-17 430 63.546 0.437379 -3.51136 63.546000 Cu 0.685433 0.0463677 1.19856e-19 431 63.546 0.0667583 -3.53322 63.546000 Cu 0.619105 0.0507872 0.5 433 63.546 0.0732832 -3.53246 63.546000 Cu 0.704445 0.0622112 0.5 453 63.546 0.0180618 -3.53502 63.546000 Cu 0.819572 0.0371055 3.71553e-17 435 63.546 0.26611 -3.53142 63.546000 Cu 0.753716 0.0407352 0.5 437 63.546 0.155448 -3.53583 63.546000 Cu 0.770311 0.0575371 0 455 63.546 0.03472 -3.53679 63.546000 Cu 0.838301 0.0524845 0.5 457 63.546 0.0502423 -3.53028 63.546000 Cu 0.904555 0.0478245 1.10507e-16 459 63.546 0.0727612 -3.52369 63.546000 Cu 0.98675 0.0601003 1 460 63.546 0.018471 -3.54021 63.546000 Cu 0.967831 0.0433802 0.5 461 63.546 0.0546554 -3.53164 63.546000 Cu 0.92099 0.0646536 0.5 462 63.546 0.00851623 -3.53921 63.546000 Cu 0.136903 0.0671669 0.5 496 63.546 0.0118268 -3.53779 63.546000 Cu 0.0230954 0.0928748 1.08829e-16 491 63.546 0.00285742 -3.53962 63.546000 Cu 0.0710463 0.071797 2.39711e-19 494 63.546 0.0134135 -3.53999 63.546000 Cu 0.0892436 0.0881866 0.5 497 63.546 0.00269476 -3.53925 63.546000 Cu 0.0043302 0.0767539 0.5 492 63.546 0.025558 -3.53956 63.546000 Cu 0.155957 0.0832708 1 495 63.546 0.00552891 -3.53918 63.546000 Cu 0.222078 0.078618 0.5 501 63.546 0.00608016 -3.53877 63.546000 Cu 0.174003 0.0996599 0.5 528 63.546 0.000945949 -3.53937 63.546000 Cu 0.240584 0.0948397 9.01315e-17 530 63.546 0.00372717 -3.53834 63.546000 Cu 0.289144 0.0736198 4.44665e-17 499 63.546 0.0174347 -3.5376 63.546000 Cu 0.355342 0.0690448 0.5 505 63.546 0.00720945 -3.53647 63.546000 Cu 0.306652 0.0901426 0.5 532 63.546 0.00375624 -3.53869 63.546000 Cu 0.372718 0.0856557 1 534 63.546 0.00103238 -3.5396 63.546000 Cu 0.571046 0.071797 0.5 450 63.546 0.0134135 -3.53999 63.546000 Cu 0.456503 0.0976276 3.59567e-19 535 63.546 0.00683604 -3.53983 63.546000 Cu 0.438726 0.0811181 0.5 536 63.546 0.00278441 -3.5402 63.546000 Cu 0.50433 0.0767539 2.39711e-19 538 63.546 0.025558 -3.53956 63.546000 Cu 0.523095 0.0928748 0.5 539 63.546 0.00285742 -3.53962 63.546000 Cu 0.636903 0.0671669 1.94286e-16 451 63.546 0.0118268 -3.53779 63.546000 Cu 0.589244 0.0881866 1.76428e-16 449 63.546 0.00269476 -3.53925 63.546000 Cu 0.655957 0.0832708 0.5 454 63.546 0.00552891 -3.53918 63.546000 Cu 0.674003 0.0996599 7.43106e-18 482 63.546 0.000945949 -3.53937 63.546000 Cu 0.722078 0.078618 1 452 63.546 0.00608016 -3.53877 63.546000 Cu 0.855342 0.0690448 1.01758e-16 456 63.546 0.00720945 -3.53647 63.546000 Cu 0.789144 0.0736198 0.5 458 63.546 0.0174347 -3.5376 63.546000 Cu 0.740584 0.0948397 0.5 484 63.546 0.00372717 -3.53834 63.546000 Cu 0.806652 0.0901426 1.19856e-19 486 63.546 0.00375624 -3.53869 63.546000 Cu 0.872718 0.0856557 0.5 488 63.546 0.00103238 -3.5396 63.546000 Cu 0.938726 0.0811181 1.72233e-16 490 63.546 0.00278441 -3.5402 63.546000 Cu 0.956503 0.0976276 0.5 493 63.546 0.00683604 -3.53983 63.546000 Cu 0.0595089 0.125452 3.59567e-19 523 63.546 0.000356644 -3.53936 63.546000 Cu 0.0412034 0.109208 0.5 524 63.546 0.000978962 -3.53931 63.546000 Cu 0.107784 0.104388 1.61685e-16 526 63.546 0.00124127 -3.53931 63.546000 Cu 0.125874 0.120736 0.5 529 63.546 0.000307822 -3.53933 63.546000 Cu 0.1923 0.115969 9.04911e-17 527 63.546 0.00128556 -3.53911 63.546000 Cu 0.258456 0.111287 0.5 533 63.546 0.000809913 -3.53909 63.546000 Cu 0.210235 0.132383 0.5 559 63.546 0.000420374 -3.53933 63.546000 Cu 0.276374 0.127753 0 561 63.546 5.7778e-05 -3.53958 63.546000 Cu 0.324483 0.106678 4.79423e-19 531 63.546 0.000301489 -3.53967 63.546000 Cu 0.390513 0.102097 0.5 537 63.546 0.000939098 -3.54012 63.546000 Cu 0.342451 0.123122 0.5 563 63.546 0.000263526 -3.53994 63.546000 Cu 0.408484 0.118559 1.06672e-17 565 63.546 0.00203147 -3.53995 63.546000 Cu 0.559509 0.125452 0.5 481 63.546 0.000356644 -3.53936 63.546000 Cu 0.493008 0.130203 1 566 63.546 0.000313952 -3.53955 63.546000 Cu 0.474858 0.113861 0.5 567 63.546 0.000784336 -3.5398 63.546000 Cu 0.541203 0.109208 1 569 63.546 0.000978962 -3.53931 63.546000 Cu 0.625874 0.120736 1.68757e-16 479 63.546 0.000307822 -3.53933 63.546000 Cu 0.607784 0.104388 0.5 480 63.546 0.00124127 -3.53931 63.546000 Cu 0.6923 0.115969 0.5 485 63.546 0.00128556 -3.53911 63.546000 Cu 0.710235 0.132383 1.26328e-16 514 63.546 0.000420374 -3.53933 63.546000 Cu 0.758456 0.111287 1 483 63.546 0.000809913 -3.53909 63.546000 Cu 0.824483 0.106678 0.5 489 63.546 0.000301489 -3.53967 63.546000 Cu 0.776374 0.127753 0.5 516 63.546 5.7778e-05 -3.53958 63.546000 Cu 0.842451 0.123122 1 518 63.546 0.000263526 -3.53994 63.546000 Cu 0.890513 0.102097 1 487 63.546 0.000939098 -3.54012 63.546000 Cu 0.908484 0.118559 0.5 520 63.546 0.00203147 -3.53995 63.546000 Cu 0.974858 0.113861 1.19856e-19 522 63.546 0.000784336 -3.5398 63.546000 Cu 0.993008 0.130203 0.5 525 63.546 0.000313952 -3.53955 63.546000 Cu 0.0112645 0.146506 1 553 63.546 9.9973e-05 -3.53953 63.546000 Cu 0.0956894 0.158152 1 554 63.546 0.00018429 -3.5394 63.546000 Cu 0.0776008 0.141794 0.5 555 63.546 0.00014035 -3.53939 63.546000 Cu 0.0293945 0.162861 0.5 556 63.546 5.63782e-05 -3.53952 63.546000 Cu 0.143987 0.137074 2.39711e-19 557 63.546 0.000417346 -3.53925 63.546000 Cu 0.22813 0.14882 5.99279e-17 558 63.546 4.35601e-05 -3.53956 63.546000 Cu 0.161967 0.153473 0.5 560 63.546 0.000157727 -3.53941 63.546000 Cu 0.246128 0.16524 0.5 590 63.546 5.77063e-05 -3.53967 63.546000 Cu 0.360453 0.139557 1 562 63.546 0.000566651 -3.53984 63.546000 Cu 0.294318 0.144181 0.5 564 63.546 8.88906e-05 -3.5397 63.546000 Cu 0.426737 0.134874 0.5 568 63.546 0.000265798 -3.53982 63.546000 Cu 0.312327 0.160601 4.14701e-17 592 63.546 0.000297923 -3.53974 63.546000 Cu 0.378619 0.15592 0.5 594 63.546 0.000141873 -3.53971 63.546000 Cu 0.444888 0.151228 2.93647e-17 596 63.546 7.89535e-05 -3.53963 63.546000 Cu 0.529395 0.162861 3.78744e-17 597 63.546 5.63782e-05 -3.53952 63.546000 Cu 0.511264 0.146506 0.5 598 63.546 9.9973e-05 -3.53953 63.546000 Cu 0.577601 0.141794 1 510 63.546 0.00014035 -3.53939 63.546000 Cu 0.661967 0.153473 4.79423e-19 511 63.546 0.000157727 -3.53941 63.546000 Cu 0.643987 0.137074 0.5 512 63.546 0.000417346 -3.53925 63.546000 Cu 0.595689 0.158152 0.5 513 63.546 0.00018429 -3.5394 63.546000 Cu 0.794318 0.144181 1.92608e-16 515 63.546 8.88906e-05 -3.5397 63.546000 Cu 0.72813 0.14882 0.5 517 63.546 4.35601e-05 -3.53956 63.546000 Cu 0.746128 0.16524 1.19856e-19 545 63.546 5.77063e-05 -3.53967 63.546000 Cu 0.812327 0.160601 0.5 547 63.546 0.000297923 -3.53974 63.546000 Cu 0.860453 0.139557 0.5 521 63.546 0.000566651 -3.53984 63.546000 Cu 0.926737 0.134874 1 519 63.546 0.000265798 -3.53982 63.546000 Cu 0.878619 0.15592 1 549 63.546 0.000141873 -3.53971 63.546000 Cu 0.944888 0.151228 0.5 551 63.546 7.89535e-05 -3.53963 63.546000 Cu 0.0475212 0.179228 1 584 63.546 7.17128e-05 -3.53953 63.546000 Cu 0.131804 0.190951 3.72751e-17 585 63.546 6.49311e-06 -3.53963 63.546000 Cu 0.113744 0.174547 0.5 586 63.546 7.24057e-05 -3.53952 63.546000 Cu 0.0655873 0.195617 0.5 587 63.546 2.94811e-05 -3.53956 63.546000 Cu 0.179934 0.169891 0 588 63.546 2.05881e-05 -3.53959 63.546000 Cu 0.264187 0.181638 0 589 63.546 0.000103225 -3.53978 63.546000 Cu 0.197992 0.186296 0.5 591 63.546 3.21145e-05 -3.53967 63.546000 Cu 0.28234 0.198006 0.5 622 63.546 2.36777e-05 -3.5397 63.546000 Cu 0.39676 0.172277 4.14701e-17 593 63.546 3.76372e-05 -3.53964 63.546000 Cu 0.330436 0.176963 0.5 595 63.546 9.4529e-05 -3.53973 63.546000 Cu 0.348599 0.193323 1 624 63.546 2.48447e-05 -3.53962 63.546000 Cu 0.414914 0.188617 0.5 626 63.546 3.93492e-05 -3.53954 63.546000 Cu 0.565587 0.195617 0 540 63.546 2.94811e-05 -3.53956 63.546000 Cu 0.463107 0.167561 0.5 599 63.546 5.0062e-05 -3.53959 63.546000 Cu 0.481237 0.183922 2.19336e-17 628 63.546 4.73453e-05 -3.53954 63.546000 Cu 0.547521 0.179228 0.5 629 63.546 7.17128e-05 -3.53953 63.546000 Cu 0.613744 0.174547 8.31799e-17 541 63.546 7.24057e-05 -3.53952 63.546000 Cu 0.697992 0.186296 1.45984e-16 542 63.546 3.21145e-05 -3.53967 63.546000 Cu 0.679934 0.169891 0.5 543 63.546 2.05881e-05 -3.53959 63.546000 Cu 0.631804 0.190951 0.5 544 63.546 6.49311e-06 -3.53963 63.546000 Cu 0.830436 0.176963 3.59567e-19 546 63.546 9.4529e-05 -3.53973 63.546000 Cu 0.764187 0.181638 0.5 548 63.546 0.000103225 -3.53978 63.546000 Cu 0.78234 0.198006 4.79423e-19 576 63.546 2.36777e-05 -3.5397 63.546000 Cu 0.848599 0.193323 0.5 578 63.546 2.48447e-05 -3.53962 63.546000 Cu 0.963107 0.167561 1 550 63.546 5.0062e-05 -3.53959 63.546000 Cu 0.89676 0.172277 0.5 552 63.546 3.76372e-05 -3.53964 63.546000 Cu 0.914914 0.188617 4.8182e-17 580 63.546 3.93492e-05 -3.53954 63.546000 Cu 0.981237 0.183922 0.5 582 63.546 4.73453e-05 -3.53954 63.546000 Cu 0.0174193 0.216689 0.5 614 63.546 1.56403e-05 -3.53955 63.546000 Cu 0.0836414 0.212013 1.19856e-19 616 63.546 1.11969e-05 -3.53961 63.546000 Cu 0.10169 0.228412 0.5 619 63.546 8.76453e-06 -3.53964 63.546000 Cu 0.0354641 0.233086 4.59047e-17 613 63.546 5.52291e-06 -3.53962 63.546000 Cu 0.167928 0.223748 9.22889e-18 617 63.546 3.79264e-05 -3.53967 63.546000 Cu 0.149844 0.207355 0.5 618 63.546 2.24698e-05 -3.53965 63.546000 Cu 0.216092 0.202685 3.17618e-17 620 63.546 2.77814e-05 -3.53967 63.546000 Cu 0.234174 0.219065 0.5 623 63.546 1.48907e-05 -3.53963 63.546000 Cu 0.300476 0.214386 6.11264e-17 621 63.546 3.19321e-05 -3.53962 63.546000 Cu 0.36676 0.209687 0.5 627 63.546 5.71322e-06 -3.53956 63.546000 Cu 0.318564 0.230753 0.5 653 63.546 1.54983e-05 -3.53957 63.546000 Cu 0.384886 0.226057 0 655 63.546 1.71222e-05 -3.53957 63.546000 Cu 0.433068 0.204993 1.47542e-16 625 63.546 2.53559e-05 -3.53952 63.546000 Cu 0.499354 0.200294 0.5 630 63.546 6.96917e-05 -3.53956 63.546000 Cu 0.451156 0.221367 0.5 657 63.546 3.29931e-05 -3.53958 63.546000 Cu 0.517419 0.216689 1 659 63.546 1.56403e-05 -3.53955 63.546000 Cu 0.535464 0.233086 0.5 660 63.546 5.52291e-06 -3.53962 63.546000 Cu 0.60169 0.228412 2.54574e-16 570 63.546 8.76453e-06 -3.53964 63.546000 Cu 0.583641 0.212013 0.5 571 63.546 1.11969e-05 -3.53961 63.546000 Cu 0.649844 0.207355 9.4686e-17 572 63.546 2.24698e-05 -3.53965 63.546000 Cu 0.667928 0.223748 0.5 575 63.546 3.79264e-05 -3.53967 63.546000 Cu 0.716092 0.202685 0.5 574 63.546 2.77814e-05 -3.53967 63.546000 Cu 0.734174 0.219065 9.4686e-17 573 63.546 1.48907e-05 -3.53963 63.546000 Cu 0.800476 0.214386 0.5 579 63.546 3.19321e-05 -3.53962 63.546000 Cu 0.818564 0.230753 7.2273e-17 608 63.546 1.54983e-05 -3.53957 63.546000 Cu 0.86676 0.209687 1 577 63.546 5.71322e-06 -3.53956 63.546000 Cu 0.999354 0.200294 1 581 63.546 6.96917e-05 -3.53956 63.546000 Cu 0.933068 0.204993 0.5 583 63.546 2.53559e-05 -3.53952 63.546000 Cu 0.884886 0.226057 0.5 610 63.546 1.71222e-05 -3.53957 63.546000 Cu 0.951156 0.221367 1.61086e-16 612 63.546 3.29931e-05 -3.53958 63.546000 Cu 0.0716238 0.265865 1.03555e-16 644 63.546 6.67547e-06 -3.53959 63.546000 Cu 0.0535338 0.249475 0.5 645 63.546 3.60972e-06 -3.53962 63.546000 Cu 0.119771 0.2448 2.45704e-17 647 63.546 5.56616e-06 -3.53966 63.546000 Cu 0.137855 0.26119 0.5 650 63.546 2.3109e-05 -3.53957 63.546000 Cu 0.204136 0.256505 3.59567e-19 648 63.546 1.39832e-05 -3.53959 63.546000 Cu 0.185999 0.240125 0.5 649 63.546 2.36135e-05 -3.53961 63.546000 Cu 0.252288 0.235441 1.19856e-19 651 63.546 9.76264e-06 -3.53962 63.546000 Cu 0.270395 0.25182 0.5 654 63.546 3.9271e-05 -3.53958 63.546000 Cu 0.336734 0.247122 1.68158e-16 652 63.546 1.96571e-05 -3.53956 63.546000 Cu 0.402996 0.242436 0.5 658 63.546 1.88501e-05 -3.53963 63.546000 Cu 0.354859 0.263492 0.5 685 63.546 3.31382e-05 -3.53965 63.546000 Cu 0.421119 0.258817 2.39711e-19 687 63.546 2.07137e-05 -3.53964 63.546000 Cu 0.553534 0.249475 1.19856e-19 600 63.546 3.60972e-06 -3.53962 63.546000 Cu 0.469236 0.237755 1 656 63.546 1.445e-05 -3.5396 63.546000 Cu 0.487322 0.254145 0.5 689 63.546 2.62443e-06 -3.53969 63.546000 Cu 0.637855 0.26119 1.19856e-19 601 63.546 2.3109e-05 -3.53957 63.546000 Cu 0.619771 0.2448 0.5 602 63.546 5.56616e-06 -3.53966 63.546000 Cu 0.571624 0.265865 0.5 603 63.546 6.67547e-06 -3.53959 63.546000 Cu 0.685999 0.240125 3.04434e-17 604 63.546 2.36135e-05 -3.53961 63.546000 Cu 0.704136 0.256505 0.5 607 63.546 1.39832e-05 -3.53959 63.546000 Cu 0.770395 0.25182 1 605 63.546 3.9271e-05 -3.53958 63.546000 Cu 0.752288 0.235441 0.5 606 63.546 9.76264e-06 -3.53962 63.546000 Cu 0.836734 0.247122 0.5 611 63.546 1.96571e-05 -3.53956 63.546000 Cu 0.854859 0.263492 1 639 63.546 3.31382e-05 -3.53965 63.546000 Cu 0.902996 0.242436 4.14701e-17 609 63.546 1.88501e-05 -3.53963 63.546000 Cu 0.969236 0.237755 0.5 615 63.546 1.445e-05 -3.5396 63.546000 Cu 0.921119 0.258817 0.5 641 63.546 2.07137e-05 -3.53964 63.546000 Cu 0.987322 0.254145 1.15062e-17 643 63.546 2.62443e-06 -3.53969 63.546000 Cu 0.0054074 0.270535 0.5 646 63.546 5.63433e-06 -3.53964 63.546000 Cu 0.023458 0.286934 2.13343e-17 675 63.546 3.02712e-05 -3.53958 63.546000 Cu 0.107775 0.298635 0 676 63.546 8.54258e-05 -3.53957 63.546000 Cu 0.0896804 0.282253 0.5 677 63.546 3.65869e-05 -3.53955 63.546000 Cu 0.155972 0.277572 7.82658e-17 679 63.546 3.63484e-05 -3.53956 63.546000 Cu 0.240427 0.28924 1.19856e-19 680 63.546 1.41829e-05 -3.53961 63.546000 Cu 0.222261 0.272876 0.5 681 63.546 1.11822e-05 -3.53959 63.546000 Cu 0.174092 0.293937 0.5 682 63.546 2.50483e-05 -3.53956 63.546000 Cu 0.288588 0.268186 1.22373e-16 683 63.546 1.8874e-05 -3.53961 63.546000 Cu 0.372968 0.279872 1 684 63.546 2.55218e-05 -3.53965 63.546000 Cu 0.306703 0.284546 0.5 686 63.546 3.93183e-05 -3.53967 63.546000 Cu 0.391036 0.296255 0.5 716 63.546 2.94517e-05 -3.53972 63.546000 Cu 0.505407 0.270535 2.05553e-16 688 63.546 5.63433e-06 -3.53964 63.546000 Cu 0.439206 0.2752 0.5 690 63.546 2.4254e-05 -3.53968 63.546000 Cu 0.457245 0.291592 1.20815e-16 718 63.546 3.88435e-06 -3.53962 63.546000 Cu 0.523458 0.286934 0.5 720 63.546 3.02712e-05 -3.53958 63.546000 Cu 0.58968 0.282253 6.52015e-17 631 63.546 3.65869e-05 -3.53955 63.546000 Cu 0.674092 0.293937 2.04714e-16 632 63.546 2.50483e-05 -3.53956 63.546000 Cu 0.655972 0.277572 0.5 633 63.546 3.63484e-05 -3.53956 63.546000 Cu 0.607775 0.298635 0.5 634 63.546 8.54258e-05 -3.53957 63.546000 Cu 0.722261 0.272876 7.07149e-18 635 63.546 1.11822e-05 -3.53959 63.546000 Cu 0.806703 0.284546 1.20335e-16 636 63.546 3.93183e-05 -3.53967 63.546000 Cu 0.788588 0.268186 0.5 637 63.546 1.8874e-05 -3.53961 63.546000 Cu 0.740427 0.28924 0.5 638 63.546 1.41829e-05 -3.53961 63.546000 Cu 0.939206 0.2752 2.01957e-16 640 63.546 2.4254e-05 -3.53968 63.546000 Cu 0.872968 0.279872 0.5 642 63.546 2.55218e-05 -3.53965 63.546000 Cu 0.891036 0.296255 8.3899e-18 671 63.546 2.94517e-05 -3.53972 63.546000 Cu 0.957245 0.291592 0.5 673 63.546 3.88435e-06 -3.53962 63.546000 Cu 0.0415102 0.303321 0.5 678 63.546 8.2644e-05 -3.53953 63.546000 Cu 0.0596345 0.319688 3.52376e-17 706 63.546 6.92745e-05 -3.53952 63.546000 Cu 0.12593 0.314986 0.5 708 63.546 2.23592e-05 -3.53962 63.546000 Cu 0.144112 0.331327 1.01158e-16 707 63.546 2.07474e-05 -3.53966 63.546000 Cu 0.192257 0.310288 1.71154e-16 710 63.546 1.08791e-05 -3.53961 63.546000 Cu 0.276721 0.321947 1.19856e-19 711 63.546 0.000132836 -3.53975 63.546000 Cu 0.258583 0.305589 0.5 712 63.546 6.64002e-05 -3.5397 63.546000 Cu 0.210431 0.326619 0.5 713 63.546 0.000126186 -3.5397 63.546000 Cu 0.324834 0.300921 2.39711e-19 714 63.546 4.79288e-05 -3.53974 63.546000 Cu 0.409107 0.312648 7.28723e-17 715 63.546 1.10239e-05 -3.53967 63.546000 Cu 0.342955 0.317287 0.5 717 63.546 0.00013271 -3.53978 63.546000 Cu 0.427165 0.32905 0.5 748 63.546 5.27236e-05 -3.53964 63.546000 Cu 0.559634 0.319688 0.5 662 63.546 6.92745e-05 -3.53952 63.546000 Cu 0.54151 0.303321 6.79582e-17 719 63.546 8.2644e-05 -3.53953 63.546000 Cu 0.475292 0.307995 0.5 721 63.546 4.6298e-05 -3.53959 63.546000 Cu 0.493354 0.324385 1 750 63.546 0.000174946 -3.53952 63.546000 Cu 0.62593 0.314986 1.19856e-19 663 63.546 2.23592e-05 -3.53962 63.546000 Cu 0.710431 0.326619 2.39711e-19 664 63.546 0.000126186 -3.5397 63.546000 Cu 0.692257 0.310288 0.5 665 63.546 1.08791e-05 -3.53961 63.546000 Cu 0.644112 0.331327 0.5 666 63.546 2.07474e-05 -3.53966 63.546000 Cu 0.758583 0.305589 7.3951e-17 667 63.546 6.64002e-05 -3.5397 63.546000 Cu 0.842955 0.317287 4.14701e-17 668 63.546 0.00013271 -3.53978 63.546000 Cu 0.824834 0.300921 0.5 669 63.546 4.79288e-05 -3.53974 63.546000 Cu 0.776721 0.321947 0.5 670 63.546 0.000132836 -3.53975 63.546000 Cu 0.975292 0.307995 1.70195e-17 672 63.546 4.6298e-05 -3.53959 63.546000 Cu 0.909107 0.312648 0.5 674 63.546 1.10239e-05 -3.53967 63.546000 Cu 0.927165 0.32905 2.27966e-16 702 63.546 5.27236e-05 -3.53964 63.546000 Cu 0.993354 0.324385 0.5 704 63.546 0.000174946 -3.53952 63.546000 Cu 0.011472 0.340757 1 703 63.546 0.000216849 -3.53941 63.546000 Cu 0.0778057 0.336029 0.5 709 63.546 3.61731e-05 -3.53954 63.546000 Cu 0.029658 0.357089 0.5 736 63.546 9.05247e-05 -3.5394 63.546000 Cu 0.0960059 0.352364 1 738 63.546 7.74745e-05 -3.53955 63.546000 Cu 0.180557 0.364008 1.83379e-17 739 63.546 0.000336176 -3.53993 63.546000 Cu 0.162382 0.347651 0.5 740 63.546 0.000202995 -3.53971 63.546000 Cu 0.228591 0.34298 6.05271e-17 742 63.546 0.000186891 -3.5398 63.546000 Cu 0.246773 0.359347 0.5 745 63.546 0.000536288 -3.53993 63.546000 Cu 0.312877 0.354748 3.59567e-19 743 63.546 6.16548e-05 -3.53977 63.546000 Cu 0.294844 0.338326 0.5 744 63.546 0.000184961 -3.53975 63.546000 Cu 0.361002 0.333695 7.67077e-17 746 63.546 1.29512e-05 -3.5397 63.546000 Cu 0.379034 0.35011 0.5 749 63.546 6.45455e-05 -3.53963 63.546000 Cu 0.397016 0.366534 7.79062e-17 777 63.546 0.00055537 -3.53938 63.546000 Cu 0.445193 0.345451 0 747 63.546 0.000265136 -3.53947 63.546000 Cu 0.511472 0.340757 0.5 751 63.546 0.000216849 -3.53941 63.546000 Cu 0.463276 0.361832 0.5 779 63.546 0.000482698 -3.53929 63.546000 Cu 0.529658 0.357089 4.14701e-17 781 63.546 9.05247e-05 -3.5394 63.546000 Cu 0.577806 0.336029 7.6468e-17 661 63.546 3.61731e-05 -3.53954 63.546000 Cu 0.596006 0.352364 0.5 692 63.546 7.74745e-05 -3.53955 63.546000 Cu 0.662382 0.347651 1 694 63.546 0.000202995 -3.53971 63.546000 Cu 0.680557 0.364008 0.5 697 63.546 0.000336176 -3.53993 63.546000 Cu 0.746773 0.359347 1.70195e-17 695 63.546 0.000536288 -3.53993 63.546000 Cu 0.728591 0.34298 0.5 696 63.546 0.000186891 -3.5398 63.546000 Cu 0.794844 0.338326 8.43784e-17 698 63.546 0.000184961 -3.53975 63.546000 Cu 0.812877 0.354748 0.5 701 63.546 6.16548e-05 -3.53977 63.546000 Cu 0.879034 0.35011 1.67678e-16 699 63.546 6.45455e-05 -3.53963 63.546000 Cu 0.861002 0.333695 0.5 700 63.546 1.29512e-05 -3.5397 63.546000 Cu 0.945193 0.345451 0.5 705 63.546 0.000265136 -3.53947 63.546000 Cu 0.963276 0.361832 1.46224e-16 734 63.546 0.000482698 -3.53929 63.546000 Cu 0.897016 0.366534 0.5 732 63.546 0.00055537 -3.53938 63.546000 Cu 0.0478562 0.373417 1 735 63.546 0.000289368 -3.53938 63.546000 Cu 0.114336 0.368662 0.5 741 63.546 0.000519849 -3.53961 63.546000 Cu 0.0662235 0.389648 0.5 767 63.546 0.00135427 -3.53933 63.546000 Cu 0.132542 0.385007 1.03316e-16 769 63.546 0.000852794 -3.5399 63.546000 Cu 0.216844 0.396805 1 770 63.546 0.000815779 -3.5401 63.546000 Cu 0.198853 0.380329 0.5 771 63.546 0.0021369 -3.53999 63.546000 Cu 0.26481 0.375791 1.65401e-17 773 63.546 0.000245708 -3.53999 63.546000 Cu 0.282841 0.392237 0.5 776 63.546 0.00037204 -3.53974 63.546000 Cu 0.348837 0.387618 1 774 63.546 0.000962366 -3.53913 63.546000 Cu 0.330859 0.371168 0.5 775 63.546 9.73495e-05 -3.53964 63.546000 Cu 0.415027 0.382932 0.5 780 63.546 0.00144798 -3.53911 63.546000 Cu 0.547856 0.373417 0.5 693 63.546 0.000289368 -3.53938 63.546000 Cu 0.48149 0.378147 2.20774e-16 778 63.546 0.000283131 -3.53933 63.546000 Cu 0.499618 0.394474 0.5 810 63.546 0.00114127 -3.53928 63.546000 Cu 0.566224 0.389648 1 722 63.546 0.00135427 -3.53933 63.546000 Cu 0.433372 0.399217 2.39711e-19 808 63.546 0.000981597 -3.53935 63.546000 Cu 0.614336 0.368662 1.53415e-17 691 63.546 0.000519849 -3.53961 63.546000 Cu 0.632542 0.385007 0.5 724 63.546 0.000852794 -3.5399 63.546000 Cu 0.698853 0.380329 2.26527e-17 726 63.546 0.0021369 -3.53999 63.546000 Cu 0.782841 0.392237 2.76867e-17 727 63.546 0.00037204 -3.53974 63.546000 Cu 0.76481 0.375791 0.5 728 63.546 0.000245708 -3.53999 63.546000 Cu 0.716844 0.396805 0.5 729 63.546 0.000815779 -3.5401 63.546000 Cu 0.830859 0.371168 9.73229e-17 730 63.546 9.73495e-05 -3.53964 63.546000 Cu 0.848837 0.387618 0.5 733 63.546 0.000962366 -3.53913 63.546000 Cu 0.999618 0.394474 5.29762e-17 765 63.546 0.00114127 -3.53928 63.546000 Cu 0.915027 0.382932 5.29762e-17 731 63.546 0.00144798 -3.53911 63.546000 Cu 0.98149 0.378147 0.5 737 63.546 0.000283131 -3.53933 63.546000 Cu 0.933372 0.399217 0.5 763 63.546 0.000981597 -3.53935 63.546000 Cu 0.0843479 0.405982 0 766 63.546 0.00284463 -3.53973 63.546000 Cu 0.0182047 0.41066 0.5 768 63.546 0.00303592 -3.53921 63.546000 Cu 0.0364156 0.427042 1 796 63.546 0.0122766 -3.54008 63.546000 Cu 0.103066 0.422116 0.5 798 63.546 0.0251441 -3.53956 63.546000 Cu 0.150878 0.401261 0.5 772 63.546 0.00629771 -3.53983 63.546000 Cu 0.168636 0.417781 1 800 63.546 0.00257422 -3.54015 63.546000 Cu 0.252052 0.429847 8.15019e-18 801 63.546 0.00760193 -3.53665 63.546000 Cu 0.234664 0.413253 0.5 802 63.546 0.000816658 -3.53963 63.546000 Cu 0.300693 0.408759 9.96001e-17 804 63.546 0.00408838 -3.53879 63.546000 Cu 0.385324 0.420257 1 805 63.546 0.00592042 -3.53877 63.546000 Cu 0.366771 0.404055 0.5 806 63.546 0.00400853 -3.53836 63.546000 Cu 0.318253 0.425263 0.5 807 63.546 0.0174976 -3.53768 63.546000 Cu 0.518205 0.41066 1 809 63.546 0.00303592 -3.53921 63.546000 Cu 0.451461 0.415587 0.5 811 63.546 0.00539679 -3.53913 63.546000 Cu 0.536416 0.427042 0.5 837 63.546 0.0122766 -3.54008 63.546000 Cu 0.470554 0.431674 1.19856e-19 836 63.546 0.0119632 -3.53775 63.546000 Cu 0.650878 0.401261 1 723 63.546 0.00629771 -3.53983 63.546000 Cu 0.584348 0.405982 0.5 725 63.546 0.00284463 -3.53973 63.546000 Cu 0.603066 0.422116 1 753 63.546 0.0251441 -3.53956 63.546000 Cu 0.668636 0.417781 0.5 755 63.546 0.00257422 -3.54015 63.546000 Cu 0.734664 0.413253 4.14701e-17 757 63.546 0.000816658 -3.53963 63.546000 Cu 0.818253 0.425263 1 758 63.546 0.0174976 -3.53768 63.546000 Cu 0.800693 0.408759 0.5 759 63.546 0.00408838 -3.53879 63.546000 Cu 0.752052 0.429847 0.5 760 63.546 0.00760193 -3.53665 63.546000 Cu 0.866771 0.404055 8.3899e-18 761 63.546 0.00400853 -3.53836 63.546000 Cu 0.951461 0.415587 1 762 63.546 0.00539679 -3.53913 63.546000 Cu 0.885324 0.420257 0.5 764 63.546 0.00592042 -3.53877 63.546000 Cu 0.970554 0.431674 0.5 794 63.546 0.0119632 -3.53775 63.546000 Cu 0.120612 0.438778 1.61805e-17 797 63.546 0.0178893 -3.5402 63.546000 Cu 0.056394 0.44301 0.5 799 63.546 0.088769 -3.53276 63.546000 Cu 0.0746972 0.460057 1.62764e-16 824 63.546 0.159568 -3.53352 63.546000 Cu 0.139516 0.455482 0.5 826 63.546 0.0553062 -3.53163 63.546000 Cu 0.00979133 0.463261 0.5 822 63.546 0.43317 -3.51135 63.546000 Cu 0.186374 0.434237 0.5 803 63.546 0.00802122 -3.5393 63.546000 Cu 0.202806 0.451041 2.19815e-16 828 63.546 0.0740138 -3.52417 63.546000 Cu 0.269107 0.446382 0.5 830 63.546 0.0490198 -3.53048 63.546000 Cu 0.287865 0.461756 1.829e-16 829 63.546 0.261068 -3.53147 63.546000 Cu 0.337135 0.441329 2.88013e-16 832 63.546 0.0351057 -3.53674 63.546000 Cu 0.403002 0.436644 0.5 834 63.546 0.0181578 -3.53498 63.546000 Cu 0.353731 0.458114 0.5 835 63.546 0.155809 -3.53575 63.546000 Cu 0.422069 0.452468 1.28365e-16 833 63.546 0.0682265 -3.5331 63.546000 Cu 0.556394 0.44301 4.79423e-19 752 63.546 0.088769 -3.53276 63.546000 Cu 0.48838 0.448051 0.5 838 63.546 0.0707678 -3.53268 63.546000 Cu 0.509791 0.463261 1.41669e-16 849 63.546 0.43317 -3.51135 63.546000 Cu 0.686374 0.434237 1.38553e-16 754 63.546 0.00802122 -3.5393 63.546000 Cu 0.620612 0.438778 0.5 756 63.546 0.0178893 -3.5402 63.546000 Cu 0.574697 0.460057 0.5 783 63.546 0.159568 -3.53352 63.546000 Cu 0.639516 0.455482 1 784 63.546 0.0553062 -3.53163 63.546000 Cu 0.702806 0.451041 0.5 786 63.546 0.0740138 -3.52417 63.546000 Cu 0.769107 0.446382 7.40708e-17 788 63.546 0.0490198 -3.53048 63.546000 Cu 0.837135 0.441329 0.5 790 63.546 0.0351057 -3.53674 63.546000 Cu 0.787865 0.461756 0.5 791 63.546 0.261068 -3.53147 63.546000 Cu 0.853731 0.458114 1 789 63.546 0.155809 -3.53575 63.546000 Cu 0.903002 0.436644 1 792 63.546 0.0181578 -3.53498 63.546000 Cu 0.98838 0.448051 7.2273e-17 793 63.546 0.0707678 -3.53268 63.546000 Cu 0.922069 0.452468 0.5 795 63.546 0.0682265 -3.5331 63.546000 Cu 0.0225898 0.479533 1 821 63.546 2.73323 -3.41878 63.546000 Cu 0.0960857 0.47658 0.5 827 63.546 0.881616 -3.47297 63.546000 Cu 0.108183 0.493952 4.21892e-17 840 63.546 4.26847 -3.48222 63.546000 Cu 0.0362812 0.493905 0.5 839 63.546 8.05522 -3.38922 63.546000 Cu 0.156703 0.473471 1.88174e-16 825 63.546 0.533636 -3.45492 63.546000 Cu 0.220862 0.467943 0.5 831 63.546 0.37599 -3.48485 63.546000 Cu 0.178863 0.493708 0.5 841 63.546 8.95815 -3.3828 63.546000 Cu 0.241148 0.482804 1 842 63.546 9.05429 -3.33299 63.546000 Cu 0.326934 0.493849 1.28965e-16 843 63.546 10.2938 -3.3799 63.546000 Cu 0.306167 0.479114 0.5 844 63.546 2.38843 -3.41307 63.546000 Cu 0.371311 0.473615 1 845 63.546 0.651494 -3.47095 63.546000 Cu 0.397002 0.493486 0.5 848 63.546 8.75383 -3.41279 63.546000 Cu 0.454827 0.482747 0 846 63.546 9.01345 -3.34133 63.546000 Cu 0.438047 0.468706 0.5 847 63.546 0.401447 -3.47255 63.546000 Cu 0.52259 0.479533 0.5 850 63.546 2.73323 -3.41878 63.546000 Cu 0.536281 0.493905 1.2501e-16 812 63.546 8.05522 -3.38922 63.546000 Cu 0.596086 0.47658 1.1602e-16 782 63.546 0.881616 -3.47297 63.546000 Cu 0.656703 0.473471 0.5 787 63.546 0.533636 -3.45492 63.546000 Cu 0.608183 0.493952 0.5 813 63.546 4.26847 -3.48222 63.546000 Cu 0.678863 0.493708 1.26208e-16 814 63.546 8.95815 -3.3828 63.546000 Cu 0.720862 0.467943 1 785 63.546 0.37599 -3.48485 63.546000 Cu 0.741148 0.482804 0.5 815 63.546 9.05429 -3.33299 63.546000 Cu 0.806167 0.479114 1 816 63.546 2.38843 -3.41307 63.546000 Cu 0.826934 0.493849 0.5 819 63.546 10.2938 -3.3799 63.546000 Cu 0.897002 0.493486 1 817 63.546 8.75383 -3.41279 63.546000 Cu 0.871311 0.473615 0.5 818 63.546 0.651494 -3.47095 63.546000 Cu 0.938047 0.468706 1 820 63.546 0.401447 -3.47255 63.546000 Cu 0.954827 0.482747 0.5 823 63.546 9.01345 -3.34133 63.546000 Cu 0.0180996 0.507925 3.59567e-19 10 63.546 3.3163 -3.403 63.546000 Cu 0.0689182 0.527592 1 11 63.546 0.209655 -3.53182 63.546000 Cu 0.0931316 0.511486 0.5 12 63.546 1.09663 -3.43896 63.546000 Cu 0.133814 0.532687 0.5 17 63.546 0.113933 -3.52675 63.546000 Cu 0.00415706 0.524285 0.5 13 63.546 0.383459 -3.50801 63.546000 Cu 0.236816 0.504827 1.66599e-17 1 63.546 9.19737 -3.34909 63.546000 Cu 0.153038 0.514553 3.47582e-17 14 63.546 0.522724 -3.43902 63.546000 Cu 0.215844 0.519987 0.5 16 63.546 0.442762 -3.49305 63.546000 Cu 0.282436 0.525866 2.91849e-16 18 63.546 0.209421 -3.53157 63.546000 Cu 0.367334 0.514224 0 2 63.546 0.922943 -3.45479 63.546000 Cu 0.301581 0.508233 0.5 3 63.546 3.04485 -3.38792 63.546000 Cu 0.347441 0.529571 0.5 20 63.546 0.193269 -3.5364 63.546000 Cu 0.432578 0.518871 0.5 4 63.546 0.549728 -3.48283 63.546000 Cu 0.450774 0.504598 5.99279e-19 24 63.546 9.19875 -3.3619 63.546000 Cu 0.504157 0.524285 3.59567e-19 25 63.546 0.383459 -3.50801 63.546000 Cu 0.5181 0.507925 0.5 26 63.546 3.3163 -3.403 63.546000 Cu 0.568918 0.527592 0.5 30 63.546 0.209655 -3.53182 63.546000 Cu 0.593132 0.511486 1.43947e-16 27 63.546 1.09663 -3.43896 63.546000 Cu 0.633814 0.532687 2.39232e-16 28 63.546 0.113933 -3.52675 63.546000 Cu 0.653038 0.514553 0.5 29 63.546 0.522724 -3.43902 63.546000 Cu 0.715844 0.519987 8.50976e-17 31 63.546 0.442762 -3.49305 63.546000 Cu 0.801581 0.508233 1.06672e-17 5 63.546 3.04485 -3.38792 63.546000 Cu 0.736816 0.504827 0.5 6 63.546 9.19737 -3.34909 63.546000 Cu 0.782436 0.525866 0.5 33 63.546 0.209421 -3.53157 63.546000 Cu 0.847441 0.529571 1.25489e-16 35 63.546 0.193269 -3.5364 63.546000 Cu 0.932578 0.518871 1 7 63.546 0.549728 -3.48283 63.546000 Cu 0.950774 0.504598 0.5 8 63.546 9.19875 -3.3619 63.546000 Cu 0.867334 0.514224 0.5 9 63.546 0.922943 -3.45479 63.546000 Cu 0.0279301 0.56072 1.0775e-16 40 63.546 0.0164294 -3.5409 63.546000 Cu 0.0491443 0.544723 0.5 41 63.546 0.0738438 -3.53057 63.546000 Cu 0.113194 0.549091 9.04911e-17 43 63.546 0.0228477 -3.54096 63.546000 Cu 0.0942336 0.565764 0.5 46 63.546 0.0218387 -3.5386 63.546000 Cu 0.196803 0.536953 1.38314e-16 15 63.546 0.0547478 -3.52929 63.546000 Cu 0.262468 0.541485 0.5 21 63.546 0.0429742 -3.53561 63.546000 Cu 0.178965 0.553852 0.5 45 63.546 0.0209869 -3.53878 63.546000 Cu 0.244234 0.558136 3.59567e-19 47 63.546 0.00526507 -3.53755 63.546000 Cu 0.415797 0.535324 1 22 63.546 0.097823 -3.53227 63.546000 Cu 0.329902 0.546503 1.50539e-16 19 63.546 0.0356468 -3.5361 63.546000 Cu 0.39528 0.551086 0.5 23 63.546 0.0314319 -3.53625 63.546000 Cu 0.310017 0.562696 0.5 49 63.546 0.0128191 -3.53916 63.546000 Cu 0.462575 0.556134 2.03755e-17 55 63.546 0.0189861 -3.5366 63.546000 Cu 0.481559 0.539565 0.5 56 63.546 0.088867 -3.5332 63.546000 Cu 0.549144 0.544723 1.17818e-16 57 63.546 0.0738438 -3.53057 63.546000 Cu 0.52793 0.56072 0.5 60 63.546 0.0164294 -3.5409 63.546000 Cu 0.696803 0.536953 0.5 34 63.546 0.0547478 -3.52929 63.546000 Cu 0.594234 0.565764 2.91249e-17 58 63.546 0.0218387 -3.5386 63.546000 Cu 0.613194 0.549091 0.5 59 63.546 0.0228477 -3.54096 63.546000 Cu 0.678965 0.553852 6.47221e-17 61 63.546 0.0209869 -3.53878 63.546000 Cu 0.762468 0.541485 3.59567e-19 32 63.546 0.0429742 -3.53561 63.546000 Cu 0.829902 0.546503 0.5 38 63.546 0.0356468 -3.5361 63.546000 Cu 0.744234 0.558136 0.5 63 63.546 0.00526507 -3.53755 63.546000 Cu 0.810017 0.562696 1.38433e-16 65 63.546 0.0128191 -3.53916 63.546000 Cu 0.915797 0.535324 0.5 37 63.546 0.097823 -3.53227 63.546000 Cu 0.89528 0.551086 1 36 63.546 0.0314319 -3.53625 63.546000 Cu 0.981559 0.539565 2.03755e-17 39 63.546 0.088867 -3.5332 63.546000 Cu 0.962575 0.556134 0.5 42 63.546 0.0189861 -3.5366 63.546000 Cu 0.00852595 0.577219 0.5 71 63.546 0.00430571 -3.53933 63.546000 Cu 0.0742355 0.581901 5.68116e-17 73 63.546 0.00346667 -3.54008 63.546000 Cu 0.140484 0.58671 0.5 75 63.546 0.0054753 -3.53903 63.546000 Cu 0.0548874 0.598311 0.5 76 63.546 0.00126143 -3.53944 63.546000 Cu 0.159627 0.570184 2.39711e-19 44 63.546 0.00396843 -3.54011 63.546000 Cu 0.225547 0.574814 0.5 50 63.546 0.00379672 -3.53918 63.546000 Cu 0.206216 0.591222 1 77 63.546 0.00105889 -3.53991 63.546000 Cu 0.272044 0.595854 0.5 79 63.546 0.00077435 -3.53962 63.546000 Cu 0.376552 0.567645 2.50498e-17 51 63.546 0.00699595 -3.53874 63.546000 Cu 0.291196 0.579279 4.42268e-17 48 63.546 0.00241997 -3.53918 63.546000 Cu 0.422958 0.58876 2.39711e-19 52 63.546 0.00133765 -3.53956 63.546000 Cu 0.356883 0.583948 0.5 54 63.546 0.00270673 -3.53951 63.546000 Cu 0.442187 0.57225 0.5 53 63.546 0.00961892 -3.53989 63.546000 Cu 0.508526 0.577219 9.04911e-17 85 63.546 0.00430571 -3.53933 63.546000 Cu 0.554887 0.598311 1 86 63.546 0.00126143 -3.53944 63.546000 Cu 0.488696 0.593465 0.5 88 63.546 0.00218534 -3.53997 63.546000 Cu 0.574236 0.581901 0.5 87 63.546 0.00346667 -3.54008 63.546000 Cu 0.659627 0.570184 0.5 64 63.546 0.00396843 -3.54011 63.546000 Cu 0.640484 0.58671 1.3268e-16 89 63.546 0.0054753 -3.53903 63.546000 Cu 0.706216 0.591222 0.5 91 63.546 0.00105889 -3.53991 63.546000 Cu 0.725547 0.574814 1.19856e-19 62 63.546 0.00379672 -3.53918 63.546000 Cu 0.856883 0.583948 8.86932e-18 66 63.546 0.00270673 -3.53951 63.546000 Cu 0.791196 0.579279 0.5 68 63.546 0.00241997 -3.53918 63.546000 Cu 0.772044 0.595854 2.27726e-17 93 63.546 0.00077435 -3.53962 63.546000 Cu 0.876552 0.567645 0.5 67 63.546 0.00699595 -3.53874 63.546000 Cu 0.942187 0.57225 4.33878e-17 69 63.546 0.00961892 -3.53989 63.546000 Cu 0.988696 0.593465 2.22093e-16 70 63.546 0.00218534 -3.53997 63.546000 Cu 0.922958 0.58876 0.5 72 63.546 0.00133765 -3.53956 63.546000 Cu 0.120806 0.602974 4.14701e-17 74 63.546 0.000867672 -3.53988 63.546000 Cu 0.035286 0.614607 1 101 63.546 0.000611655 -3.53981 63.546000 Cu 0.101395 0.619378 0.5 103 63.546 0.000369177 -3.53958 63.546000 Cu 0.0159426 0.631021 0.5 104 63.546 0.000116019 -3.53971 63.546000 Cu 0.252577 0.6123 4.79423e-19 78 63.546 0.000242972 -3.53986 63.546000 Cu 0.186883 0.607708 0.5 80 63.546 0.001673 -3.53945 63.546000 Cu 0.167254 0.624062 0 105 63.546 0.000270728 -3.53989 63.546000 Cu 0.233153 0.628772 0.5 107 63.546 0.000515035 -3.53973 63.546000 Cu 0.337667 0.60046 1.01278e-16 81 63.546 0.000428718 -3.53952 63.546000 Cu 0.38404 0.621599 1.19856e-19 82 63.546 0.000282648 -3.53976 63.546000 Cu 0.403369 0.605137 0.5 83 63.546 0.000924081 -3.5398 63.546000 Cu 0.318304 0.616963 0.5 84 63.546 0.000157032 -3.53972 63.546000 Cu 0.469373 0.60991 1 115 63.546 0.000431223 -3.53965 63.546000 Cu 0.515943 0.631021 8.73748e-17 116 63.546 0.000116019 -3.53971 63.546000 Cu 0.535286 0.614607 0.5 117 63.546 0.000611655 -3.53981 63.546000 Cu 0.449899 0.626282 0.5 118 63.546 0.000384645 -3.53981 63.546000 Cu 0.686883 0.607708 1.12784e-16 90 63.546 0.001673 -3.53945 63.546000 Cu 0.620806 0.602974 0.5 92 63.546 0.000867672 -3.53988 63.546000 Cu 0.601395 0.619378 1 119 63.546 0.000369177 -3.53958 63.546000 Cu 0.667254 0.624062 0.5 121 63.546 0.000270728 -3.53989 63.546000 Cu 0.837667 0.60046 0.5 95 63.546 0.000428718 -3.53952 63.546000 Cu 0.818304 0.616963 0 94 63.546 0.000157032 -3.53972 63.546000 Cu 0.752577 0.6123 0.5 96 63.546 0.000242972 -3.53986 63.546000 Cu 0.733153 0.628772 1.07031e-16 123 63.546 0.000515035 -3.53973 63.546000 Cu 0.903369 0.605137 4.14701e-17 97 63.546 0.000924081 -3.5398 63.546000 Cu 0.949899 0.626282 1 98 63.546 0.000384645 -3.53981 63.546000 Cu 0.969373 0.60991 0.5 99 63.546 0.000431223 -3.53965 63.546000 Cu 0.88404 0.621599 0.5 100 63.546 0.000282648 -3.53976 63.546000 Cu 0.0818478 0.635728 1.88054e-16 102 63.546 0.000170095 -3.53987 63.546000 Cu 0.0624626 0.652137 0.5 133 63.546 4.24225e-05 -3.5398 63.546000 Cu 0.128399 0.656849 1.19856e-19 135 63.546 1.95893e-05 -3.53987 63.546000 Cu 0.213731 0.645161 1 106 63.546 9.12037e-05 -3.5399 63.546000 Cu 0.147833 0.640478 0.5 108 63.546 0.000182589 -3.53976 63.546000 Cu 0.279649 0.649838 0.5 112 63.546 0.000157473 -3.5398 63.546000 Cu 0.194353 0.661567 0.5 137 63.546 0.000138962 -3.53977 63.546000 Cu 0.26026 0.666235 1 139 63.546 4.17913e-05 -3.53987 63.546000 Cu 0.298938 0.633398 1.27646e-16 109 63.546 7.14265e-05 -3.53991 63.546000 Cu 0.345457 0.654483 1 110 63.546 2.27569e-05 -3.53986 63.546000 Cu 0.364755 0.638053 0.5 111 63.546 2.48542e-05 -3.53985 63.546000 Cu 0.411296 0.65915 0.5 114 63.546 1.56633e-05 -3.53981 63.546000 Cu 0.430608 0.64271 1 113 63.546 0.00014812 -3.53977 63.546000 Cu 0.477136 0.663828 1.10507e-16 146 63.546 6.20055e-05 -3.5398 63.546000 Cu 0.496495 0.647409 0.5 147 63.546 0.000123965 -3.53984 63.546000 Cu 0.562463 0.652137 1 148 63.546 4.24225e-05 -3.5398 63.546000 Cu 0.647833 0.640478 2.06272e-16 120 63.546 0.000182589 -3.53976 63.546000 Cu 0.581848 0.635728 0.5 122 63.546 0.000170095 -3.53987 63.546000 Cu 0.713731 0.645161 0.5 126 63.546 9.12037e-05 -3.5399 63.546000 Cu 0.628399 0.656849 0.5 150 63.546 1.95893e-05 -3.53987 63.546000 Cu 0.694353 0.661567 4.14701e-17 152 63.546 0.000138962 -3.53977 63.546000 Cu 0.798938 0.633398 0.5 125 63.546 7.14265e-05 -3.53991 63.546000 Cu 0.779649 0.649838 1.19856e-19 124 63.546 0.000157473 -3.5398 63.546000 Cu 0.845457 0.654483 0.5 130 63.546 2.27569e-05 -3.53986 63.546000 Cu 0.76026 0.666235 0.5 154 63.546 4.17913e-05 -3.53987 63.546000 Cu 0.864755 0.638053 1.19856e-19 127 63.546 2.48542e-05 -3.53985 63.546000 Cu 0.911296 0.65915 5.59726e-17 128 63.546 1.56633e-05 -3.53981 63.546000 Cu 0.930608 0.64271 0.5 129 63.546 0.00014812 -3.53977 63.546000 Cu 0.996495 0.647409 1.61805e-17 131 63.546 0.000123965 -3.53984 63.546000 Cu 0.977136 0.663828 0.5 134 63.546 6.20055e-05 -3.5398 63.546000 Cu 0.0430292 0.668521 1 132 63.546 8.39472e-05 -3.53986 63.546000 Cu 0.108977 0.67323 0.5 138 63.546 2.13207e-05 -3.53981 63.546000 Cu 0.0236697 0.684922 0.5 162 63.546 7.39321e-05 -3.53983 63.546000 Cu 0.089609 0.689611 1 164 63.546 6.45898e-05 -3.53981 63.546000 Cu 0.174961 0.677938 7.52694e-17 136 63.546 2.52899e-05 -3.53983 63.546000 Cu 0.240867 0.682636 0.5 142 63.546 3.81568e-05 -3.53983 63.546000 Cu 0.155558 0.694319 0.5 166 63.546 1.66755e-05 -3.53982 63.546000 Cu 0.221487 0.699025 6.11264e-17 168 63.546 6.07438e-05 -3.53988 63.546000 Cu 0.306738 0.687316 1 140 63.546 3.58209e-05 -3.53982 63.546000 Cu 0.326116 0.67091 0.5 141 63.546 3.55451e-05 -3.53981 63.546000 Cu 0.391952 0.675573 1 143 63.546 8.99597e-06 -3.53981 63.546000 Cu 0.372618 0.691998 0.5 145 63.546 8.03544e-05 -3.53982 63.546000 Cu 0.438518 0.696659 1 144 63.546 2.72808e-05 -3.53988 63.546000 Cu 0.543029 0.668521 0.5 151 63.546 8.39472e-05 -3.53986 63.546000 Cu 0.457799 0.68025 0.5 176 63.546 2.7262e-05 -3.53982 63.546000 Cu 0.52367 0.684922 2.97242e-17 177 63.546 7.39321e-05 -3.53983 63.546000 Cu 0.608977 0.67323 8.15019e-18 149 63.546 2.13207e-05 -3.53981 63.546000 Cu 0.674961 0.677938 0.5 155 63.546 2.52899e-05 -3.53983 63.546000 Cu 0.589609 0.689611 0.5 179 63.546 6.45898e-05 -3.53981 63.546000 Cu 0.655558 0.694319 1 181 63.546 1.66755e-05 -3.53982 63.546000 Cu 0.740867 0.682636 0 153 63.546 3.81568e-05 -3.53983 63.546000 Cu 0.826116 0.67091 0 156 63.546 3.55451e-05 -3.53981 63.546000 Cu 0.806738 0.687316 0.5 159 63.546 3.58209e-05 -3.53982 63.546000 Cu 0.721487 0.699025 0.5 183 63.546 6.07438e-05 -3.53988 63.546000 Cu 0.872618 0.691998 2.08309e-16 157 63.546 8.03544e-05 -3.53982 63.546000 Cu 0.891952 0.675573 0.5 158 63.546 8.99597e-06 -3.53981 63.546000 Cu 0.957799 0.68025 1.23332e-16 160 63.546 2.7262e-05 -3.53982 63.546000 Cu 0.938518 0.696659 0.5 163 63.546 2.72808e-05 -3.53988 63.546000 Cu 0.00440751 0.70133 4.79423e-19 161 63.546 3.16769e-05 -3.53989 63.546000 Cu 0.136238 0.710699 1 165 63.546 7.57518e-05 -3.53992 63.546000 Cu 0.0703101 0.706011 0.5 167 63.546 5.42924e-05 -3.53988 63.546000 Cu 0.0511143 0.722408 1 193 63.546 2.13277e-05 -3.53995 63.546000 Cu 0.117045 0.727087 0.5 195 63.546 2.8174e-05 -3.53996 63.546000 Cu 0.268199 0.720093 0 169 63.546 1.2977e-05 -3.53995 63.546000 Cu 0.2022 0.715407 0.5 171 63.546 5.88963e-05 -3.53994 63.546000 Cu 0.183001 0.731767 1.3304e-17 197 63.546 3.98096e-05 -3.53994 63.546000 Cu 0.287404 0.703715 0.5 170 63.546 8.26591e-05 -3.53989 63.546000 Cu 0.353374 0.708394 1 172 63.546 3.258e-05 -3.53991 63.546000 Cu 0.400128 0.729457 1 173 63.546 1.53361e-05 -3.53992 63.546000 Cu 0.419325 0.713067 0.5 174 63.546 2.30125e-05 -3.53991 63.546000 Cu 0.334163 0.724781 0.5 175 63.546 1.72438e-05 -3.53991 63.546000 Cu 0.57031 0.706011 1 178 63.546 5.42924e-05 -3.53988 63.546000 Cu 0.504408 0.70133 0.5 180 63.546 3.16769e-05 -3.53989 63.546000 Cu 0.485224 0.717735 1 206 63.546 3.59743e-06 -3.53995 63.546000 Cu 0.551114 0.722408 0.5 208 63.546 2.13277e-05 -3.53995 63.546000 Cu 0.7022 0.715407 3.11625e-17 182 63.546 5.88963e-05 -3.53994 63.546000 Cu 0.636238 0.710699 0.5 184 63.546 7.57518e-05 -3.53992 63.546000 Cu 0.617045 0.727087 2.30123e-17 210 63.546 2.8174e-05 -3.53996 63.546000 Cu 0.683001 0.731767 0.5 212 63.546 3.98096e-05 -3.53994 63.546000 Cu 0.787404 0.703715 1 185 63.546 8.26591e-05 -3.53989 63.546000 Cu 0.834163 0.724781 1 186 63.546 1.72438e-05 -3.53991 63.546000 Cu 0.853374 0.708394 0.5 187 63.546 3.258e-05 -3.53991 63.546000 Cu 0.768199 0.720093 0.5 188 63.546 1.2977e-05 -3.53995 63.546000 Cu 0.919325 0.713067 2.02556e-17 189 63.546 2.30125e-05 -3.53991 63.546000 Cu 0.985224 0.717735 0.5 191 63.546 3.59743e-06 -3.53995 63.546000 Cu 0.900128 0.729457 0.5 192 63.546 1.53361e-05 -3.53992 63.546000 Cu 0.0978976 0.743479 1 194 63.546 6.93423e-06 -3.53993 63.546000 Cu 0.0319819 0.738803 0.5 196 63.546 6.35724e-06 -3.53992 63.546000 Cu 0.0128434 0.755206 0 222 63.546 1.52945e-05 -3.53994 63.546000 Cu 0.078734 0.759875 0.5 224 63.546 1.26113e-05 -3.53994 63.546000 Cu 0.229779 0.752831 7.10745e-17 198 63.546 3.27483e-05 -3.53994 63.546000 Cu 0.248978 0.736463 0.5 199 63.546 2.35232e-06 -3.53993 63.546000 Cu 0.163812 0.748149 0.5 200 63.546 3.90694e-05 -3.53991 63.546000 Cu 0.144685 0.764539 3.02036e-17 226 63.546 1.70004e-05 -3.53994 63.546000 Cu 0.314952 0.741157 4.09907e-17 201 63.546 1.6109e-05 -3.53992 63.546000 Cu 0.361764 0.762219 2.06871e-16 202 63.546 7.61923e-06 -3.53995 63.546000 Cu 0.380933 0.745842 0.5 203 63.546 9.3129e-06 -3.53993 63.546000 Cu 0.29578 0.757527 0.5 204 63.546 2.15334e-06 -3.53995 63.546000 Cu 0.531982 0.738803 8.3899e-19 207 63.546 6.35724e-06 -3.53992 63.546000 Cu 0.466052 0.73414 0.5 209 63.546 2.84494e-05 -3.53994 63.546000 Cu 0.446902 0.750531 1 236 63.546 2.86156e-05 -3.5399 63.546000 Cu 0.512843 0.755206 0.5 238 63.546 1.52945e-05 -3.53994 63.546000 Cu 0.663812 0.748149 1.72952e-16 211 63.546 3.90694e-05 -3.53991 63.546000 Cu 0.597898 0.743479 0.5 213 63.546 6.93423e-06 -3.53993 63.546000 Cu 0.578734 0.759875 2.21733e-17 239 63.546 1.26113e-05 -3.53994 63.546000 Cu 0.644685 0.764539 0.5 241 63.546 1.70004e-05 -3.53994 63.546000 Cu 0.748978 0.736463 7.50297e-17 214 63.546 2.35232e-06 -3.53993 63.546000 Cu 0.79578 0.757527 5.02196e-17 215 63.546 2.15334e-06 -3.53995 63.546000 Cu 0.814952 0.741157 0.5 216 63.546 1.6109e-05 -3.53992 63.546000 Cu 0.729779 0.752831 0.5 217 63.546 3.27483e-05 -3.53994 63.546000 Cu 0.966052 0.73414 9.14499e-17 190 63.546 2.84494e-05 -3.53994 63.546000 Cu 0.880933 0.745842 1.88653e-16 218 63.546 9.3129e-06 -3.53993 63.546000 Cu 0.946902 0.750531 0.5 220 63.546 2.86156e-05 -3.5399 63.546000 Cu 0.861764 0.762219 0.5 221 63.546 7.61923e-06 -3.53995 63.546000 Cu 0.0596265 0.77627 4.14701e-17 223 63.546 3.35711e-05 -3.53997 63.546000 Cu 0.125515 0.780936 0.5 229 63.546 1.83556e-05 -3.53994 63.546000 Cu 0.0404173 0.792664 0.5 253 63.546 6.353e-05 -3.5399 63.546000 Cu 0.106334 0.797345 4.19495e-18 255 63.546 8.00015e-05 -3.53988 63.546000 Cu 0.191435 0.785609 1 227 63.546 2.40782e-05 -3.53991 63.546000 Cu 0.210617 0.769214 0.5 228 63.546 2.46017e-05 -3.53995 63.546000 Cu 0.276587 0.773893 0 230 63.546 3.98594e-05 -3.53993 63.546000 Cu 0.257362 0.790279 0.5 233 63.546 7.07295e-05 -3.5399 63.546000 Cu 0.427735 0.766916 0.5 205 63.546 4.14716e-05 -3.53995 63.546000 Cu 0.32333 0.794964 1.55812e-17 231 63.546 0.000107694 -3.53987 63.546000 Cu 0.342559 0.778589 0.5 232 63.546 1.14467e-05 -3.53998 63.546000 Cu 0.40855 0.783276 4.59047e-17 234 63.546 6.05153e-05 -3.53996 63.546000 Cu 0.389257 0.799654 0.5 235 63.546 0.000107885 -3.53987 63.546000 Cu 0.493684 0.771594 5.10585e-17 237 63.546 2.32511e-05 -3.53997 63.546000 Cu 0.559626 0.77627 0.5 242 63.546 3.35711e-05 -3.53997 63.546000 Cu 0.474521 0.787979 0.5 268 63.546 0.000120239 -3.53995 63.546000 Cu 0.540417 0.792664 1.31122e-16 269 63.546 6.353e-05 -3.5399 63.546000 Cu 0.625515 0.780936 6.19654e-17 240 63.546 1.83556e-05 -3.53994 63.546000 Cu 0.710617 0.769214 7.29921e-17 243 63.546 2.46017e-05 -3.53995 63.546000 Cu 0.691435 0.785609 0.5 246 63.546 2.40782e-05 -3.53991 63.546000 Cu 0.606334 0.797345 0.5 271 63.546 8.00015e-05 -3.53988 63.546000 Cu 0.757362 0.790279 1 244 63.546 7.07295e-05 -3.5399 63.546000 Cu 0.776587 0.773893 0.5 245 63.546 3.98594e-05 -3.53993 63.546000 Cu 0.842559 0.778589 1 247 63.546 1.14467e-05 -3.53998 63.546000 Cu 0.82333 0.794964 0.5 250 63.546 0.000107694 -3.53987 63.546000 Cu 0.927735 0.766916 6.83178e-18 219 63.546 4.14716e-05 -3.53995 63.546000 Cu 0.993684 0.771594 0.5 225 63.546 2.32511e-05 -3.53997 63.546000 Cu 0.889257 0.799654 1.12425e-16 248 63.546 0.000107885 -3.53987 63.546000 Cu 0.90855 0.783276 0.5 249 63.546 6.05153e-05 -3.53996 63.546000 Cu 0.974521 0.787979 1.15062e-17 251 63.546 0.000120239 -3.53995 63.546000 Cu 0.021121 0.80907 1 252 63.546 0.000177264 -3.53978 63.546000 Cu 0.0869997 0.81376 0.5 258 63.546 0.000139666 -3.53978 63.546000 Cu 0.00160956 0.82546 0.5 283 63.546 8.4143e-05 -3.53968 63.546000 Cu 0.0674984 0.830176 1.21174e-16 285 63.546 0.00016953 -3.53968 63.546000 Cu 0.152836 0.818432 2.14062e-16 256 63.546 9.22835e-05 -3.53973 63.546000 Cu 0.172193 0.80202 0.5 257 63.546 6.38805e-05 -3.53988 63.546000 Cu 0.238085 0.80668 8.03033e-18 259 63.546 0.000141348 -3.5398 63.546000 Cu 0.218637 0.823106 0.5 262 63.546 5.48822e-05 -3.53974 63.546000 Cu 0.284456 0.827767 1 260 63.546 0.000147016 -3.53965 63.546000 Cu 0.303934 0.811361 0.5 261 63.546 7.21008e-05 -3.53979 63.546000 Cu 0.369825 0.816046 1.19856e-19 263 63.546 9.45619e-05 -3.53976 63.546000 Cu 0.350263 0.832457 0.5 266 63.546 8.01522e-05 -3.5397 63.546000 Cu 0.435689 0.820749 0.5 265 63.546 5.5169e-05 -3.53976 63.546000 Cu 0.455182 0.804358 5.27365e-18 267 63.546 8.03824e-05 -3.53982 63.546000 Cu 0.521121 0.80907 0.5 272 63.546 0.000177264 -3.53978 63.546000 Cu 0.50161 0.82546 1.04155e-16 297 63.546 8.4143e-05 -3.53968 63.546000 Cu 0.567498 0.830176 0.5 299 63.546 0.00016953 -3.53968 63.546000 Cu 0.587 0.81376 7.26326e-17 270 63.546 0.000139666 -3.53978 63.546000 Cu 0.672193 0.80202 1.3304e-17 273 63.546 6.38805e-05 -3.53988 63.546000 Cu 0.652836 0.818432 0.5 276 63.546 9.22835e-05 -3.53973 63.546000 Cu 0.718637 0.823106 1.04274e-17 274 63.546 5.48822e-05 -3.53974 63.546000 Cu 0.738085 0.80668 0.5 275 63.546 0.000141348 -3.5398 63.546000 Cu 0.803934 0.811361 8.50976e-18 277 63.546 7.21008e-05 -3.53979 63.546000 Cu 0.850263 0.832457 3.72751e-17 278 63.546 8.01522e-05 -3.5397 63.546000 Cu 0.784456 0.827767 0.5 280 63.546 0.000147016 -3.53965 63.546000 Cu 0.955182 0.804358 0.5 254 63.546 8.03824e-05 -3.53982 63.546000 Cu 0.869825 0.816046 0.5 279 63.546 9.45619e-05 -3.53976 63.546000 Cu 0.935689 0.820749 8.12622e-17 281 63.546 5.5169e-05 -3.53976 63.546000 Cu 0.113723 0.8513 7.33517e-17 286 63.546 0.000177728 -3.53964 63.546000 Cu 0.133326 0.834867 0.5 287 63.546 0.000112862 -3.53964 63.546000 Cu 0.0478331 0.846568 0.5 288 63.546 5.24814e-05 -3.5396 63.546000 Cu 0.0281628 0.862984 1 313 63.546 0.000100575 -3.53967 63.546000 Cu 0.199102 0.839536 1.40231e-16 289 63.546 6.24317e-05 -3.53957 63.546000 Cu 0.245243 0.860672 4.14701e-17 290 63.546 3.72114e-05 -3.53956 63.546000 Cu 0.264873 0.844217 0.5 291 63.546 4.83612e-05 -3.53958 63.546000 Cu 0.17952 0.856006 0.5 292 63.546 0.000155527 -3.5395 63.546000 Cu 0.416082 0.837136 5.75308e-17 264 63.546 0.000127585 -3.53957 63.546000 Cu 0.330583 0.848871 1.06911e-16 293 63.546 0.000176254 -3.53951 63.546000 Cu 0.396405 0.85356 0.5 295 63.546 8.00118e-05 -3.53962 63.546000 Cu 0.31097 0.865337 0.5 296 63.546 7.84416e-05 -3.53963 63.546000 Cu 0.547833 0.846568 1 298 63.546 5.24814e-05 -3.5396 63.546000 Cu 0.481945 0.841854 0.5 300 63.546 2.21103e-05 -3.53966 63.546000 Cu 0.462245 0.858239 1 327 63.546 0.00020472 -3.53949 63.546000 Cu 0.528163 0.862984 0.5 329 63.546 0.000100575 -3.53967 63.546000 Cu 0.633326 0.834867 0 301 63.546 0.000112862 -3.53964 63.546000 Cu 0.67952 0.856006 0 302 63.546 0.000155527 -3.5395 63.546000 Cu 0.699102 0.839536 0.5 303 63.546 6.24317e-05 -3.53957 63.546000 Cu 0.613723 0.8513 0.5 304 63.546 0.000177728 -3.53964 63.546000 Cu 0.764873 0.844217 1.19856e-19 305 63.546 4.83612e-05 -3.53958 63.546000 Cu 0.81097 0.865337 1.46344e-16 306 63.546 7.84416e-05 -3.53963 63.546000 Cu 0.830583 0.848871 0.5 307 63.546 0.000176254 -3.53951 63.546000 Cu 0.745243 0.860672 0.5 308 63.546 3.72114e-05 -3.53956 63.546000 Cu 0.981945 0.841854 1.28845e-16 282 63.546 2.21103e-05 -3.53966 63.546000 Cu 0.916082 0.837136 0.5 284 63.546 0.000127585 -3.53957 63.546000 Cu 0.896405 0.85356 1 309 63.546 8.00118e-05 -3.53962 63.546000 Cu 0.962245 0.858239 0.5 311 63.546 0.00020472 -3.53949 63.546000 Cu 0.074363 0.884146 1 314 63.546 0.000670986 -3.53968 63.546000 Cu 0.0939929 0.867708 0.5 315 63.546 0.000109989 -3.5395 63.546000 Cu 0.00834961 0.879359 0.5 316 63.546 0.000404039 -3.53936 63.546000 Cu 0.140178 0.888857 0.5 320 63.546 0.000402289 -3.5395 63.546000 Cu 0.159921 0.872464 1 317 63.546 0.000416126 -3.53965 63.546000 Cu 0.206134 0.893636 1.54614e-17 318 63.546 0.00103769 -3.53965 63.546000 Cu 0.225695 0.877159 0.5 319 63.546 0.000326451 -3.53954 63.546000 Cu 0.271814 0.898313 0.5 324 63.546 0.000537974 -3.53929 63.546000 Cu 0.37669 0.869964 1.34838e-16 294 63.546 0.000509567 -3.53943 63.546000 Cu 0.291362 0.881791 0 321 63.546 0.000153385 -3.53949 63.546000 Cu 0.357051 0.88645 0.5 323 63.546 0.000258897 -3.53962 63.546000 Cu 0.422674 0.891045 1.78585e-17 325 63.546 0.00170142 -3.53914 63.546000 Cu 0.50835 0.879359 1 328 63.546 0.000404039 -3.53936 63.546000 Cu 0.442556 0.874674 0.5 330 63.546 0.000258246 -3.53967 63.546000 Cu 0.488643 0.895791 0.5 359 63.546 0.00096241 -3.5397 63.546000 Cu 0.593993 0.867708 1.19856e-19 331 63.546 0.000109989 -3.5395 63.546000 Cu 0.640178 0.888857 1 332 63.546 0.000402289 -3.5395 63.546000 Cu 0.659921 0.872464 0.5 333 63.546 0.000416126 -3.53965 63.546000 Cu 0.574363 0.884146 0.5 334 63.546 0.000670986 -3.53968 63.546000 Cu 0.706134 0.893636 0.5 338 63.546 0.00103769 -3.53965 63.546000 Cu 0.725695 0.877159 0 335 63.546 0.000326451 -3.53954 63.546000 Cu 0.771814 0.898313 7.71871e-17 336 63.546 0.000537974 -3.53929 63.546000 Cu 0.791362 0.881791 0.5 337 63.546 0.000153385 -3.53949 63.546000 Cu 0.857051 0.88645 4.14701e-17 339 63.546 0.000258897 -3.53962 63.546000 Cu 0.942556 0.874674 1.19736e-16 310 63.546 0.000258246 -3.53967 63.546000 Cu 0.87669 0.869964 0.5 312 63.546 0.000509567 -3.53943 63.546000 Cu 0.922674 0.891045 0.5 341 63.546 0.00170142 -3.53914 63.546000 Cu 0.988643 0.895791 4.14701e-17 343 63.546 0.00096241 -3.5397 63.546000 Cu 0.0348773 0.916886 4.14701e-17 344 63.546 0.0037495 -3.53997 63.546000 Cu 0.0544681 0.900458 0.5 345 63.546 0.00139274 -3.53923 63.546000 Cu 0.120599 0.905315 1 347 63.546 0.0023254 -3.5399 63.546000 Cu 0.100504 0.921567 0.5 350 63.546 0.00476623 -3.53908 63.546000 Cu 0.0145958 0.933038 0.5 374 63.546 0.0230093 -3.53815 63.546000 Cu 0.166785 0.926549 1.15062e-17 348 63.546 0.00975026 -3.53979 63.546000 Cu 0.18629 0.910019 0.5 349 63.546 0.00144797 -3.53931 63.546000 Cu 0.252317 0.91484 0 351 63.546 0.00282299 -3.53936 63.546000 Cu 0.232349 0.931159 0.5 354 63.546 0.00723775 -3.53847 63.546000 Cu 0.337332 0.902913 1 322 63.546 0.000818593 -3.53927 63.546000 Cu 0.403048 0.907559 0.5 326 63.546 0.00117414 -3.53964 63.546000 Cu 0.317917 0.919517 0.5 353 63.546 0.00248023 -3.53892 63.546000 Cu 0.38341 0.923988 1.09908e-16 355 63.546 0.00422602 -3.53876 63.546000 Cu 0.468664 0.912074 1.71993e-16 358 63.546 0.00580112 -3.53864 63.546000 Cu 0.554468 0.900458 1.39033e-17 360 63.546 0.00139274 -3.53923 63.546000 Cu 0.534877 0.916886 0.5 363 63.546 0.0037495 -3.53997 63.546000 Cu 0.44928 0.928624 0.5 388 63.546 0.00430891 -3.53982 63.546000 Cu 0.514596 0.933038 1 389 63.546 0.0230093 -3.53815 63.546000 Cu 0.600504 0.921567 1.01158e-16 361 63.546 0.00476623 -3.53908 63.546000 Cu 0.620599 0.905315 0.5 362 63.546 0.0023254 -3.5399 63.546000 Cu 0.68629 0.910019 1.45265e-16 364 63.546 0.00144797 -3.53931 63.546000 Cu 0.666785 0.926549 0.5 367 63.546 0.00975026 -3.53979 63.546000 Cu 0.837332 0.902913 0.5 342 63.546 0.000818593 -3.53927 63.546000 Cu 0.732349 0.931159 1 365 63.546 0.00723775 -3.53847 63.546000 Cu 0.752317 0.91484 0.5 366 63.546 0.00282299 -3.53936 63.546000 Cu 0.817917 0.919517 7.5629e-17 368 63.546 0.00248023 -3.53892 63.546000 Cu 0.903048 0.907559 1 340 63.546 0.00117414 -3.53964 63.546000 Cu 0.968664 0.912074 0.5 346 63.546 0.00580112 -3.53864 63.546000 Cu 0.88341 0.923988 0.5 370 63.546 0.00422602 -3.53876 63.546000 Cu 0.94928 0.928624 4.49459e-17 372 63.546 0.00430891 -3.53982 63.546000 Cu 0.0808544 0.938094 3.93127e-17 376 63.546 0.0170153 -3.54081 63.546000 Cu 0.126923 0.959285 1 377 63.546 0.0926722 -3.53302 63.546000 Cu 0.0594186 0.954101 0.5 379 63.546 0.0755911 -3.52987 63.546000 Cu 0.146144 0.942678 0.5 378 63.546 0.019863 -3.53615 63.546000 Cu 0.213366 0.947742 7.7307e-17 380 63.546 0.0326472 -3.53634 63.546000 Cu 0.192595 0.963504 0.5 383 63.546 0.102614 -3.53194 63.546000 Cu 0.278643 0.952328 0.5 382 63.546 0.0365091 -3.53579 63.546000 Cu 0.298786 0.936122 2.0735e-17 352 63.546 0.0128526 -3.53912 63.546000 Cu 0.364466 0.940702 0.5 357 63.546 0.00611032 -3.53731 63.546000 Cu 0.346001 0.957371 3.41589e-17 384 63.546 0.0442237 -3.5358 63.546000 Cu 0.411596 0.961898 0.5 386 63.546 0.0539402 -3.5296 63.546000 Cu 0.429656 0.944969 7.16737e-17 356 63.546 0.0224641 -3.53826 63.546000 Cu 0.559419 0.954101 2.39711e-19 390 63.546 0.0755911 -3.52987 63.546000 Cu 0.495411 0.949742 0.5 392 63.546 0.023986 -3.54082 63.546000 Cu 0.474546 0.966125 1.06911e-16 414 63.546 0.123002 -3.52576 63.546000 Cu 0.580854 0.938094 0.5 391 63.546 0.0170153 -3.54081 63.546000 Cu 0.646144 0.942678 1 393 63.546 0.019863 -3.53615 63.546000 Cu 0.692595 0.963504 2.88852e-17 394 63.546 0.102614 -3.53194 63.546000 Cu 0.626923 0.959285 0.5 396 63.546 0.0926722 -3.53302 63.546000 Cu 0.713366 0.947742 0.5 395 63.546 0.0326472 -3.53634 63.546000 Cu 0.798786 0.936122 0.5 371 63.546 0.0128526 -3.53912 63.546000 Cu 0.778643 0.952328 1 397 63.546 0.0365091 -3.53579 63.546000 Cu 0.846001 0.957371 0.5 399 63.546 0.0442237 -3.5358 63.546000 Cu 0.995411 0.949742 1 373 63.546 0.023986 -3.54082 63.546000 Cu 0.864466 0.940702 2.60087e-17 369 63.546 0.00611032 -3.53731 63.546000 Cu 0.929656 0.944969 0.5 375 63.546 0.0224641 -3.53826 63.546000 Cu 0.911596 0.961898 1.19856e-19 401 63.546 0.0539402 -3.5296 63.546000 Cu 0.974546 0.966125 0.5 403 63.546 0.123002 -3.52576 63.546000 Cu 0.0394257 0.97127 1.14582e-16 405 63.546 0.217288 -3.53118 63.546000 Cu 0.090003 0.990969 1 406 63.546 3.35425 -3.40257 63.546000 Cu 0.104107 0.974574 0.5 407 63.546 0.385665 -3.50717 63.546000 Cu 0.0148929 0.987346 0.5 408 63.546 1.11241 -3.43559 63.546000 Cu 0.260874 0.969281 1.66599e-16 381 63.546 0.197635 -3.53649 63.546000 Cu 0.175638 0.979991 1 409 63.546 0.562703 -3.48404 63.546000 Cu 0.240632 0.984607 0.5 410 63.546 0.938982 -3.4539 63.546000 Cu 0.157194 0.994278 0.5 411 63.546 9.2331 -3.36399 63.546000 Cu 0.392403 0.978868 0 385 63.546 0.452344 -3.49368 63.546000 Cu 0.325754 0.973001 0.5 387 63.546 0.206263 -3.53129 63.546000 Cu 0.306529 0.990645 5.17777e-17 412 63.546 3.0908 -3.38678 63.546000 Cu 0.371285 0.994021 0.5 413 63.546 9.23724 -3.35112 63.546000 Cu 0.514893 0.987346 1 415 63.546 1.11241 -3.43559 63.546000 Cu 0.539426 0.97127 0.5 416 63.546 0.217288 -3.53118 63.546000 Cu 0.455075 0.984288 0.5 417 63.546 0.521124 -3.4377 63.546000 Cu 0.604107 0.974574 1 418 63.546 0.385665 -3.50717 63.546000 Cu 0.657194 0.994278 2.46423e-16 419 63.546 9.2331 -3.36399 63.546000 Cu 0.675638 0.979991 0.5 420 63.546 0.562703 -3.48404 63.546000 Cu 0.590003 0.990969 0.5 421 63.546 3.35425 -3.40257 63.546000 Cu 0.825754 0.973001 1.01877e-17 398 63.546 0.206263 -3.53129 63.546000 Cu 0.760874 0.969281 0.5 400 63.546 0.197635 -3.53649 63.546000 Cu 0.740632 0.984607 2.76028e-16 422 63.546 0.938982 -3.4539 63.546000 Cu 0.806529 0.990645 0.5 423 63.546 3.0908 -3.38678 63.546000 Cu 0.955075 0.984288 8.62961e-17 402 63.546 0.521124 -3.4377 63.546000 Cu 0.892403 0.978868 0.5 404 63.546 0.452344 -3.49368 63.546000 Cu 0.871285 0.994021 2.4942e-16 424 63.546 9.23724 -3.35112