Number of particles = 652 A = 1 Angstrom (basic length-scale) H0(1,1) = 23.1578 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.5964 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60905 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 0.087739 0.0072031 2.88396e-17 342 63.546 0.0215536 -3.51005 63.546000 Cu 0.0270089 0.0205164 0.5 343 63.546 0.00424615 -3.51428 63.546000 Cu 0.136851 0.0221866 0.5 357 63.546 0.0801598 -3.52005 63.546000 Cu 0.0761309 0.0351904 7.87081e-17 355 63.546 0.0175299 -3.51613 63.546000 Cu 0.197006 0.00958263 1 359 63.546 0.182709 -3.51824 63.546000 Cu 0.24508 0.0265406 0.5 362 63.546 0.022962 -3.5065 63.546000 Cu 0.305588 0.0157677 1.8193e-16 360 63.546 0.145488 -3.49861 63.546000 Cu 0.366768 0.00453934 0.5 363 63.546 0.253848 -3.51169 63.546000 Cu 0.355258 0.0312985 0.5 383 63.546 0.0685612 -3.50328 63.546000 Cu 0.416412 0.0190568 4.68643e-18 385 63.546 0.0381583 -3.50888 63.546000 Cu 0.527009 0.0205164 1.70634e-16 386 63.546 0.00424615 -3.51428 63.546000 Cu 0.477321 0.00610944 0.5 387 63.546 0.00705852 -3.51684 63.546000 Cu 0.465852 0.033566 0.5 388 63.546 0.00699607 -3.5166 63.546000 Cu 0.587739 0.0072031 0.5 389 63.546 0.0215536 -3.51005 63.546000 Cu 0.636851 0.0221866 2.1149e-17 419 63.546 0.0801598 -3.52005 63.546000 Cu 0.697006 0.00958263 0.5 421 63.546 0.182709 -3.51824 63.546000 Cu 0.576131 0.0351904 0.5 417 63.546 0.0175299 -3.51613 63.546000 Cu 0.805588 0.0157677 0.5 333 63.546 0.145488 -3.49861 63.546000 Cu 0.855258 0.0312985 1.49005e-16 337 63.546 0.0685612 -3.50328 63.546000 Cu 0.74508 0.0265406 1 420 63.546 0.022962 -3.5065 63.546000 Cu 0.866768 0.00453934 1 332 63.546 0.253848 -3.51169 63.546000 Cu 0.965852 0.033566 5.16709e-17 338 63.546 0.00699607 -3.5166 63.546000 Cu 0.916412 0.0190568 0.5 339 63.546 0.0381583 -3.50888 63.546000 Cu 0.977321 0.00610944 1 341 63.546 0.00705852 -3.51684 63.546000 Cu 0.064091 0.0630349 1 352 63.546 0.00960721 -3.51908 63.546000 Cu 0.0150918 0.0481801 0.5 353 63.546 0.00236856 -3.51665 63.546000 Cu 0.124796 0.0503415 0.5 358 63.546 0.0335101 -3.52155 63.546000 Cu 0.185152 0.038006 1 356 63.546 0.0538208 -3.51975 63.546000 Cu 0.173345 0.06599 1 377 63.546 0.0170629 -3.52048 63.546000 Cu 0.282737 0.0701036 2.33481e-16 378 63.546 0.0101155 -3.51229 63.546000 Cu 0.23362 0.0542438 0.5 379 63.546 0.00640561 -3.51427 63.546000 Cu 0.294169 0.0428694 1 381 63.546 0.0362778 -3.50721 63.546000 Cu 0.404652 0.0461939 4.02553e-17 382 63.546 0.0201938 -3.51249 63.546000 Cu 0.343559 0.0583079 0.5 384 63.546 0.0212871 -3.51015 63.546000 Cu 0.453986 0.0609663 0.5 413 63.546 0.00526832 -3.51622 63.546000 Cu 0.515092 0.0481801 4.68643e-18 415 63.546 0.00236856 -3.51665 63.546000 Cu 0.564091 0.0630349 0.5 418 63.546 0.00960721 -3.51908 63.546000 Cu 0.624796 0.0503415 4.68643e-18 416 63.546 0.0335101 -3.52155 63.546000 Cu 0.685152 0.038006 0.5 422 63.546 0.0538208 -3.51975 63.546000 Cu 0.673345 0.06599 0.5 453 63.546 0.0170629 -3.52048 63.546000 Cu 0.843559 0.0583079 4.68643e-18 334 63.546 0.0212871 -3.51015 63.546000 Cu 0.794169 0.0428694 0.5 335 63.546 0.0362778 -3.50721 63.546000 Cu 0.782737 0.0701036 0.5 336 63.546 0.0101155 -3.51229 63.546000 Cu 0.73362 0.0542438 1.03342e-16 455 63.546 0.00640561 -3.51427 63.546000 Cu 0.904652 0.0461939 0.5 340 63.546 0.0201938 -3.51249 63.546000 Cu 0.953986 0.0609663 4.68643e-18 351 63.546 0.00526832 -3.51622 63.546000 Cu 0.0521659 0.0907755 9.8295e-17 373 63.546 0.00408687 -3.5197 63.546000 Cu 0.11288 0.0782523 0.5 375 63.546 0.0129866 -3.5213 63.546000 Cu 0.100931 0.106015 0.5 376 63.546 0.00445593 -3.52026 63.546000 Cu 0.00317823 0.0757716 0.5 354 63.546 0.00139829 -3.5178 63.546000 Cu 0.161575 0.0937618 1.32782e-16 374 63.546 0.00569374 -3.51994 63.546000 Cu 0.222099 0.0818111 0.5 380 63.546 0.00229962 -3.51671 63.546000 Cu 0.27111 0.0974197 1 407 63.546 0.00264382 -3.51504 63.546000 Cu 0.381153 0.100676 1 408 63.546 0.00417723 -3.51568 63.546000 Cu 0.331984 0.0854977 0.5 409 63.546 0.00742934 -3.51362 63.546000 Cu 0.392929 0.0733956 1.36147e-16 411 63.546 0.00939557 -3.51438 63.546000 Cu 0.503178 0.0757716 1 412 63.546 0.00139829 -3.5178 63.546000 Cu 0.442178 0.0883555 0.5 414 63.546 0.00291059 -3.51649 63.546000 Cu 0.491245 0.103325 4.68643e-18 447 63.546 0.000737559 -3.51806 63.546000 Cu 0.552166 0.0907755 0.5 449 63.546 0.00408687 -3.5197 63.546000 Cu 0.600931 0.106015 1.50326e-16 448 63.546 0.00445593 -3.52026 63.546000 Cu 0.61288 0.0782523 2.64363e-18 451 63.546 0.0129866 -3.5213 63.546000 Cu 0.661575 0.0937618 0.5 454 63.546 0.00569374 -3.51994 63.546000 Cu 0.77111 0.0974197 0.5 345 63.546 0.00264382 -3.51504 63.546000 Cu 0.831984 0.0854977 4.68643e-18 347 63.546 0.00742934 -3.51362 63.546000 Cu 0.722099 0.0818111 2.89598e-17 452 63.546 0.00229962 -3.51671 63.546000 Cu 0.942178 0.0883555 2.4033e-19 348 63.546 0.00291059 -3.51649 63.546000 Cu 0.892929 0.0733956 0.5 349 63.546 0.00939557 -3.51438 63.546000 Cu 0.881153 0.100676 0.5 350 63.546 0.00417723 -3.51568 63.546000 Cu 0.991245 0.103325 0.5 371 63.546 0.000737559 -3.51806 63.546000 Cu 0.0400838 0.11842 1 370 63.546 0.00155406 -3.51929 63.546000 Cu 0.0887121 0.133661 0.5 401 63.546 0.00141806 -3.5194 63.546000 Cu 0.149582 0.12141 4.68643e-18 403 63.546 0.00200998 -3.5192 63.546000 Cu 0.25915 0.124791 7.24595e-17 404 63.546 0.000656209 -3.51638 63.546000 Cu 0.210329 0.109335 0.5 405 63.546 0.000975311 -3.51751 63.546000 Cu 0.198219 0.136835 0.5 406 63.546 0.000424909 -3.51784 63.546000 Cu 0.320132 0.112784 0.5 410 63.546 0.00260404 -3.51549 63.546000 Cu 0.307949 0.140124 0.5 441 63.546 0.000752566 -3.51638 63.546000 Cu 0.369061 0.128007 2.80225e-16 443 63.546 0.00173985 -3.51643 63.546000 Cu 0.430211 0.115756 0.5 445 63.546 0.00154671 -3.51705 63.546000 Cu 0.479042 0.130836 1.40233e-16 444 63.546 0.000425533 -3.51819 63.546000 Cu 0.540084 0.11842 0.5 450 63.546 0.00155406 -3.51929 63.546000 Cu 0.588712 0.133661 1 483 63.546 0.00141806 -3.5194 63.546000 Cu 0.698219 0.136835 1 484 63.546 0.000424909 -3.51784 63.546000 Cu 0.649582 0.12141 0.5 485 63.546 0.00200998 -3.5192 63.546000 Cu 0.710329 0.109335 1 487 63.546 0.000975311 -3.51751 63.546000 Cu 0.820132 0.112784 1 344 63.546 0.00260404 -3.51549 63.546000 Cu 0.75915 0.124791 0.5 346 63.546 0.000656209 -3.51638 63.546000 Cu 0.807949 0.140124 1 365 63.546 0.000752566 -3.51638 63.546000 Cu 0.869061 0.128007 0.5 367 63.546 0.00173985 -3.51643 63.546000 Cu 0.930211 0.115756 1 369 63.546 0.00154671 -3.51705 63.546000 Cu 0.979042 0.130836 0.5 372 63.546 0.000425533 -3.51819 63.546000 Cu 0.0149946 0.173513 1.33744e-16 396 63.546 0.000152902 -3.51854 63.546000 Cu 0.0276536 0.145992 1 399 63.546 0.000388184 -3.51891 63.546000 Cu 0.137241 0.148974 6.24858e-18 400 63.546 0.000769534 -3.51874 63.546000 Cu 0.0761779 0.161221 0.5 402 63.546 0.000458214 -3.51889 63.546000 Cu 0.12466 0.176485 8.67591e-17 435 63.546 0.000444713 -3.5183 63.546000 Cu 0.185798 0.164307 0.5 437 63.546 0.000282198 -3.51807 63.546000 Cu 0.246862 0.152199 1.42155e-16 439 63.546 0.00017135 -3.51722 63.546000 Cu 0.356674 0.155373 1 440 63.546 0.000629913 -3.51691 63.546000 Cu 0.295508 0.167501 0.5 442 63.546 0.000257674 -3.51707 63.546000 Cu 0.41786 0.143164 0.5 446 63.546 0.000686229 -3.51742 63.546000 Cu 0.40528 0.17059 0.5 477 63.546 0.000514743 -3.51762 63.546000 Cu 0.466497 0.158325 1.21006e-16 479 63.546 0.00019756 -3.5183 63.546000 Cu 0.527654 0.145992 0.5 481 63.546 0.000388184 -3.51891 63.546000 Cu 0.514995 0.173513 0.5 482 63.546 0.000152902 -3.51854 63.546000 Cu 0.576178 0.161221 1 480 63.546 0.000458214 -3.51889 63.546000 Cu 0.637241 0.148974 0.5 486 63.546 0.000769534 -3.51874 63.546000 Cu 0.62466 0.176485 0.5 517 63.546 0.000444713 -3.5183 63.546000 Cu 0.685798 0.164307 1 519 63.546 0.000282198 -3.51807 63.546000 Cu 0.795508 0.167501 1.44198e-18 364 63.546 0.000257674 -3.51707 63.546000 Cu 0.856674 0.155373 0.5 368 63.546 0.000629913 -3.51691 63.546000 Cu 0.746862 0.152199 0.5 520 63.546 0.00017135 -3.51722 63.546000 Cu 0.91786 0.143164 1 366 63.546 0.000686229 -3.51742 63.546000 Cu 0.90528 0.17059 1 395 63.546 0.000514743 -3.51762 63.546000 Cu 0.966497 0.158325 0.5 397 63.546 0.00019756 -3.5183 63.546000 Cu 0.111666 0.20395 1 432 63.546 0.000230371 -3.51775 63.546000 Cu 0.0633553 0.188722 0.5 433 63.546 0.000212289 -3.51834 63.546000 Cu 0.00196013 0.201007 1 431 63.546 2.50949e-05 -3.51848 63.546000 Cu 0.234293 0.179619 4.68643e-18 436 63.546 0.00014651 -3.51737 63.546000 Cu 0.17301 0.191757 0.5 438 63.546 0.000203097 -3.51757 63.546000 Cu 0.221318 0.207033 1.72557e-16 471 63.546 6.00046e-05 -3.5173 63.546000 Cu 0.282627 0.194902 0.5 473 63.546 1.32054e-05 -3.51722 63.546000 Cu 0.330944 0.210191 4.68643e-18 472 63.546 7.28444e-05 -3.51761 63.546000 Cu 0.343992 0.182768 1.57656e-16 475 63.546 0.000270526 -3.51729 63.546000 Cu 0.392293 0.198031 0.5 478 63.546 0.000300806 -3.51792 63.546000 Cu 0.453672 0.1858 3.94742e-16 476 63.546 0.000218428 -3.51828 63.546000 Cu 0.440564 0.21328 1.49365e-16 511 63.546 0.000383248 -3.51844 63.546000 Cu 0.50196 0.201007 0.5 513 63.546 2.50949e-05 -3.51848 63.546000 Cu 0.563355 0.188722 1.90702e-16 515 63.546 0.000212289 -3.51834 63.546000 Cu 0.67301 0.191757 1 516 63.546 0.000203097 -3.51757 63.546000 Cu 0.611666 0.20395 0.5 518 63.546 0.000230371 -3.51775 63.546000 Cu 0.782627 0.194902 1 391 63.546 1.32054e-05 -3.51722 63.546000 Cu 0.843992 0.182768 0.5 393 63.546 0.000270526 -3.51729 63.546000 Cu 0.830944 0.210191 0.5 394 63.546 7.28444e-05 -3.51761 63.546000 Cu 0.734293 0.179619 0.5 521 63.546 0.00014651 -3.51737 63.546000 Cu 0.721318 0.207033 0.5 552 63.546 6.00046e-05 -3.5173 63.546000 Cu 0.892293 0.198031 2.75779e-16 392 63.546 0.000300806 -3.51792 63.546000 Cu 0.953672 0.1858 0.5 398 63.546 0.000218428 -3.51828 63.546000 Cu 0.940564 0.21328 0.5 429 63.546 0.000383248 -3.51844 63.546000 Cu 0.0502694 0.216191 0.5 434 63.546 0.000115008 -3.51806 63.546000 Cu 0.0372379 0.243659 0.5 465 63.546 0.000142288 -3.51811 63.546000 Cu 0.0985958 0.231376 5.80397e-17 467 63.546 0.000456603 -3.51761 63.546000 Cu 0.208365 0.234438 4.8066e-19 468 63.546 0.000226867 -3.5172 63.546000 Cu 0.159974 0.219181 0.5 469 63.546 0.00026079 -3.51737 63.546000 Cu 0.147054 0.246578 0.5 470 63.546 0.000639607 -3.51709 63.546000 Cu 0.269667 0.222319 0.5 474 63.546 3.98997e-05 -3.5174 63.546000 Cu 0.256836 0.249728 0.5 505 63.546 0.000254804 -3.51712 63.546000 Cu 0.317993 0.237631 4.68643e-18 507 63.546 0.000126883 -3.51781 63.546000 Cu 0.427554 0.240773 4.68643e-18 508 63.546 0.000840917 -3.51865 63.546000 Cu 0.37924 0.225489 0.5 509 63.546 0.000351374 -3.51822 63.546000 Cu 0.550269 0.216191 1.56214e-17 512 63.546 0.000115008 -3.51806 63.546000 Cu 0.488871 0.228491 0.5 514 63.546 0.000190488 -3.51852 63.546000 Cu 0.537238 0.243659 1 547 63.546 0.000142288 -3.51811 63.546000 Cu 0.647054 0.246578 1 548 63.546 0.000639607 -3.51709 63.546000 Cu 0.598596 0.231376 0.5 549 63.546 0.000456603 -3.51761 63.546000 Cu 0.659974 0.219181 3.00412e-17 551 63.546 0.00026079 -3.51737 63.546000 Cu 0.708365 0.234438 0.5 553 63.546 0.000226867 -3.5172 63.546000 Cu 0.769667 0.222319 1 390 63.546 3.98997e-05 -3.5174 63.546000 Cu 0.817993 0.237631 0.5 425 63.546 0.000126883 -3.51781 63.546000 Cu 0.756836 0.249728 6.27261e-17 423 63.546 0.000254804 -3.51712 63.546000 Cu 0.87924 0.225489 9.04842e-17 427 63.546 0.000351374 -3.51822 63.546000 Cu 0.988871 0.228491 1.5261e-16 428 63.546 0.000190488 -3.51852 63.546000 Cu 0.927554 0.240773 0.5 430 63.546 0.000840917 -3.51865 63.546000 Cu 0.0857562 0.258793 1 464 63.546 0.00069416 -3.51751 63.546000 Cu 0.0244668 0.271123 0.5 466 63.546 0.000337157 -3.51821 63.546000 Cu 0.13442 0.273939 0.5 501 63.546 0.00153328 -3.5165 63.546000 Cu 0.19564 0.261809 1 503 63.546 0.000862046 -3.51653 63.546000 Cu 0.244257 0.277123 0.5 506 63.546 0.000832728 -3.51669 63.546000 Cu 0.305307 0.265095 7.34208e-17 504 63.546 0.00034357 -3.51814 63.546000 Cu 0.366366 0.252972 0.5 510 63.546 0.000669895 -3.51869 63.546000 Cu 0.353827 0.280521 0.5 541 63.546 0.00195957 -3.51933 63.546000 Cu 0.4148 0.2683 1 543 63.546 0.00173033 -3.51923 63.546000 Cu 0.524467 0.271123 1 544 63.546 0.000337157 -3.51821 63.546000 Cu 0.475945 0.255989 0.5 545 63.546 0.000645105 -3.51862 63.546000 Cu 0.463333 0.283521 0.5 546 63.546 0.00143588 -3.5191 63.546000 Cu 0.585756 0.258793 0.5 550 63.546 0.00069416 -3.51751 63.546000 Cu 0.63442 0.273939 1 583 63.546 0.00153328 -3.5165 63.546000 Cu 0.69564 0.261809 0.5 585 63.546 0.000862046 -3.51653 63.546000 Cu 0.805307 0.265095 0.5 426 63.546 0.00034357 -3.51814 63.546000 Cu 0.853827 0.280521 0 459 63.546 0.00195957 -3.51933 63.546000 Cu 0.744257 0.277123 1 584 63.546 0.000832728 -3.51669 63.546000 Cu 0.866366 0.252972 4.68643e-18 424 63.546 0.000669895 -3.51869 63.546000 Cu 0.963333 0.283521 1.34465e-16 460 63.546 0.00143588 -3.5191 63.546000 Cu 0.9148 0.2683 0.5 461 63.546 0.00173033 -3.51923 63.546000 Cu 0.975945 0.255989 1 463 63.546 0.000645105 -3.51862 63.546000 Cu 0.0607548 0.313565 1 496 63.546 0.00258008 -3.51604 63.546000 Cu 0.0120165 0.298605 0.5 497 63.546 0.000566522 -3.51799 63.546000 Cu 0.0732164 0.286191 8.63986e-17 499 63.546 0.00115218 -3.51704 63.546000 Cu 0.122051 0.301259 0.5 502 63.546 0.00368367 -3.51547 63.546000 Cu 0.183201 0.289141 1 500 63.546 0.00263394 -3.51559 63.546000 Cu 0.170928 0.316414 1 535 63.546 0.00717134 -3.51382 63.546000 Cu 0.280702 0.32007 2.23507e-16 536 63.546 0.00200618 -3.51719 63.546000 Cu 0.232013 0.30449 0.5 537 63.546 0.00253704 -3.51546 63.546000 Cu 0.292945 0.292574 2.4033e-19 539 63.546 0.00072219 -3.51786 63.546000 Cu 0.402336 0.295891 1 540 63.546 0.00394067 -3.52021 63.546000 Cu 0.341463 0.308125 0.5 542 63.546 0.0051764 -3.51994 63.546000 Cu 0.450845 0.311124 0.5 577 63.546 0.00399526 -3.51945 63.546000 Cu 0.512017 0.298605 2.45858e-16 579 63.546 0.000566522 -3.51799 63.546000 Cu 0.560755 0.313565 0.5 582 63.546 0.00258008 -3.51604 63.546000 Cu 0.573216 0.286191 0.5 581 63.546 0.00115218 -3.51704 63.546000 Cu 0.622051 0.301259 9.22867e-17 580 63.546 0.00368367 -3.51547 63.546000 Cu 0.683201 0.289141 0.5 586 63.546 0.00263394 -3.51559 63.546000 Cu 0.670928 0.316414 0.5 615 63.546 0.00717134 -3.51382 63.546000 Cu 0.841463 0.308125 2.49943e-17 456 63.546 0.0051764 -3.51994 63.546000 Cu 0.792945 0.292574 0.5 457 63.546 0.00072219 -3.51786 63.546000 Cu 0.780702 0.32007 0.5 458 63.546 0.00200618 -3.51719 63.546000 Cu 0.732013 0.30449 4.78257e-17 617 63.546 0.00253704 -3.51546 63.546000 Cu 0.902336 0.295891 0.5 462 63.546 0.00394067 -3.52021 63.546000 Cu 0.950845 0.311124 1 495 63.546 0.00399526 -3.51945 63.546000 Cu 0.0484451 0.340915 2.4033e-19 531 63.546 0.00516771 -3.51576 63.546000 Cu 0.10974 0.328504 0.5 533 63.546 0.00928303 -3.51421 63.546000 Cu 0.0974538 0.355677 0.5 534 63.546 0.0209849 -3.51184 63.546000 Cu 0.158835 0.34359 1 532 63.546 0.0205251 -3.51025 63.546000 Cu 0.219883 0.3318 0.5 538 63.546 0.00920857 -3.51301 63.546000 Cu 0.268649 0.347641 5.10701e-17 571 63.546 0.0065112 -3.51525 63.546000 Cu 0.377345 0.351492 1.00818e-16 572 63.546 0.0306943 -3.52144 63.546000 Cu 0.329145 0.335861 0.5 573 63.546 0.0151683 -3.5207 63.546000 Cu 0.389863 0.323609 5.10701e-17 575 63.546 0.0117392 -3.5211 63.546000 Cu 0.499506 0.326115 1.41915e-16 576 63.546 0.00148158 -3.5175 63.546000 Cu 0.438331 0.338825 0.5 578 63.546 0.00950874 -3.519 63.546000 Cu 0.487043 0.35368 2.68809e-16 609 63.546 0.00243115 -3.51644 63.546000 Cu 0.548445 0.340915 0.5 611 63.546 0.00516771 -3.51576 63.546000 Cu 0.597454 0.355677 5.52759e-18 610 63.546 0.0209849 -3.51184 63.546000 Cu 0.60974 0.328504 7.63048e-17 613 63.546 0.00928303 -3.51421 63.546000 Cu 0.658835 0.34359 0.5 616 63.546 0.0205251 -3.51025 63.546000 Cu 0.768649 0.347641 0.5 489 63.546 0.0065112 -3.51525 63.546000 Cu 0.829145 0.335861 4.68643e-18 491 63.546 0.0151683 -3.5207 63.546000 Cu 0.719883 0.3318 1.21126e-16 614 63.546 0.00920857 -3.51301 63.546000 Cu 0.938331 0.338825 6.03228e-17 492 63.546 0.00950874 -3.519 63.546000 Cu 0.889863 0.323609 0.5 493 63.546 0.0117392 -3.5211 63.546000 Cu 0.877345 0.351492 0.5 494 63.546 0.0306943 -3.52144 63.546000 Cu 0.999506 0.326115 0.5 498 63.546 0.00148158 -3.5175 63.546000 Cu 0.987043 0.35368 0.5 529 63.546 0.00243115 -3.51644 63.546000 Cu 0.0359653 0.368289 1.56815e-16 528 63.546 0.0071683 -3.51618 63.546000 Cu 0.0851113 0.382783 0.5 565 63.546 0.0413193 -3.50813 63.546000 Cu 0.146555 0.370588 1.15839e-16 567 63.546 0.0665655 -3.50297 63.546000 Cu 0.256599 0.375339 9.67328e-17 568 63.546 0.0222237 -3.50813 63.546000 Cu 0.20783 0.359031 0.5 569 63.546 0.0329431 -3.50782 63.546000 Cu 0.195954 0.386139 0.5 570 63.546 0.130152 -3.49936 63.546000 Cu 0.316714 0.363833 0.5 574 63.546 0.0502855 -3.52043 63.546000 Cu 0.30438 0.392236 0.5 603 63.546 0.175776 -3.51827 63.546000 Cu 0.364739 0.379634 4.81862e-17 605 63.546 0.0764201 -3.52001 63.546000 Cu 0.425696 0.366648 0.5 607 63.546 0.0175126 -3.51597 63.546000 Cu 0.47455 0.381317 1 606 63.546 0.00410851 -3.51381 63.546000 Cu 0.535965 0.368289 0.5 612 63.546 0.0071683 -3.51618 63.546000 Cu 0.585111 0.382783 1 635 63.546 0.0413193 -3.50813 63.546000 Cu 0.695954 0.386139 1 636 63.546 0.130152 -3.49936 63.546000 Cu 0.646555 0.370588 0.5 637 63.546 0.0665655 -3.50297 63.546000 Cu 0.70783 0.359031 9.93764e-17 639 63.546 0.0329431 -3.50782 63.546000 Cu 0.816714 0.363833 1 488 63.546 0.0502855 -3.52043 63.546000 Cu 0.756599 0.375339 0.5 490 63.546 0.0222237 -3.50813 63.546000 Cu 0.80438 0.392236 2.4033e-18 523 63.546 0.175776 -3.51827 63.546000 Cu 0.864739 0.379634 0.5 525 63.546 0.0764201 -3.52001 63.546000 Cu 0.925696 0.366648 1 527 63.546 0.0175126 -3.51597 63.546000 Cu 0.97455 0.381317 0.5 530 63.546 0.00410851 -3.51381 63.546000 Cu 0.0132268 0.423244 1.3831e-16 560 63.546 0.0210495 -3.5163 63.546000 Cu 0.0239233 0.395729 4.68643e-18 563 63.546 0.00678154 -3.51619 63.546000 Cu 0.134419 0.397298 9.45698e-17 564 63.546 0.259274 -3.51064 63.546000 Cu 0.0740134 0.409957 0.5 566 63.546 0.0517244 -3.51671 63.546000 Cu 0.124141 0.424058 1.3098e-16 597 63.546 0.89844 -3.50585 63.546000 Cu 0.185498 0.413072 0.5 599 63.546 0.853569 -3.43732 63.546000 Cu 0.245573 0.403531 1.1644e-16 601 63.546 0.170198 -3.44822 63.546000 Cu 0.352913 0.408089 7.79871e-17 602 63.546 0.145967 -3.504 63.546000 Cu 0.291834 0.421431 0.5 604 63.546 0.636358 -3.53122 63.546000 Cu 0.413518 0.394608 0.5 608 63.546 0.0207105 -3.50965 63.546000 Cu 0.402408 0.422691 0.5 629 63.546 0.0330377 -3.50483 63.546000 Cu 0.463025 0.409081 1 631 63.546 0.00709838 -3.51335 63.546000 Cu 0.523923 0.395729 0.5 633 63.546 0.00678154 -3.51619 63.546000 Cu 0.513227 0.423244 0.5 634 63.546 0.0210495 -3.5163 63.546000 Cu 0.574013 0.409957 1 632 63.546 0.0517244 -3.51671 63.546000 Cu 0.634419 0.397298 0.5 638 63.546 0.259274 -3.51064 63.546000 Cu 0.624141 0.424058 0.5 650 63.546 0.89844 -3.50585 63.546000 Cu 0.685498 0.413072 3.60495e-19 652 63.546 0.853569 -3.43732 63.546000 Cu 0.745573 0.403531 0.5 330 63.546 0.170198 -3.44822 63.546000 Cu 0.791834 0.421431 1.77844e-17 522 63.546 0.636358 -3.53122 63.546000 Cu 0.852913 0.408089 0.5 526 63.546 0.145967 -3.504 63.546000 Cu 0.913518 0.394608 1 524 63.546 0.0207105 -3.50965 63.546000 Cu 0.902408 0.422691 6.17648e-17 559 63.546 0.0330377 -3.50483 63.546000 Cu 0.963025 0.409081 0.5 561 63.546 0.00709838 -3.51335 63.546000 Cu 0.118176 0.450874 1.13796e-16 594 63.546 2.54122 -3.4836 63.546000 Cu 0.0645077 0.437214 0.5 595 63.546 0.0764273 -3.52841 63.546000 Cu 0.00750684 0.450869 1.19925e-16 593 63.546 0.0758729 -3.51795 63.546000 Cu 0.235371 0.434518 1.55013e-17 598 63.546 2.44936 -3.37709 63.546000 Cu 0.174392 0.438784 0.5 600 63.546 5.85862 -3.18824 63.546000 Cu 0.284276 0.45104 0.5 625 63.546 1.81376 -3.57342 63.546000 Cu 0.173938 0.463122 0.5 621 63.546 5.84549 -3.18749 63.546000 Cu 0.343929 0.43669 4.68643e-18 627 63.546 0.0930718 -3.48756 63.546000 Cu 0.39652 0.450919 0.5 630 63.546 0.104058 -3.50572 63.546000 Cu 0.453902 0.436942 1 628 63.546 0.0518587 -3.51557 63.546000 Cu 0.507507 0.450869 0.5 646 63.546 0.0758729 -3.51795 63.546000 Cu 0.564508 0.437214 1 648 63.546 0.0764273 -3.52841 63.546000 Cu 0.674392 0.438784 4.68643e-18 649 63.546 5.85862 -3.18824 63.546000 Cu 0.618176 0.450874 0.5 651 63.546 2.54122 -3.4836 63.546000 Cu 0.673938 0.463122 6.00825e-19 58 63.546 5.84549 -3.18749 63.546000 Cu 0.735371 0.434518 0.5 328 63.546 2.44936 -3.37709 63.546000 Cu 0.784276 0.45104 4.68643e-18 555 63.546 1.81376 -3.57342 63.546000 Cu 0.843929 0.43669 0.5 557 63.546 0.0930718 -3.48756 63.546000 Cu 0.89652 0.450919 2.42493e-16 556 63.546 0.104058 -3.50572 63.546000 Cu 0.953902 0.436942 0.5 562 63.546 0.0518587 -3.51557 63.546000 Cu 0.0638734 0.464513 0.5 596 63.546 0.0714637 -3.52911 63.546000 Cu 0.0721849 0.491755 0.5 618 63.546 0.0416904 -3.51713 63.546000 Cu 0.122907 0.477757 4.68643e-18 619 63.546 0.876615 -3.50696 63.546000 Cu 0.0119879 0.478477 4.68643e-18 590 63.546 0.0219895 -3.51715 63.546000 Cu 0.23464 0.467532 3.98948e-17 623 63.546 2.33089 -3.37683 63.546000 Cu 0.243572 0.498474 8.68793e-17 620 63.546 0.153593 -3.44718 63.546000 Cu 0.183894 0.488852 0.5 622 63.546 0.866176 -3.43731 63.546000 Cu 0.343391 0.465217 1.21246e-16 624 63.546 0.0930302 -3.48934 63.546000 Cu 0.290705 0.480578 0.5 626 63.546 0.588694 -3.532 63.546000 Cu 0.351275 0.493834 2.19782e-16 641 63.546 0.138971 -3.50586 63.546000 Cu 0.40127 0.47914 0.5 643 63.546 0.0348048 -3.50627 63.546000 Cu 0.45338 0.464827 1.78205e-16 644 63.546 0.0489094 -3.5163 63.546000 Cu 0.461251 0.492688 1 642 63.546 0.00867299 -3.51455 63.546000 Cu 0.563873 0.464513 1 645 63.546 0.0714637 -3.52911 63.546000 Cu 0.511988 0.478477 0.5 647 63.546 0.0219895 -3.51715 63.546000 Cu 0.572185 0.491755 1 323 63.546 0.0416904 -3.51713 63.546000 Cu 0.622907 0.477757 0.5 60 63.546 0.876615 -3.50696 63.546000 Cu 0.683894 0.488852 1 303 63.546 0.866176 -3.43731 63.546000 Cu 0.73464 0.467532 0.5 16 63.546 2.33089 -3.37683 63.546000 Cu 0.843391 0.465217 0.5 558 63.546 0.0930302 -3.48934 63.546000 Cu 0.743572 0.498474 0.5 14 63.546 0.153593 -3.44718 63.546000 Cu 0.790705 0.480578 1.57416e-17 554 63.546 0.588694 -3.532 63.546000 Cu 0.851275 0.493834 0.5 588 63.546 0.138971 -3.50586 63.546000 Cu 0.95338 0.464827 0.5 591 63.546 0.0489094 -3.5163 63.546000 Cu 0.90127 0.47914 4.68643e-18 589 63.546 0.0348048 -3.50627 63.546000 Cu 0.961251 0.492688 0.5 592 63.546 0.00867299 -3.51455 63.546000 Cu 0.132201 0.504488 1 1 63.546 0.241321 -3.51061 63.546000 Cu 0.0216388 0.505998 1 4 63.546 0.00559218 -3.5171 63.546000 Cu 0.0327447 0.533453 4.68643e-18 5 63.546 0.00504989 -3.51698 63.546000 Cu 0.0823613 0.518944 0.5 6 63.546 0.0324428 -3.50895 63.546000 Cu 0.193377 0.515774 0.5 2 63.546 0.136468 -3.49946 63.546000 Cu 0.143442 0.531233 3.83326e-17 8 63.546 0.0619746 -3.50352 63.546000 Cu 0.25373 0.526648 9.60118e-17 59 63.546 0.0198723 -3.50699 63.546000 Cu 0.302152 0.509739 0.5 640 63.546 0.160381 -3.51783 63.546000 Cu 0.411321 0.507231 0.5 34 63.546 0.0214498 -3.51092 63.546000 Cu 0.362126 0.522289 8.20727e-17 61 63.546 0.0695665 -3.52068 63.546000 Cu 0.422563 0.535208 0.5 63 63.546 0.01635 -3.51703 63.546000 Cu 0.471843 0.520448 3.64941e-16 32 63.546 0.0047844 -3.51497 63.546000 Cu 0.521639 0.505998 0.5 33 63.546 0.00559218 -3.5171 63.546000 Cu 0.532745 0.533453 0.5 38 63.546 0.00504989 -3.51698 63.546000 Cu 0.693377 0.515774 1 13 63.546 0.136468 -3.49946 63.546000 Cu 0.632201 0.504488 0.5 15 63.546 0.241321 -3.51061 63.546000 Cu 0.582361 0.518944 1 35 63.546 0.0324428 -3.50895 63.546000 Cu 0.643442 0.531233 0.5 37 63.546 0.0619746 -3.50352 63.546000 Cu 0.75373 0.526648 0.5 19 63.546 0.0198723 -3.50699 63.546000 Cu 0.802152 0.509739 1 587 63.546 0.160381 -3.51783 63.546000 Cu 0.911321 0.507231 2.43454e-16 3 63.546 0.0214498 -3.51092 63.546000 Cu 0.971843 0.520448 0.5 7 63.546 0.0047844 -3.51497 63.546000 Cu 0.862126 0.522289 0.5 18 63.546 0.0695665 -3.52068 63.546000 Cu 0.922563 0.535208 4.68643e-18 20 63.546 0.01635 -3.51703 63.546000 Cu 0.0937863 0.546083 0.5 11 63.546 0.0158013 -3.51231 63.546000 Cu 0.0443997 0.560844 1.0935e-16 24 63.546 0.00332758 -3.51632 63.546000 Cu 0.154844 0.558239 3.60495e-19 9 63.546 0.0182129 -3.51046 63.546000 Cu 0.204356 0.542893 0.5 10 63.546 0.0377759 -3.50784 63.546000 Cu 0.215695 0.570115 0.5 12 63.546 0.0115375 -3.51257 63.546000 Cu 0.26488 0.554323 1 92 63.546 0.00599188 -3.51461 63.546000 Cu 0.373769 0.550419 7.82274e-17 62 63.546 0.0278472 -3.52168 63.546000 Cu 0.31356 0.538114 0.5 64 63.546 0.0463345 -3.51973 63.546000 Cu 0.325091 0.566072 0.5 94 63.546 0.0135461 -3.5203 63.546000 Cu 0.483411 0.548106 4.68643e-18 65 63.546 0.0029992 -3.51735 63.546000 Cu 0.5444 0.560844 0.5 67 63.546 0.00332758 -3.51632 63.546000 Cu 0.434349 0.563043 0.5 68 63.546 0.00821247 -3.51951 63.546000 Cu 0.593786 0.546083 7.2099e-19 36 63.546 0.0158013 -3.51231 63.546000 Cu 0.704356 0.542893 1.10552e-17 39 63.546 0.0377759 -3.50784 63.546000 Cu 0.654844 0.558239 0.5 42 63.546 0.0182129 -3.51046 63.546000 Cu 0.81356 0.538114 1.20165e-19 17 63.546 0.0463345 -3.51973 63.546000 Cu 0.715695 0.570115 1 40 63.546 0.0115375 -3.51257 63.546000 Cu 0.76488 0.554323 0.5 41 63.546 0.00599188 -3.51461 63.546000 Cu 0.825091 0.566072 1.20165e-19 43 63.546 0.0135461 -3.5203 63.546000 Cu 0.934349 0.563043 6.2606e-17 21 63.546 0.00821247 -3.51951 63.546000 Cu 0.983411 0.548106 0.5 22 63.546 0.0029992 -3.51735 63.546000 Cu 0.873769 0.550419 0.5 23 63.546 0.0278472 -3.52168 63.546000 Cu 0.0562904 0.58822 1.56815e-16 25 63.546 0.00165914 -3.51682 63.546000 Cu 0.10547 0.573274 0.5 26 63.546 0.00634591 -3.51461 63.546000 Cu 0.117482 0.60055 0.5 31 63.546 0.00256982 -3.51588 63.546000 Cu 0.00741579 0.603215 0.5 49 63.546 0.000831287 -3.51819 63.546000 Cu 0.16649 0.585426 5.76792e-18 28 63.546 0.00641087 -3.51399 63.546000 Cu 0.227464 0.597418 0.5 30 63.546 0.00342833 -3.51523 63.546000 Cu 0.276322 0.581868 1 93 63.546 0.00205135 -3.51671 63.546000 Cu 0.38555 0.578288 5.33533e-17 95 63.546 0.0110128 -3.52109 63.546000 Cu 0.397764 0.605991 1 96 63.546 0.00414532 -3.51992 63.546000 Cu 0.336975 0.5938 0.5 98 63.546 0.00415364 -3.51972 63.546000 Cu 0.495209 0.57569 1.51168e-16 66 63.546 0.00170057 -3.51823 63.546000 Cu 0.55629 0.58822 0.5 72 63.546 0.00165914 -3.51682 63.546000 Cu 0.446338 0.590738 0.5 97 63.546 0.00386607 -3.51954 63.546000 Cu 0.507416 0.603215 2.21224e-16 99 63.546 0.000831287 -3.51819 63.546000 Cu 0.60547 0.573274 3.60495e-19 69 63.546 0.00634591 -3.51461 63.546000 Cu 0.617482 0.60055 2.4033e-19 70 63.546 0.00256982 -3.51588 63.546000 Cu 0.66649 0.585426 0.5 71 63.546 0.00641087 -3.51399 63.546000 Cu 0.836975 0.5938 1 44 63.546 0.00415364 -3.51972 63.546000 Cu 0.776322 0.581868 0.5 46 63.546 0.00205135 -3.51671 63.546000 Cu 0.727464 0.597418 1 73 63.546 0.00342833 -3.51523 63.546000 Cu 0.995209 0.57569 0.5 27 63.546 0.00170057 -3.51823 63.546000 Cu 0.88555 0.578288 0.5 45 63.546 0.0110128 -3.52109 63.546000 Cu 0.946338 0.590738 8.39953e-17 47 63.546 0.00386607 -3.51954 63.546000 Cu 0.897764 0.605991 0.5 50 63.546 0.00414532 -3.51992 63.546000 Cu 0.0686822 0.615607 1.36748e-16 51 63.546 0.00057349 -3.51703 63.546000 Cu 0.129915 0.627888 0.5 53 63.546 0.00105821 -3.51657 63.546000 Cu 0.0200799 0.630708 0.5 54 63.546 0.000219931 -3.51819 63.546000 Cu 0.178644 0.612719 4.68643e-18 29 63.546 0.00259671 -3.51574 63.546000 Cu 0.191192 0.640061 1.20165e-16 55 63.546 0.000996787 -3.51681 63.546000 Cu 0.239777 0.624774 0.5 127 63.546 0.00103694 -3.51664 63.546000 Cu 0.288404 0.609357 1.11032e-16 124 63.546 0.000690213 -3.51739 63.546000 Cu 0.300909 0.636808 8.65188e-17 125 63.546 0.000186724 -3.51779 63.546000 Cu 0.349353 0.621392 0.5 126 63.546 0.00141138 -3.51904 63.546000 Cu 0.410442 0.633581 1 128 63.546 0.00141747 -3.51929 63.546000 Cu 0.52008 0.630708 1.44318e-16 100 63.546 0.000219931 -3.51819 63.546000 Cu 0.458855 0.61833 0.5 102 63.546 0.00147989 -3.51922 63.546000 Cu 0.568682 0.615607 0.5 101 63.546 0.00057349 -3.51703 63.546000 Cu 0.678644 0.612719 0.5 76 63.546 0.00259671 -3.51574 63.546000 Cu 0.629915 0.627888 1 103 63.546 0.00105821 -3.51657 63.546000 Cu 0.691192 0.640061 0.5 105 63.546 0.000996787 -3.51681 63.546000 Cu 0.739777 0.624774 2.96807e-17 74 63.546 0.00103694 -3.51664 63.546000 Cu 0.788404 0.609357 0.5 75 63.546 0.000690213 -3.51739 63.546000 Cu 0.849353 0.621392 1 77 63.546 0.00141138 -3.51904 63.546000 Cu 0.800909 0.636808 0.5 80 63.546 0.000186724 -3.51779 63.546000 Cu 0.958855 0.61833 1 48 63.546 0.00147989 -3.51922 63.546000 Cu 0.910442 0.633581 0.5 79 63.546 0.00141747 -3.51929 63.546000 Cu 0.0813377 0.643025 1 52 63.546 0.000313402 -3.51747 63.546000 Cu 0.0328972 0.658183 0.5 83 63.546 0.000100926 -3.51826 63.546000 Cu 0.0942678 0.670443 4.68643e-18 85 63.546 0.000112494 -3.51781 63.546000 Cu 0.142688 0.65526 0.5 57 63.546 0.000355972 -3.51707 63.546000 Cu 0.203995 0.667437 6.12841e-17 56 63.546 0.000380399 -3.51695 63.546000 Cu 0.252443 0.65216 0.5 157 63.546 0.000356303 -3.51699 63.546000 Cu 0.362023 0.648904 0.5 131 63.546 0.000683178 -3.51845 63.546000 Cu 0.313634 0.664248 1.20165e-19 158 63.546 0.000111837 -3.51756 63.546000 Cu 0.374952 0.676376 0.5 160 63.546 0.000433545 -3.51809 63.546000 Cu 0.423251 0.661096 6.21253e-17 129 63.546 0.000698935 -3.51872 63.546000 Cu 0.471606 0.645876 0.5 130 63.546 0.000403934 -3.51874 63.546000 Cu 0.532897 0.658183 1.81209e-16 132 63.546 0.000100926 -3.51826 63.546000 Cu 0.484565 0.673374 0.5 135 63.546 6.67233e-05 -3.5186 63.546000 Cu 0.642688 0.65526 2.22546e-16 104 63.546 0.000355972 -3.51707 63.546000 Cu 0.581338 0.643025 0.5 106 63.546 0.000313402 -3.51747 63.546000 Cu 0.703995 0.667437 0.5 110 63.546 0.000380399 -3.51695 63.546000 Cu 0.594268 0.670443 0.5 134 63.546 0.000112494 -3.51781 63.546000 Cu 0.752443 0.65216 1.43237e-16 107 63.546 0.000356303 -3.51699 63.546000 Cu 0.813634 0.664248 0.5 109 63.546 0.000111837 -3.51756 63.546000 Cu 0.862023 0.648904 2.66165e-16 78 63.546 0.000683178 -3.51845 63.546000 Cu 0.971606 0.645876 2.50183e-16 81 63.546 0.000403934 -3.51874 63.546000 Cu 0.984565 0.673374 4.68643e-18 82 63.546 6.67233e-05 -3.5186 63.546000 Cu 0.923251 0.661096 0.5 84 63.546 0.000698935 -3.51872 63.546000 Cu 0.874952 0.676376 1.82891e-16 111 63.546 0.000433545 -3.51809 63.546000 Cu 0.107091 0.697897 4.68643e-18 86 63.546 0.000135294 -3.51821 63.546000 Cu 0.0458717 0.685659 0.5 88 63.546 9.31152e-05 -3.51839 63.546000 Cu 0.0586869 0.713146 0.5 117 63.546 0.000175971 -3.51857 63.546000 Cu 0.155568 0.682668 0.5 87 63.546 0.000225171 -3.51758 63.546000 Cu 0.216817 0.694824 1 89 63.546 0.000103883 -3.51736 63.546000 Cu 0.1683 0.710095 0.5 91 63.546 0.000158571 -3.51783 63.546000 Cu 0.265312 0.679559 0.5 161 63.546 0.000150673 -3.51716 63.546000 Cu 0.277992 0.706951 0.5 190 63.546 2.67022e-05 -3.51721 63.546000 Cu 0.326565 0.69166 4.68643e-18 159 63.546 0.000233609 -3.51747 63.546000 Cu 0.387732 0.703825 0.5 165 63.546 0.000398959 -3.51798 63.546000 Cu 0.545872 0.685659 4.39804e-17 133 63.546 9.31152e-05 -3.51839 63.546000 Cu 0.436217 0.688591 6.09236e-17 162 63.546 0.000279928 -3.51844 63.546000 Cu 0.497436 0.700874 0.5 164 63.546 1.57301e-05 -3.51859 63.546000 Cu 0.558687 0.713146 1 166 63.546 0.000175971 -3.51857 63.546000 Cu 0.655568 0.682668 2.42373e-16 136 63.546 0.000225171 -3.51758 63.546000 Cu 0.6683 0.710095 4.68643e-18 137 63.546 0.000158571 -3.51783 63.546000 Cu 0.607091 0.697897 0.5 139 63.546 0.000135294 -3.51821 63.546000 Cu 0.765312 0.679559 4.74532e-16 108 63.546 0.000150673 -3.51716 63.546000 Cu 0.826565 0.69166 0.5 114 63.546 0.000233609 -3.51747 63.546000 Cu 0.716817 0.694824 0.5 138 63.546 0.000103883 -3.51736 63.546000 Cu 0.777992 0.706951 7.41418e-17 140 63.546 2.67022e-05 -3.51721 63.546000 Cu 0.997436 0.700874 4.68643e-18 115 63.546 1.57301e-05 -3.51859 63.546000 Cu 0.887732 0.703825 1 112 63.546 0.000398959 -3.51798 63.546000 Cu 0.936217 0.688591 0.5 113 63.546 0.000279928 -3.51844 63.546000 Cu 0.0102658 0.728377 1 116 63.546 0.000209212 -3.51867 63.546000 Cu 0.119863 0.725387 1.20646e-16 119 63.546 0.000375667 -3.51829 63.546000 Cu 0.0714205 0.740671 0.5 122 63.546 0.000644451 -3.51889 63.546000 Cu 0.229519 0.722233 4.68643e-18 90 63.546 4.52293e-05 -3.51711 63.546000 Cu 0.181007 0.737543 0.5 121 63.546 0.000171966 -3.5179 63.546000 Cu 0.242123 0.749645 1.67029e-16 222 63.546 0.000177834 -3.51728 63.546000 Cu 0.339253 0.719072 1.20165e-19 191 63.546 0.000310088 -3.51724 63.546000 Cu 0.351912 0.746466 4.54224e-17 192 63.546 0.000859541 -3.51701 63.546000 Cu 0.400519 0.731256 0.5 193 63.546 0.000622079 -3.51771 63.546000 Cu 0.290714 0.734336 0.5 194 63.546 0.00020928 -3.51684 63.546000 Cu 0.44902 0.716074 1 163 63.546 0.000117431 -3.51833 63.546000 Cu 0.510266 0.728377 0.5 169 63.546 0.000209212 -3.51867 63.546000 Cu 0.461729 0.743559 4.5182e-17 195 63.546 0.000104024 -3.51827 63.546000 Cu 0.57142 0.740671 1.20165e-19 167 63.546 0.000644451 -3.51889 63.546000 Cu 0.619863 0.725387 0.5 168 63.546 0.000375667 -3.51829 63.546000 Cu 0.681007 0.737543 4.68643e-18 170 63.546 0.000171966 -3.5179 63.546000 Cu 0.790714 0.734336 2.07405e-16 141 63.546 0.00020928 -3.51684 63.546000 Cu 0.839253 0.719072 0.5 142 63.546 0.000310088 -3.51724 63.546000 Cu 0.729519 0.722233 0.5 143 63.546 4.52293e-05 -3.51711 63.546000 Cu 0.851912 0.746466 0.5 147 63.546 0.000859541 -3.51701 63.546000 Cu 0.742123 0.749645 0.5 172 63.546 0.000177834 -3.51728 63.546000 Cu 0.94902 0.716074 0.5 118 63.546 0.000117431 -3.51833 63.546000 Cu 0.900519 0.731256 1 144 63.546 0.000622079 -3.51771 63.546000 Cu 0.961729 0.743559 0.5 146 63.546 0.000104024 -3.51827 63.546000 Cu 0.132497 0.752898 1 120 63.546 0.000649634 -3.5189 63.546000 Cu 0.022916 0.755917 2.29034e-16 148 63.546 0.000690649 -3.51889 63.546000 Cu 0.0355928 0.783487 5.28726e-18 149 63.546 0.00177973 -3.51892 63.546000 Cu 0.0840293 0.768244 0.5 150 63.546 0.00178455 -3.51934 63.546000 Cu 0.193551 0.765029 0.5 123 63.546 0.000330398 -3.51811 63.546000 Cu 0.145085 0.780461 1.20766e-16 152 63.546 0.00173112 -3.51926 63.546000 Cu 0.254605 0.777059 1.3843e-16 223 63.546 0.000789558 -3.51671 63.546000 Cu 0.413158 0.7587 0.5 198 63.546 0.000799454 -3.51742 63.546000 Cu 0.303293 0.76172 0.5 224 63.546 0.000926006 -3.51659 63.546000 Cu 0.364474 0.773852 1 225 63.546 0.00206241 -3.51663 63.546000 Cu 0.474346 0.771066 1 196 63.546 0.000207827 -3.51815 63.546000 Cu 0.522916 0.755917 0.5 197 63.546 0.000690649 -3.51889 63.546000 Cu 0.535593 0.783487 0.5 202 63.546 0.00177973 -3.51892 63.546000 Cu 0.693551 0.765029 1 171 63.546 0.000330398 -3.51811 63.546000 Cu 0.632497 0.752898 0.5 173 63.546 0.000649634 -3.5189 63.546000 Cu 0.584029 0.768244 1 199 63.546 0.00178455 -3.51934 63.546000 Cu 0.645085 0.780461 0.5 201 63.546 0.00173112 -3.51926 63.546000 Cu 0.803293 0.76172 1 174 63.546 0.000926006 -3.51659 63.546000 Cu 0.754605 0.777059 0.5 177 63.546 0.000789558 -3.51671 63.546000 Cu 0.913158 0.7587 7.45023e-18 145 63.546 0.000799454 -3.51742 63.546000 Cu 0.974346 0.771066 0.5 151 63.546 0.000207827 -3.51815 63.546000 Cu 0.864474 0.773852 0.5 176 63.546 0.00206241 -3.51663 63.546000 Cu 0.0968129 0.795864 0.5 155 63.546 0.00434037 -3.5199 63.546000 Cu 0.0486155 0.811106 1 182 63.546 0.00400732 -3.51907 63.546000 Cu 0.157964 0.808092 4.68643e-18 153 63.546 0.00507679 -3.51972 63.546000 Cu 0.20615 0.792527 0.5 154 63.546 0.000820806 -3.51785 63.546000 Cu 0.218953 0.820036 0.5 156 63.546 0.00182944 -3.51709 63.546000 Cu 0.26731 0.804443 2.42613e-16 256 63.546 0.00261234 -3.51535 63.546000 Cu 0.377185 0.801206 1.20165e-19 226 63.546 0.00426531 -3.51557 63.546000 Cu 0.315816 0.789081 0.5 228 63.546 0.00282823 -3.51562 63.546000 Cu 0.3286 0.816373 0.5 258 63.546 0.00787995 -3.51399 63.546000 Cu 0.425739 0.78614 0.5 227 63.546 0.0012161 -3.51704 63.546000 Cu 0.487177 0.798579 1 229 63.546 0.000567583 -3.51781 63.546000 Cu 0.548616 0.811106 0.5 231 63.546 0.00400732 -3.51907 63.546000 Cu 0.438692 0.813552 0.5 232 63.546 0.00214868 -3.51636 63.546000 Cu 0.596813 0.795864 1 200 63.546 0.00434037 -3.5199 63.546000 Cu 0.70615 0.792527 1 203 63.546 0.000820806 -3.51785 63.546000 Cu 0.657964 0.808092 0.5 206 63.546 0.00507679 -3.51972 63.546000 Cu 0.815816 0.789081 4.68643e-18 175 63.546 0.00282823 -3.51562 63.546000 Cu 0.718953 0.820036 2.57153e-17 204 63.546 0.00182944 -3.51709 63.546000 Cu 0.76731 0.804443 0.5 205 63.546 0.00261234 -3.51535 63.546000 Cu 0.8286 0.816373 4.68643e-18 207 63.546 0.00787995 -3.51399 63.546000 Cu 0.925739 0.78614 1 178 63.546 0.0012161 -3.51704 63.546000 Cu 0.938692 0.813552 1.26534e-16 179 63.546 0.00214868 -3.51636 63.546000 Cu 0.987177 0.798579 0.5 180 63.546 0.000567583 -3.51781 63.546000 Cu 0.877185 0.801206 0.5 181 63.546 0.00426531 -3.51557 63.546000 Cu 0.0618228 0.838821 1 183 63.546 0.00951187 -3.51853 63.546000 Cu 0.109903 0.823574 0.5 184 63.546 0.0107223 -3.52061 63.546000 Cu 0.000299549 0.826123 0.5 185 63.546 0.00143317 -3.51743 63.546000 Cu 0.123043 0.851462 0.5 189 63.546 0.0288532 -3.52113 63.546000 Cu 0.0134423 0.853721 0.5 213 63.546 0.00304891 -3.51627 63.546000 Cu 0.170923 0.835819 1.83612e-16 186 63.546 0.0140214 -3.52026 63.546000 Cu 0.231677 0.847594 0.5 188 63.546 0.00598274 -3.51528 63.546000 Cu 0.280049 0.831773 5.53961e-17 257 63.546 0.00891929 -3.51307 63.546000 Cu 0.390085 0.828502 1 259 63.546 0.00897189 -3.5145 63.546000 Cu 0.403049 0.855704 0 260 63.546 0.0200699 -3.51224 63.546000 Cu 0.341411 0.843576 0.5 262 63.546 0.0210253 -3.51077 63.546000 Cu 0.5003 0.826123 3.60495e-19 230 63.546 0.00143317 -3.51743 63.546000 Cu 0.561823 0.838821 0.5 236 63.546 0.00951187 -3.51853 63.546000 Cu 0.451795 0.840947 0.5 261 63.546 0.00426996 -3.51559 63.546000 Cu 0.513442 0.853721 1 263 63.546 0.00304891 -3.51627 63.546000 Cu 0.609903 0.823574 1 233 63.546 0.0107223 -3.52061 63.546000 Cu 0.623043 0.851462 1 234 63.546 0.0288532 -3.52113 63.546000 Cu 0.670923 0.835819 0.5 235 63.546 0.0140214 -3.52026 63.546000 Cu 0.841411 0.843576 4.68643e-18 208 63.546 0.0210253 -3.51077 63.546000 Cu 0.780049 0.831773 0.5 210 63.546 0.00891929 -3.51307 63.546000 Cu 0.731677 0.847594 1 237 63.546 0.00598274 -3.51528 63.546000 Cu 0.890085 0.828502 0.5 209 63.546 0.00897189 -3.5145 63.546000 Cu 0.951795 0.840947 4.68643e-18 211 63.546 0.00426996 -3.51559 63.546000 Cu 0.903049 0.855704 0.5 214 63.546 0.0200699 -3.51224 63.546000 Cu 0.0748903 0.866662 3.38865e-17 215 63.546 0.018155 -3.51623 63.546000 Cu 0.135873 0.879614 0.5 217 63.546 0.0746736 -3.52035 63.546000 Cu 0.0261293 0.881384 0.5 218 63.546 0.00511057 -3.51381 63.546000 Cu 0.183794 0.863782 8.90422e-17 187 63.546 0.0470175 -3.52005 63.546000 Cu 0.19621 0.89216 1 219 63.546 0.163467 -3.51802 63.546000 Cu 0.244013 0.875265 0.5 289 63.546 0.0198905 -3.50834 63.546000 Cu 0.292702 0.859003 2.21224e-16 286 63.546 0.0329631 -3.50842 63.546000 Cu 0.30475 0.886121 3.19519e-16 287 63.546 0.124852 -3.50054 63.546000 Cu 0.354042 0.870605 0.5 288 63.546 0.0642002 -3.50391 63.546000 Cu 0.415599 0.882842 2.22305e-16 290 63.546 0.0392143 -3.50832 63.546000 Cu 0.526129 0.881384 1 264 63.546 0.00511057 -3.51381 63.546000 Cu 0.464659 0.868354 0.5 266 63.546 0.00600113 -3.5162 63.546000 Cu 0.683794 0.863782 0.5 240 63.546 0.0470175 -3.52005 63.546000 Cu 0.57489 0.866662 0.5 265 63.546 0.018155 -3.51623 63.546000 Cu 0.635873 0.879614 1 267 63.546 0.0746736 -3.52035 63.546000 Cu 0.69621 0.89216 0.5 269 63.546 0.163467 -3.51802 63.546000 Cu 0.744013 0.875265 1.64626e-17 238 63.546 0.0198905 -3.50834 63.546000 Cu 0.792702 0.859003 0.5 239 63.546 0.0329631 -3.50842 63.546000 Cu 0.854042 0.870605 1 241 63.546 0.0642002 -3.50391 63.546000 Cu 0.80475 0.886121 0.5 244 63.546 0.124852 -3.50054 63.546000 Cu 0.964659 0.868354 1 212 63.546 0.00600113 -3.5162 63.546000 Cu 0.915599 0.882842 0.5 243 63.546 0.0392143 -3.50832 63.546000 Cu 0.0871135 0.894649 4.8066e-19 216 63.546 0.0228918 -3.51013 63.546000 Cu 0.0376051 0.909163 0.5 247 63.546 0.00947872 -3.51371 63.546000 Cu 0.0979406 0.922724 1.08148e-18 249 63.546 0.0365517 -3.50569 63.546000 Cu 0.208492 0.921289 1 220 63.546 0.594741 -3.53064 63.546000 Cu 0.147624 0.908062 0.5 221 63.546 0.148308 -3.50531 63.546000 Cu 0.255123 0.903368 0.5 309 63.546 0.153915 -3.45052 63.546000 Cu 0.366333 0.89734 0.5 293 63.546 0.24545 -3.51037 63.546000 Cu 0.315017 0.913033 1 310 63.546 0.839856 -3.44046 63.546000 Cu 0.376243 0.924088 0.5 312 63.546 0.878491 -3.50708 63.546000 Cu 0.426585 0.910043 4.68643e-18 291 63.546 0.0471907 -3.51687 63.546000 Cu 0.476805 0.89581 0.5 292 63.546 0.007139 -3.51631 63.546000 Cu 0.537605 0.909163 1.20165e-19 294 63.546 0.00947872 -3.51371 63.546000 Cu 0.487169 0.92334 0.5 297 63.546 0.0218952 -3.517 63.546000 Cu 0.647624 0.908062 3.60495e-19 268 63.546 0.148308 -3.50531 63.546000 Cu 0.587114 0.894649 0.5 270 63.546 0.0228918 -3.51013 63.546000 Cu 0.708492 0.921289 0.5 274 63.546 0.594741 -3.53064 63.546000 Cu 0.597941 0.922724 0.5 296 63.546 0.0365517 -3.50569 63.546000 Cu 0.755123 0.903368 1.50206e-17 271 63.546 0.153915 -3.45052 63.546000 Cu 0.815017 0.913033 0.5 273 63.546 0.839856 -3.44046 63.546000 Cu 0.866333 0.89734 1 242 63.546 0.24545 -3.51037 63.546000 Cu 0.976805 0.89581 1 245 63.546 0.007139 -3.51631 63.546000 Cu 0.987169 0.92334 1 246 63.546 0.0218952 -3.517 63.546000 Cu 0.926585 0.910043 0.5 248 63.546 0.0471907 -3.51687 63.546000 Cu 0.876243 0.924088 6.00825e-19 275 63.546 0.878491 -3.50708 63.546000 Cu 0.103261 0.950925 2.19902e-17 250 63.546 0.0972403 -3.50574 63.546000 Cu 0.0461404 0.937009 0.5 252 63.546 0.0488352 -3.516 63.546000 Cu 0.156146 0.936649 0.5 251 63.546 0.0944745 -3.48882 63.546000 Cu 0.215584 0.950866 3.60495e-19 253 63.546 1.72528 -3.57427 63.546000 Cu 0.264719 0.934344 0.5 313 63.546 2.30872 -3.37752 63.546000 Cu 0.325622 0.938812 2.00676e-16 311 63.546 6.87169 -3.19555 63.546000 Cu 0.381665 0.950959 0.5 317 63.546 2.44755 -3.48435 63.546000 Cu 0.325855 0.963169 1.28336e-16 325 63.546 5.916 -3.18131 63.546000 Cu 0.54614 0.937009 7.2099e-19 295 63.546 0.0488352 -3.516 63.546000 Cu 0.435621 0.937307 1.53331e-16 314 63.546 0.0739977 -3.52883 63.546000 Cu 0.492347 0.950961 0.5 316 63.546 0.0746995 -3.51828 63.546000 Cu 0.656146 0.936649 8.41155e-19 298 63.546 0.0944745 -3.48882 63.546000 Cu 0.603261 0.950925 0.5 301 63.546 0.0972403 -3.50574 63.546000 Cu 0.764719 0.934344 1 272 63.546 2.30872 -3.37752 63.546000 Cu 0.825622 0.938812 0.5 278 63.546 6.87169 -3.19555 63.546000 Cu 0.715584 0.950866 0.5 300 63.546 1.72528 -3.57427 63.546000 Cu 0.825855 0.963169 0.5 304 63.546 5.916 -3.18131 63.546000 Cu 0.992347 0.950961 1 279 63.546 0.0746995 -3.51828 63.546000 Cu 0.881665 0.950959 5.33533e-17 276 63.546 2.44755 -3.48435 63.546000 Cu 0.935621 0.937307 0.5 277 63.546 0.0739977 -3.52883 63.546000 Cu 0.046285 0.964903 0.5 281 63.546 0.049611 -3.51607 63.546000 Cu 0.0982137 0.979118 1 283 63.546 0.0347451 -3.50534 63.546000 Cu 0.0379568 0.992744 0.5 285 63.546 0.00775126 -3.51363 63.546000 Cu 0.255612 0.998288 0.5 361 63.546 0.17003 -3.44324 63.546000 Cu 0.15633 0.96513 0.5 255 63.546 0.0928633 -3.48898 63.546000 Cu 0.26508 0.967288 0.5 324 63.546 2.53911 -3.37753 63.546000 Cu 0.208885 0.980379 3.641e-17 254 63.546 0.649217 -3.53356 63.546000 Cu 0.148073 0.993713 0.5 284 63.546 0.149358 -3.50452 63.546000 Cu 0.315392 0.988827 3.92939e-16 326 63.546 0.905708 -3.43249 63.546000 Cu 0.37656 0.977803 0.5 327 63.546 0.913311 -3.50623 63.546000 Cu 0.426973 0.991873 4.68643e-18 329 63.546 0.0496106 -3.51761 63.546000 Cu 0.546285 0.964903 1 318 63.546 0.049611 -3.51607 63.546000 Cu 0.435739 0.964614 4.68643e-18 315 63.546 0.0727707 -3.52918 63.546000 Cu 0.487412 0.978591 0.5 321 63.546 0.0222872 -3.51704 63.546000 Cu 0.537957 0.992744 8.77204e-18 319 63.546 0.00775126 -3.51363 63.546000 Cu 0.65633 0.96513 2.64363e-17 299 63.546 0.0928633 -3.48898 63.546000 Cu 0.598214 0.979118 0.5 320 63.546 0.0347451 -3.50534 63.546000 Cu 0.648073 0.993713 4.68643e-18 322 63.546 0.149358 -3.50452 63.546000 Cu 0.708885 0.980379 0.5 305 63.546 0.649217 -3.53356 63.546000 Cu 0.755612 0.998288 1.07307e-16 331 63.546 0.17003 -3.44324 63.546000 Cu 0.76508 0.967288 4.68643e-18 302 63.546 2.53911 -3.37753 63.546000 Cu 0.815392 0.988827 0.5 308 63.546 0.905708 -3.43249 63.546000 Cu 0.987412 0.978591 1 280 63.546 0.0222872 -3.51704 63.546000 Cu 0.935739 0.964614 0.5 282 63.546 0.0727707 -3.52918 63.546000 Cu 0.87656 0.977803 1 306 63.546 0.913311 -3.50623 63.546000 Cu 0.926973 0.991873 0.5 307 63.546 0.0496106 -3.51761