Number of particles = 652 A = 1 Angstrom (basic length-scale) H0(1,1) = 23.1584 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.5954 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61104 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 0.0989681 0.00694716 1.71621e-16 342 63.546 0.0722772 -3.52757 63.546000 Cu 0.037865 0.0205192 0.5 343 63.546 0.0149242 -3.53369 63.546000 Cu 0.0862355 0.0353187 3.52129e-16 355 63.546 0.0268795 -3.538 63.546000 Cu 0.146702 0.0223182 0.5 357 63.546 0.077168 -3.53199 63.546000 Cu 0.194794 0.0383901 1 356 63.546 0.0445371 -3.53768 63.546000 Cu 0.20691 0.00975897 1.53126e-16 359 63.546 0.227514 -3.52265 63.546000 Cu 0.314881 0.0167324 1 360 63.546 0.532178 -3.47378 63.546000 Cu 0.254253 0.0266581 0.5 362 63.546 0.0928989 -3.53149 63.546000 Cu 0.377498 0.00533562 0.5 363 63.546 0.507851 -3.49243 63.546000 Cu 0.365008 0.031883 0.5 383 63.546 0.116811 -3.51978 63.546000 Cu 0.427279 0.0194243 1.22621e-16 385 63.546 0.0367131 -3.53074 63.546000 Cu 0.488732 0.0062113 0.5 387 63.546 0.0259121 -3.53388 63.546000 Cu 0.476306 0.0337473 0.5 388 63.546 0.00720147 -3.53582 63.546000 Cu 0.537865 0.0205192 1 386 63.546 0.0149242 -3.53369 63.546000 Cu 0.598968 0.00694716 0.5 389 63.546 0.0722772 -3.52757 63.546000 Cu 0.586235 0.0353187 0.5 417 63.546 0.0268795 -3.538 63.546000 Cu 0.646702 0.0223182 1.22501e-16 419 63.546 0.077168 -3.53199 63.546000 Cu 0.754253 0.0266581 2.54369e-16 420 63.546 0.0928989 -3.53149 63.546000 Cu 0.70691 0.00975897 0.5 421 63.546 0.227514 -3.52265 63.546000 Cu 0.694794 0.0383901 0.5 422 63.546 0.0445371 -3.53768 63.546000 Cu 0.814881 0.0167324 0.5 333 63.546 0.532178 -3.47378 63.546000 Cu 0.877498 0.00533562 1 332 63.546 0.507851 -3.49243 63.546000 Cu 0.865008 0.031883 3.67622e-16 337 63.546 0.116811 -3.51978 63.546000 Cu 0.976306 0.0337473 2.44881e-16 338 63.546 0.00720147 -3.53582 63.546000 Cu 0.927279 0.0194243 0.5 339 63.546 0.0367131 -3.53074 63.546000 Cu 0.988732 0.0062113 1 341 63.546 0.0259121 -3.53388 63.546000 Cu 0.0735271 0.063256 1.81349e-17 352 63.546 0.0115235 -3.54126 63.546000 Cu 0.0250584 0.0483374 0.5 353 63.546 0.00548891 -3.53875 63.546000 Cu 0.134359 0.050622 0.5 358 63.546 0.0314298 -3.54085 63.546000 Cu 0.121788 0.0785265 0.5 375 63.546 0.0121686 -3.54233 63.546000 Cu 0.0123098 0.0759645 0.5 354 63.546 0.0020429 -3.54017 63.546000 Cu 0.182534 0.0663418 3.32673e-17 377 63.546 0.0139899 -3.54168 63.546000 Cu 0.291715 0.0705187 1.2238e-16 378 63.546 0.0184242 -3.5307 63.546000 Cu 0.242966 0.0545747 0.5 379 63.546 0.0122818 -3.53924 63.546000 Cu 0.230804 0.0821315 0.5 380 63.546 0.00284417 -3.53965 63.546000 Cu 0.303621 0.0434817 3.62698e-17 381 63.546 0.0868718 -3.51763 63.546000 Cu 0.353035 0.0587487 0.5 384 63.546 0.0339435 -3.52749 63.546000 Cu 0.414577 0.0464964 9.00739e-17 382 63.546 0.0166232 -3.53285 63.546000 Cu 0.402117 0.0736499 1 411 63.546 0.00785987 -3.53569 63.546000 Cu 0.463609 0.0611507 0.5 413 63.546 0.00323925 -3.53788 63.546000 Cu 0.51231 0.0759645 1 412 63.546 0.0020429 -3.54017 63.546000 Cu 0.525058 0.0483374 1.4628e-16 415 63.546 0.00548891 -3.53875 63.546000 Cu 0.573527 0.063256 0.5 418 63.546 0.0115235 -3.54126 63.546000 Cu 0.634359 0.050622 6.00493e-19 416 63.546 0.0314298 -3.54085 63.546000 Cu 0.621788 0.0785265 1.04966e-16 451 63.546 0.0121686 -3.54233 63.546000 Cu 0.791715 0.0705187 0.5 336 63.546 0.0184242 -3.5307 63.546000 Cu 0.730804 0.0821315 2.40197e-19 452 63.546 0.00284417 -3.53965 63.546000 Cu 0.682534 0.0663418 0.5 453 63.546 0.0139899 -3.54168 63.546000 Cu 0.742966 0.0545747 3.05771e-16 455 63.546 0.0122818 -3.53924 63.546000 Cu 0.803621 0.0434817 0.5 335 63.546 0.0868718 -3.51763 63.546000 Cu 0.853035 0.0587487 1 334 63.546 0.0339435 -3.52749 63.546000 Cu 0.914577 0.0464964 0.5 340 63.546 0.0166232 -3.53285 63.546000 Cu 0.902117 0.0736499 0.5 349 63.546 0.00785987 -3.53569 63.546000 Cu 0.963609 0.0611507 1 351 63.546 0.00323925 -3.53788 63.546000 Cu 0.047882 0.118581 6.16106e-17 370 63.546 0.00150979 -3.54123 63.546000 Cu 0.0607486 0.0909758 9.24759e-18 373 63.546 0.00477352 -3.54145 63.546000 Cu 0.108998 0.106227 0.5 376 63.546 0.00433782 -3.5422 63.546000 Cu 0.157364 0.121618 1 403 63.546 0.00174467 -3.54143 63.546000 Cu 0.169985 0.0940444 8.62308e-17 374 63.546 0.0047186 -3.54153 63.546000 Cu 0.218318 0.10959 0.5 405 63.546 0.000898085 -3.53975 63.546000 Cu 0.27939 0.0977284 1 407 63.546 0.00463928 -3.53587 63.546000 Cu 0.32808 0.113007 0.5 410 63.546 0.00325631 -3.53658 63.546000 Cu 0.389434 0.100871 7.38606e-17 408 63.546 0.00320864 -3.53703 63.546000 Cu 0.340638 0.085812 0.5 409 63.546 0.0102992 -3.53417 63.546000 Cu 0.450899 0.0885274 0.5 414 63.546 0.00170176 -3.53875 63.546000 Cu 0.438115 0.115883 0.5 445 63.546 0.000715175 -3.53862 63.546000 Cu 0.499467 0.103487 1 447 63.546 0.000870833 -3.53991 63.546000 Cu 0.560749 0.0909758 0.5 449 63.546 0.00477352 -3.54145 63.546000 Cu 0.547882 0.118581 0.5 450 63.546 0.00150979 -3.54123 63.546000 Cu 0.608998 0.106227 2.40197e-19 448 63.546 0.00433782 -3.5422 63.546000 Cu 0.657364 0.121618 0.5 485 63.546 0.00174467 -3.54143 63.546000 Cu 0.77939 0.0977284 0.5 345 63.546 0.00463928 -3.53587 63.546000 Cu 0.669985 0.0940444 0.5 454 63.546 0.0047186 -3.54153 63.546000 Cu 0.718318 0.10959 1 487 63.546 0.000898085 -3.53975 63.546000 Cu 0.82808 0.113007 5.06816e-17 344 63.546 0.00325631 -3.53658 63.546000 Cu 0.840638 0.085812 4.67183e-17 347 63.546 0.0102992 -3.53417 63.546000 Cu 0.950899 0.0885274 7.20591e-19 348 63.546 0.00170176 -3.53875 63.546000 Cu 0.889434 0.100871 0.5 350 63.546 0.00320864 -3.53703 63.546000 Cu 0.938115 0.115883 8.6471e-17 369 63.546 0.000715175 -3.53862 63.546000 Cu 0.999467 0.103487 0.5 371 63.546 0.000870833 -3.53991 63.546000 Cu 0.0353464 0.146106 2.42959e-16 399 63.546 0.00049177 -3.54075 63.546000 Cu 0.144875 0.149137 1 400 63.546 0.000601905 -3.5411 63.546000 Cu 0.0963608 0.133818 0.5 401 63.546 0.00130113 -3.54168 63.546000 Cu 0.0838745 0.161351 0.5 402 63.546 0.000296608 -3.54073 63.546000 Cu 0.193487 0.164468 0.5 437 63.546 0.000134387 -3.54012 63.546000 Cu 0.205854 0.137029 0.5 406 63.546 0.000357716 -3.54005 63.546000 Cu 0.266902 0.125026 1 404 63.546 0.00139117 -3.53805 63.546000 Cu 0.254514 0.152377 1.20099e-19 439 63.546 0.000406955 -3.53886 63.546000 Cu 0.31561 0.140289 0.5 441 63.546 0.000954895 -3.53825 63.546000 Cu 0.364389 0.155469 1.92158e-17 440 63.546 0.000302739 -3.53917 63.546000 Cu 0.376833 0.128143 1 443 63.546 0.00111304 -3.53822 63.546000 Cu 0.486727 0.130948 3.60296e-19 444 63.546 0.000305684 -3.54 63.546000 Cu 0.425572 0.143261 0.5 446 63.546 0.000370425 -3.53964 63.546000 Cu 0.474238 0.1584 1 479 63.546 0.000104794 -3.54034 63.546000 Cu 0.583874 0.161351 2.44641e-16 480 63.546 0.000296608 -3.54073 63.546000 Cu 0.535346 0.146106 0.5 481 63.546 0.00049177 -3.54075 63.546000 Cu 0.596361 0.133818 1 483 63.546 0.00130113 -3.54168 63.546000 Cu 0.644875 0.149137 0.5 486 63.546 0.000601905 -3.5411 63.546000 Cu 0.766902 0.125026 0.5 346 63.546 0.00139117 -3.53805 63.546000 Cu 0.705854 0.137029 3.67862e-16 484 63.546 0.000357716 -3.54005 63.546000 Cu 0.693487 0.164468 1.53966e-16 519 63.546 0.000134387 -3.54012 63.546000 Cu 0.754514 0.152377 0.5 520 63.546 0.000406955 -3.53886 63.546000 Cu 0.81561 0.140289 6.00493e-19 365 63.546 0.000954895 -3.53825 63.546000 Cu 0.925572 0.143261 1 366 63.546 0.000370425 -3.53964 63.546000 Cu 0.876833 0.128143 0.5 367 63.546 0.00111304 -3.53822 63.546000 Cu 0.864389 0.155469 0.5 368 63.546 0.000302739 -3.53917 63.546000 Cu 0.986727 0.130948 0.5 372 63.546 0.000305684 -3.54 63.546000 Cu 0.974238 0.1584 0.5 397 63.546 0.000104794 -3.54034 63.546000 Cu 0.022885 0.173593 1 396 63.546 0.000250524 -3.54051 63.546000 Cu 0.119816 0.204075 3.60296e-19 432 63.546 6.28046e-05 -3.53999 63.546000 Cu 0.071407 0.188833 0.5 433 63.546 0.000201017 -3.54034 63.546000 Cu 0.132505 0.176623 1 435 63.546 0.000236044 -3.54046 63.546000 Cu 0.0101358 0.201047 1 431 63.546 7.04391e-05 -3.54031 63.546000 Cu 0.18104 0.191901 0.5 438 63.546 0.000134458 -3.53974 63.546000 Cu 0.242167 0.179755 6.00493e-19 436 63.546 0.000113109 -3.5391 63.546000 Cu 0.303232 0.167624 0.5 442 63.546 0.000192556 -3.53897 63.546000 Cu 0.229505 0.207152 1 471 63.546 4.44143e-05 -3.53953 63.546000 Cu 0.290729 0.195012 0.5 473 63.546 8.07987e-05 -3.53926 63.546000 Cu 0.351919 0.182847 3.36276e-17 475 63.546 0.000161453 -3.53977 63.546000 Cu 0.413071 0.170659 0.5 477 63.546 0.000191389 -3.5402 63.546000 Cu 0.400448 0.198076 0.5 478 63.546 0.000166671 -3.53997 63.546000 Cu 0.461696 0.185841 1 476 63.546 9.83582e-05 -3.54038 63.546000 Cu 0.522885 0.173593 0.5 482 63.546 0.000250524 -3.54051 63.546000 Cu 0.510136 0.201047 0.5 513 63.546 7.04391e-05 -3.54031 63.546000 Cu 0.571407 0.188833 4.80394e-19 515 63.546 0.000201017 -3.54034 63.546000 Cu 0.632505 0.176623 0.5 517 63.546 0.000236044 -3.54046 63.546000 Cu 0.619816 0.204075 0.5 518 63.546 6.28046e-05 -3.53999 63.546000 Cu 0.790729 0.195012 5.94488e-17 391 63.546 8.07987e-05 -3.53926 63.546000 Cu 0.68104 0.191901 1 516 63.546 0.000134458 -3.53974 63.546000 Cu 0.742167 0.179755 0.5 521 63.546 0.000113109 -3.5391 63.546000 Cu 0.729505 0.207152 0.5 552 63.546 4.44143e-05 -3.53953 63.546000 Cu 0.803232 0.167624 8.4069e-19 364 63.546 0.000192556 -3.53897 63.546000 Cu 0.900448 0.198076 1.22621e-16 392 63.546 0.000166671 -3.53997 63.546000 Cu 0.851919 0.182847 0.5 393 63.546 0.000161453 -3.53977 63.546000 Cu 0.913071 0.170659 8.4069e-19 395 63.546 0.000191389 -3.5402 63.546000 Cu 0.961696 0.185841 0.5 398 63.546 9.83582e-05 -3.54038 63.546000 Cu 0.0585231 0.216282 0.5 434 63.546 4.12029e-05 -3.54018 63.546000 Cu 0.0457348 0.243731 0.5 465 63.546 7.59488e-05 -3.54058 63.546000 Cu 0.106984 0.231502 3.60296e-19 467 63.546 9.9932e-05 -3.54006 63.546000 Cu 0.155466 0.246742 0.5 470 63.546 0.000126211 -3.53961 63.546000 Cu 0.168222 0.219322 0.5 469 63.546 3.16679e-05 -3.53972 63.546000 Cu 0.216678 0.234559 3.60296e-19 468 63.546 0.000110675 -3.53956 63.546000 Cu 0.277956 0.22241 0.5 474 63.546 1.04673e-05 -3.53961 63.546000 Cu 0.32639 0.23768 5.42845e-17 507 63.546 0.000118487 -3.53963 63.546000 Cu 0.265237 0.249815 0.5 505 63.546 0.000123481 -3.53973 63.546000 Cu 0.339205 0.210259 3.00727e-16 472 63.546 8.01235e-05 -3.53972 63.546000 Cu 0.387605 0.225511 0.5 509 63.546 0.00017294 -3.5396 63.546000 Cu 0.436055 0.240744 1 508 63.546 0.000135186 -3.54008 63.546000 Cu 0.448873 0.213289 3.60296e-19 511 63.546 2.29655e-05 -3.53999 63.546000 Cu 0.497249 0.228508 0.5 514 63.546 5.7346e-05 -3.54041 63.546000 Cu 0.558523 0.216282 2.1966e-16 512 63.546 4.12029e-05 -3.54018 63.546000 Cu 0.545735 0.243731 2.0705e-16 547 63.546 7.59488e-05 -3.54058 63.546000 Cu 0.606984 0.231502 0.5 549 63.546 9.9932e-05 -3.54006 63.546000 Cu 0.655466 0.246742 1.06287e-16 548 63.546 0.000126211 -3.53961 63.546000 Cu 0.777956 0.22241 1 390 63.546 1.04673e-05 -3.53961 63.546000 Cu 0.668222 0.219322 1 551 63.546 3.16679e-05 -3.53972 63.546000 Cu 0.716678 0.234559 0.5 553 63.546 0.000110675 -3.53956 63.546000 Cu 0.765237 0.249815 6.84562e-18 423 63.546 0.000123481 -3.53973 63.546000 Cu 0.82639 0.23768 0.5 425 63.546 0.000118487 -3.53963 63.546000 Cu 0.839205 0.210259 0.5 394 63.546 8.01235e-05 -3.53972 63.546000 Cu 0.887605 0.225511 1.22741e-16 427 63.546 0.00017294 -3.5396 63.546000 Cu 0.997249 0.228508 1 428 63.546 5.7346e-05 -3.54041 63.546000 Cu 0.948873 0.213289 0.5 429 63.546 2.29655e-05 -3.53999 63.546000 Cu 0.936055 0.240744 0.5 430 63.546 0.000135186 -3.54008 63.546000 Cu 0.0943004 0.258947 2.77908e-16 464 63.546 0.000149639 -3.53989 63.546000 Cu 0.0332157 0.271193 0.5 466 63.546 0.000133732 -3.54012 63.546000 Cu 0.0819642 0.286387 1 499 63.546 0.00030979 -3.54018 63.546000 Cu 0.143011 0.27415 0.5 501 63.546 0.000271205 -3.53944 63.546000 Cu 0.191863 0.289352 9.71597e-17 500 63.546 0.000830843 -3.5393 63.546000 Cu 0.204093 0.261959 1 503 63.546 0.00032589 -3.53928 63.546000 Cu 0.313874 0.265111 1 504 63.546 0.000137689 -3.53995 63.546000 Cu 0.252847 0.277219 0.5 506 63.546 0.000355227 -3.53928 63.546000 Cu 0.374946 0.252946 0.5 510 63.546 0.000145195 -3.5401 63.546000 Cu 0.362535 0.280414 0.5 541 63.546 0.000425638 -3.54004 63.546000 Cu 0.423524 0.26822 1 543 63.546 0.000281346 -3.54053 63.546000 Cu 0.484593 0.255983 0.5 545 63.546 0.000117465 -3.54049 63.546000 Cu 0.472196 0.283471 0.5 546 63.546 0.000459421 -3.5405 63.546000 Cu 0.533216 0.271193 4.09536e-17 544 63.546 0.000133732 -3.54012 63.546000 Cu 0.5943 0.258947 0.5 550 63.546 0.000149639 -3.53989 63.546000 Cu 0.581964 0.286387 0.5 581 63.546 0.00030979 -3.54018 63.546000 Cu 0.643011 0.27415 1 583 63.546 0.000271205 -3.53944 63.546000 Cu 0.752847 0.277219 2.0657e-16 584 63.546 0.000355227 -3.53928 63.546000 Cu 0.704093 0.261959 0.5 585 63.546 0.00032589 -3.53928 63.546000 Cu 0.691863 0.289352 0.5 586 63.546 0.000830843 -3.5393 63.546000 Cu 0.813874 0.265111 0.5 426 63.546 0.000137689 -3.53995 63.546000 Cu 0.874946 0.252946 1 424 63.546 0.000145195 -3.5401 63.546000 Cu 0.862535 0.280414 6.01694e-17 459 63.546 0.000425638 -3.54004 63.546000 Cu 0.972196 0.283471 1 460 63.546 0.000459421 -3.5405 63.546000 Cu 0.923524 0.26822 0.5 461 63.546 0.000281346 -3.54053 63.546000 Cu 0.984593 0.255983 1.22501e-16 463 63.546 0.000117465 -3.54049 63.546000 Cu 0.0701114 0.313826 5.22429e-17 496 63.546 0.000343042 -3.53937 63.546000 Cu 0.0210844 0.298669 0.5 497 63.546 0.000223853 -3.54039 63.546000 Cu 0.130989 0.30156 0.5 502 63.546 0.000440873 -3.53954 63.546000 Cu 0.119362 0.328925 0.5 533 63.546 0.0012291 -3.53819 63.546000 Cu 0.00938263 0.326159 0.5 498 63.546 0.000456798 -3.54033 63.546000 Cu 0.180155 0.316732 1 535 63.546 0.00151436 -3.53845 63.546000 Cu 0.290027 0.319991 1 536 63.546 0.000294656 -3.53966 63.546000 Cu 0.240924 0.304624 0.5 537 63.546 0.000681858 -3.53893 63.546000 Cu 0.229437 0.332011 0.5 538 63.546 0.00161003 -3.53792 63.546000 Cu 0.301664 0.292544 1 539 63.546 0.000295089 -3.53944 63.546000 Cu 0.350647 0.3079 0.5 542 63.546 0.000606726 -3.54066 63.546000 Cu 0.399666 0.323268 1.20099e-19 575 63.546 0.00170851 -3.54164 63.546000 Cu 0.411345 0.295714 1 540 63.546 0.000691366 -3.54082 63.546000 Cu 0.460299 0.31098 0.5 577 63.546 0.000748528 -3.54109 63.546000 Cu 0.509383 0.326159 1 576 63.546 0.000456798 -3.54033 63.546000 Cu 0.521084 0.298669 1 579 63.546 0.000223853 -3.54039 63.546000 Cu 0.570111 0.313826 0.5 582 63.546 0.000343042 -3.53937 63.546000 Cu 0.630989 0.30156 0 580 63.546 0.000440873 -3.53954 63.546000 Cu 0.619362 0.328925 1.51925e-16 613 63.546 0.0012291 -3.53819 63.546000 Cu 0.790027 0.319991 0.5 458 63.546 0.000294656 -3.53966 63.546000 Cu 0.729437 0.332011 1.47121e-16 614 63.546 0.00161003 -3.53792 63.546000 Cu 0.680155 0.316732 0.5 615 63.546 0.00151436 -3.53845 63.546000 Cu 0.740924 0.304624 4.5037e-17 617 63.546 0.000681858 -3.53893 63.546000 Cu 0.801664 0.292544 0.5 457 63.546 0.000295089 -3.53944 63.546000 Cu 0.850647 0.3079 3.66301e-16 456 63.546 0.000606726 -3.54066 63.546000 Cu 0.911345 0.295714 0.5 462 63.546 0.000691366 -3.54082 63.546000 Cu 0.899666 0.323268 0.5 493 63.546 0.00170851 -3.54164 63.546000 Cu 0.960299 0.31098 1.7006e-16 495 63.546 0.000748528 -3.54109 63.546000 Cu 0.0470753 0.368649 1.22621e-16 528 63.546 0.0013114 -3.53872 63.546000 Cu 0.0586139 0.34124 2.5593e-16 531 63.546 0.000574027 -3.53916 63.546000 Cu 0.107982 0.356249 0.5 534 63.546 0.00329622 -3.5374 63.546000 Cu 0.157431 0.371298 1.30067e-16 567 63.546 0.0114919 -3.53419 63.546000 Cu 0.168795 0.344054 1 532 63.546 0.00395259 -3.53695 63.546000 Cu 0.218203 0.359353 0.5 569 63.546 0.00507611 -3.53567 63.546000 Cu 0.27871 0.347455 1.14334e-16 571 63.546 0.000801702 -3.53933 63.546000 Cu 0.327775 0.36305 0.5 574 63.546 0.00385414 -3.54131 63.546000 Cu 0.267456 0.374962 6.04096e-17 568 63.546 0.00266028 -3.53957 63.546000 Cu 0.38819 0.350889 6.14905e-17 572 63.546 0.00453953 -3.54203 63.546000 Cu 0.339161 0.33544 0.5 573 63.546 0.00136329 -3.54096 63.546000 Cu 0.44872 0.338553 0.5 578 63.546 0.00215618 -3.54185 63.546000 Cu 0.437135 0.366199 0.5 607 63.546 0.00596137 -3.54163 63.546000 Cu 0.497862 0.353682 4.92404e-18 609 63.546 0.00112299 -3.54095 63.546000 Cu 0.558614 0.34124 0.5 611 63.546 0.000574027 -3.53916 63.546000 Cu 0.547075 0.368649 0.5 612 63.546 0.0013114 -3.53872 63.546000 Cu 0.607982 0.356249 0 610 63.546 0.00329622 -3.5374 63.546000 Cu 0.657431 0.371298 0.5 637 63.546 0.0114919 -3.53419 63.546000 Cu 0.77871 0.347455 0.5 489 63.546 0.000801702 -3.53933 63.546000 Cu 0.668795 0.344054 0.5 616 63.546 0.00395259 -3.53695 63.546000 Cu 0.718203 0.359353 1 639 63.546 0.00507611 -3.53567 63.546000 Cu 0.767456 0.374962 0.5 490 63.546 0.00266028 -3.53957 63.546000 Cu 0.827775 0.36305 1.38354e-16 488 63.546 0.00385414 -3.54131 63.546000 Cu 0.839161 0.33544 8.4069e-18 491 63.546 0.00136329 -3.54096 63.546000 Cu 0.94872 0.338553 1 492 63.546 0.00215618 -3.54185 63.546000 Cu 0.88819 0.350889 0.5 494 63.546 0.00453953 -3.54203 63.546000 Cu 0.937135 0.366199 1 527 63.546 0.00596137 -3.54163 63.546000 Cu 0.997862 0.353682 0.5 529 63.546 0.00112299 -3.54095 63.546000 Cu 0.0356062 0.396044 2.82232e-17 563 63.546 0.00297322 -3.53805 63.546000 Cu 0.146272 0.398417 1.83631e-16 564 63.546 0.0343338 -3.52844 63.546000 Cu 0.0965322 0.383511 0.5 565 63.546 0.00781905 -3.5357 63.546000 Cu 0.0851776 0.410693 0.5 566 63.546 0.0174164 -3.53341 63.546000 Cu 0.196246 0.41371 0.5 599 63.546 0.0842032 -3.51759 63.546000 Cu 0.207051 0.386608 0.5 570 63.546 0.0191854 -3.53121 63.546000 Cu 0.256558 0.402578 8.41891e-17 601 63.546 0.0115994 -3.53921 63.546000 Cu 0.316496 0.390796 0.5 603 63.546 0.0126552 -3.54142 63.546000 Cu 0.3653 0.406558 3.63418e-16 602 63.546 0.0311046 -3.54065 63.546000 Cu 0.376681 0.378625 1.41956e-16 605 63.546 0.0121386 -3.54225 63.546000 Cu 0.486222 0.381239 1.15175e-16 606 63.546 0.00273522 -3.54014 63.546000 Cu 0.425639 0.393943 0.5 608 63.546 0.012817 -3.54135 63.546000 Cu 0.474668 0.408881 1 631 63.546 0.00607898 -3.53879 63.546000 Cu 0.585178 0.410693 6.00493e-19 632 63.546 0.0174164 -3.53341 63.546000 Cu 0.535606 0.396044 0.5 633 63.546 0.00297322 -3.53805 63.546000 Cu 0.596532 0.383511 1.22861e-16 635 63.546 0.00781905 -3.5357 63.546000 Cu 0.646272 0.398417 0.5 638 63.546 0.0343338 -3.52844 63.546000 Cu 0.756558 0.402578 0.5 330 63.546 0.0115994 -3.53921 63.546000 Cu 0.707051 0.386608 1.2238e-16 636 63.546 0.0191854 -3.53121 63.546000 Cu 0.696246 0.41371 2.45001e-16 652 63.546 0.0842032 -3.51759 63.546000 Cu 0.816496 0.390796 2.72143e-16 523 63.546 0.0126552 -3.54142 63.546000 Cu 0.925639 0.393943 1.20099e-19 524 63.546 0.012817 -3.54135 63.546000 Cu 0.876681 0.378625 0.5 525 63.546 0.0121386 -3.54225 63.546000 Cu 0.8653 0.406558 0.5 526 63.546 0.0311046 -3.54065 63.546000 Cu 0.986222 0.381239 0.5 530 63.546 0.00273522 -3.54014 63.546000 Cu 0.974668 0.408881 0.5 561 63.546 0.00607898 -3.53879 63.546000 Cu 0.0238507 0.423465 1 560 63.546 0.0066183 -3.5358 63.546000 Cu 0.123 0.451874 1.20099e-19 594 63.546 0.495294 -3.4936 63.546000 Cu 0.0731223 0.437778 0.5 595 63.546 0.0354826 -3.53093 63.546000 Cu 0.135164 0.425317 3.60296e-19 597 63.546 0.117192 -3.51968 63.546000 Cu 0.0117397 0.450997 8.11866e-17 593 63.546 0.0223539 -3.53401 63.546000 Cu 0.185551 0.440463 0.5 600 63.546 0.52654 -3.47433 63.546000 Cu 0.246 0.430533 1.49162e-16 598 63.546 0.0916039 -3.53029 63.546000 Cu 0.305265 0.418781 0.5 604 63.546 0.0416944 -3.53771 63.546000 Cu 0.293564 0.447427 0.5 625 63.546 0.224159 -3.52185 63.546000 Cu 0.353611 0.434883 1.20099e-19 627 63.546 0.0771741 -3.53243 63.546000 Cu 0.413907 0.42189 0.5 629 63.546 0.0280357 -3.53837 63.546000 Cu 0.401486 0.450267 0.5 630 63.546 0.0712393 -3.52737 63.546000 Cu 0.462507 0.43669 1 628 63.546 0.0139244 -3.53394 63.546000 Cu 0.523851 0.423465 0.5 634 63.546 0.0066183 -3.5358 63.546000 Cu 0.51174 0.450997 0.5 646 63.546 0.0223539 -3.53401 63.546000 Cu 0.573122 0.437778 1 648 63.546 0.0354826 -3.53093 63.546000 Cu 0.635164 0.425317 0.5 650 63.546 0.117192 -3.51968 63.546000 Cu 0.623 0.451874 0.5 651 63.546 0.495294 -3.4936 63.546000 Cu 0.746 0.430533 0.5 328 63.546 0.0916039 -3.53029 63.546000 Cu 0.793564 0.447427 1 555 63.546 0.224159 -3.52185 63.546000 Cu 0.685551 0.440463 5.52453e-18 649 63.546 0.52654 -3.47433 63.546000 Cu 0.805265 0.418781 1.20099e-19 522 63.546 0.0416944 -3.53771 63.546000 Cu 0.901486 0.450267 1 556 63.546 0.0712393 -3.52737 63.546000 Cu 0.853611 0.434883 0.5 557 63.546 0.0771741 -3.53243 63.546000 Cu 0.913907 0.42189 1.74383e-16 559 63.546 0.0280357 -3.53837 63.546000 Cu 0.962507 0.43669 0.5 562 63.546 0.0139244 -3.53394 63.546000 Cu 0.0617709 0.464978 0.5 596 63.546 0.116611 -3.53285 63.546000 Cu 0.0617419 0.492317 0.5 618 63.546 0.12063 -3.53195 63.546000 Cu 0.115537 0.478646 7.93851e-17 619 63.546 3.2795 -3.48477 63.546000 Cu 0.0046355 0.47866 1 590 63.546 0.146917 -3.54508 63.546000 Cu 0.172372 0.466171 0.5 621 63.546 7.56508 -3.26835 63.546000 Cu 0.172276 0.491118 0.5 622 63.546 7.5729 -3.26789 63.546000 Cu 0.236667 0.459816 3.75908e-17 623 63.546 5.70896 -3.4697 63.546000 Cu 0.236651 0.497449 1 620 63.546 5.69311 -3.47102 63.546000 Cu 0.277516 0.478644 0.5 626 63.546 4.57103 -3.57734 63.546000 Cu 0.341483 0.464184 1 624 63.546 0.343904 -3.49689 63.546000 Cu 0.341509 0.493106 2.40197e-19 641 63.546 0.345587 -3.49679 63.546000 Cu 0.392622 0.478662 0.5 643 63.546 0.313672 -3.51764 63.546000 Cu 0.451529 0.492606 3.0445e-16 642 63.546 0.0849542 -3.5263 63.546000 Cu 0.4515 0.464706 8.79121e-17 644 63.546 0.0835218 -3.52659 63.546000 Cu 0.561742 0.492317 3.60296e-19 323 63.546 0.12063 -3.53195 63.546000 Cu 0.561771 0.464978 1 645 63.546 0.116611 -3.53285 63.546000 Cu 0.504636 0.47866 0.5 647 63.546 0.146917 -3.54508 63.546000 Cu 0.615537 0.478646 0.5 60 63.546 3.2795 -3.48477 63.546000 Cu 0.736667 0.459816 0.5 16 63.546 5.70896 -3.4697 63.546000 Cu 0.736651 0.497449 0.5 14 63.546 5.69311 -3.47102 63.546000 Cu 0.672372 0.466171 1.20099e-19 58 63.546 7.56508 -3.26835 63.546000 Cu 0.672276 0.491118 1 303 63.546 7.5729 -3.26789 63.546000 Cu 0.777516 0.478644 1 554 63.546 4.57103 -3.57734 63.546000 Cu 0.841483 0.464184 0.5 558 63.546 0.343904 -3.49689 63.546000 Cu 0.841509 0.493106 0.5 588 63.546 0.345587 -3.49679 63.546000 Cu 0.892622 0.478662 1 589 63.546 0.313672 -3.51764 63.546000 Cu 0.9515 0.464706 0.5 591 63.546 0.0835218 -3.52659 63.546000 Cu 0.951529 0.492606 0.5 592 63.546 0.0849542 -3.5263 63.546000 Cu 0.122974 0.505409 3.01447e-17 1 63.546 0.498406 -3.49282 63.546000 Cu 0.0118017 0.506304 1 4 63.546 0.0244009 -3.53348 63.546000 Cu 0.0242871 0.533817 4.80394e-19 5 63.546 0.00698652 -3.53572 63.546000 Cu 0.0732914 0.519499 0.5 6 63.546 0.0357319 -3.53029 63.546000 Cu 0.135566 0.531942 1 8 63.546 0.11535 -3.51934 63.546000 Cu 0.185672 0.516809 0.5 2 63.546 0.528347 -3.47482 63.546000 Cu 0.246253 0.526726 1 59 63.546 0.0911029 -3.5313 63.546000 Cu 0.305796 0.538453 0.5 64 63.546 0.0446705 -3.53843 63.546000 Cu 0.293604 0.509842 0.5 640 63.546 0.227401 -3.52274 63.546000 Cu 0.353842 0.522393 1 61 63.546 0.0774805 -3.53276 63.546000 Cu 0.462702 0.520609 2.00565e-17 32 63.546 0.0144766 -3.53401 63.546000 Cu 0.401571 0.507046 0.5 34 63.546 0.0699538 -3.52751 63.546000 Cu 0.414372 0.535403 0.5 63 63.546 0.0256348 -3.53836 63.546000 Cu 0.511802 0.506304 0.5 33 63.546 0.0244009 -3.53348 63.546000 Cu 0.573291 0.519499 1 35 63.546 0.0357319 -3.53029 63.546000 Cu 0.524287 0.533817 0.5 38 63.546 0.00698652 -3.53572 63.546000 Cu 0.622974 0.505409 0.5 15 63.546 0.498406 -3.49282 63.546000 Cu 0.635566 0.531942 0.5 37 63.546 0.11535 -3.51934 63.546000 Cu 0.685672 0.516809 1 13 63.546 0.528347 -3.47482 63.546000 Cu 0.746253 0.526726 0.5 19 63.546 0.0911029 -3.5313 63.546000 Cu 0.793604 0.509842 1 587 63.546 0.227401 -3.52274 63.546000 Cu 0.805796 0.538453 1 17 63.546 0.0446705 -3.53843 63.546000 Cu 0.901571 0.507046 1 3 63.546 0.0699538 -3.52751 63.546000 Cu 0.962702 0.520609 0.5 7 63.546 0.0144766 -3.53401 63.546000 Cu 0.853842 0.522393 0.5 18 63.546 0.0774805 -3.53276 63.546000 Cu 0.914372 0.535403 1 20 63.546 0.0256348 -3.53836 63.546000 Cu 0.147606 0.558795 1 9 63.546 0.033499 -3.52768 63.546000 Cu 0.0859985 0.546555 0.5 11 63.546 0.0167993 -3.53297 63.546000 Cu 0.0370034 0.561201 2.44881e-16 24 63.546 0.00323805 -3.53759 63.546000 Cu 0.0985523 0.573679 0.5 26 63.546 0.007344 -3.5354 63.546000 Cu 0.196968 0.543527 0.5 10 63.546 0.08431 -3.51772 63.546000 Cu 0.208902 0.570565 0.5 12 63.546 0.0188057 -3.5306 63.546000 Cu 0.257647 0.554633 1 92 63.546 0.0116831 -3.53955 63.546000 Cu 0.269798 0.582177 2.40197e-17 93 63.546 0.00259596 -3.53955 63.546000 Cu 0.318051 0.566386 0.5 94 63.546 0.0146562 -3.54159 63.546000 Cu 0.366226 0.550689 1 62 63.546 0.0311649 -3.54095 63.546000 Cu 0.378842 0.578565 6.00493e-19 95 63.546 0.0121381 -3.5427 63.546000 Cu 0.475544 0.548403 1.22621e-16 65 63.546 0.00541618 -3.53852 63.546000 Cu 0.488335 0.575994 5.68066e-17 66 63.546 0.00213648 -3.54002 63.546000 Cu 0.427093 0.563316 0.5 68 63.546 0.0107927 -3.54135 63.546000 Cu 0.537003 0.561201 0.5 67 63.546 0.00323805 -3.53759 63.546000 Cu 0.585999 0.546555 7.02577e-17 36 63.546 0.0167993 -3.53297 63.546000 Cu 0.598552 0.573679 1 69 63.546 0.007344 -3.5354 63.546000 Cu 0.647606 0.558795 0.5 42 63.546 0.033499 -3.52768 63.546000 Cu 0.696968 0.543527 1 39 63.546 0.08431 -3.51772 63.546000 Cu 0.708902 0.570565 1 40 63.546 0.0188057 -3.5306 63.546000 Cu 0.757647 0.554633 0.5 41 63.546 0.0116831 -3.53955 63.546000 Cu 0.769798 0.582177 0.5 46 63.546 0.00259596 -3.53955 63.546000 Cu 0.818051 0.566386 1 43 63.546 0.0146562 -3.54159 63.546000 Cu 0.988335 0.575994 0.5 27 63.546 0.00213648 -3.54002 63.546000 Cu 0.927093 0.563316 0 21 63.546 0.0107927 -3.54135 63.546000 Cu 0.975544 0.548403 0.5 22 63.546 0.00541618 -3.53852 63.546000 Cu 0.866226 0.550689 0.5 23 63.546 0.0311649 -3.54095 63.546000 Cu 0.878842 0.578565 0.5 45 63.546 0.0121381 -3.5427 63.546000 Cu 0.0497668 0.588547 8.19072e-17 25 63.546 0.00156231 -3.53848 63.546000 Cu 0.160003 0.585843 0 28 63.546 0.0102562 -3.5338 63.546000 Cu 0.111199 0.600883 0.5 31 63.546 0.00309059 -3.53717 63.546000 Cu 0.00120061 0.603489 0.5 49 63.546 0.000780265 -3.53979 63.546000 Cu 0.0625488 0.615885 2.07891e-16 51 63.546 0.00066468 -3.53858 63.546000 Cu 0.172589 0.613017 4.01129e-16 29 63.546 0.00307737 -3.537 63.546000 Cu 0.221283 0.597759 0.5 30 63.546 0.00511431 -3.53584 63.546000 Cu 0.330649 0.594059 0.5 98 63.546 0.00521233 -3.54175 63.546000 Cu 0.28236 0.609617 1.20099e-19 124 63.546 0.000881024 -3.53989 63.546000 Cu 0.343318 0.621617 0.5 126 63.546 0.00184658 -3.54108 63.546000 Cu 0.391649 0.606227 3.17901e-16 96 63.546 0.00480558 -3.54189 63.546000 Cu 0.43994 0.591007 0.5 97 63.546 0.00411445 -3.54135 63.546000 Cu 0.452738 0.618572 0.5 102 63.546 0.00157348 -3.54106 63.546000 Cu 0.549767 0.588547 0.5 72 63.546 0.00156231 -3.53848 63.546000 Cu 0.501201 0.603489 1 99 63.546 0.000780265 -3.53979 63.546000 Cu 0.562549 0.615885 0.5 101 63.546 0.00066468 -3.53858 63.546000 Cu 0.611199 0.600883 1.99123e-16 70 63.546 0.00309059 -3.53717 63.546000 Cu 0.660003 0.585843 0.5 71 63.546 0.0102562 -3.5338 63.546000 Cu 0.721283 0.597759 1.20099e-19 73 63.546 0.00511431 -3.53584 63.546000 Cu 0.78236 0.609617 0.5 75 63.546 0.000881024 -3.53989 63.546000 Cu 0.672589 0.613017 0.5 76 63.546 0.00307737 -3.537 63.546000 Cu 0.830649 0.594059 0 44 63.546 0.00521233 -3.54175 63.546000 Cu 0.93994 0.591007 8.75518e-17 47 63.546 0.00411445 -3.54135 63.546000 Cu 0.952738 0.618572 1 48 63.546 0.00157348 -3.54106 63.546000 Cu 0.891649 0.606227 0.5 50 63.546 0.00480558 -3.54189 63.546000 Cu 0.843318 0.621617 1 77 63.546 0.00184658 -3.54108 63.546000 Cu 0.0751822 0.643232 1 52 63.546 0.000289344 -3.53954 63.546000 Cu 0.12388 0.628147 0.5 53 63.546 0.00126291 -3.53832 63.546000 Cu 0.0139646 0.630928 0.5 54 63.546 0.00036184 -3.54016 63.546000 Cu 0.136301 0.655471 0.5 57 63.546 0.000569615 -3.53913 63.546000 Cu 0.0264213 0.658354 0.5 83 63.546 0.000138277 -3.54022 63.546000 Cu 0.185124 0.640293 1 55 63.546 0.00117321 -3.53864 63.546000 Cu 0.2338 0.62504 0.5 127 63.546 0.00152349 -3.53833 63.546000 Cu 0.294865 0.637041 1 125 63.546 0.000397917 -3.53984 63.546000 Cu 0.246152 0.652387 0.5 157 63.546 0.000596743 -3.53907 63.546000 Cu 0.307083 0.664466 5.15223e-17 158 63.546 0.000155071 -3.53995 63.546000 Cu 0.355755 0.649116 0.5 131 63.546 0.000691844 -3.54091 63.546000 Cu 0.404299 0.63379 3.37477e-17 128 63.546 0.0017854 -3.54139 63.546000 Cu 0.416724 0.661294 4.80394e-19 129 63.546 0.000630887 -3.54075 63.546000 Cu 0.465345 0.64607 0.5 130 63.546 0.000582949 -3.54103 63.546000 Cu 0.513965 0.630928 1.07608e-16 100 63.546 0.00036184 -3.54016 63.546000 Cu 0.575182 0.643232 0.5 106 63.546 0.000289344 -3.53954 63.546000 Cu 0.526421 0.658354 1 132 63.546 0.000138277 -3.54022 63.546000 Cu 0.62388 0.628147 1 103 63.546 0.00126291 -3.53832 63.546000 Cu 0.636301 0.655471 3.67381e-16 104 63.546 0.000569615 -3.53913 63.546000 Cu 0.7338 0.62504 1 74 63.546 0.00152349 -3.53833 63.546000 Cu 0.685124 0.640293 0.5 105 63.546 0.00117321 -3.53864 63.546000 Cu 0.746152 0.652387 2.44881e-16 107 63.546 0.000596743 -3.53907 63.546000 Cu 0.794865 0.637041 0.5 80 63.546 0.000397917 -3.53984 63.546000 Cu 0.807083 0.664466 0.5 109 63.546 0.000155071 -3.53995 63.546000 Cu 0.855755 0.649116 1.18297e-16 78 63.546 0.000691844 -3.54091 63.546000 Cu 0.904299 0.63379 0.5 79 63.546 0.0017854 -3.54139 63.546000 Cu 0.965345 0.64607 2.97844e-17 81 63.546 0.000582949 -3.54103 63.546000 Cu 0.916724 0.661294 0.5 84 63.546 0.000630887 -3.54075 63.546000 Cu 0.0874427 0.670613 2.48244e-16 85 63.546 0.000166662 -3.53975 63.546000 Cu 0.099438 0.698033 1.05687e-16 86 63.546 0.000172743 -3.53978 63.546000 Cu 0.148372 0.682826 0.5 87 63.546 0.000186974 -3.53886 63.546000 Cu 0.0386152 0.68579 0.5 88 63.546 0.000124331 -3.54033 63.546000 Cu 0.197313 0.66763 2.4344e-16 56 63.546 0.0004013 -3.53865 63.546000 Cu 0.209254 0.694979 2.97844e-17 89 63.546 4.91328e-05 -3.53884 63.546000 Cu 0.319131 0.691863 1 159 63.546 9.41326e-05 -3.53989 63.546000 Cu 0.258213 0.679754 0.5 161 63.546 0.000190139 -3.53897 63.546000 Cu 0.270187 0.707117 0.5 190 63.546 0.000113398 -3.53946 63.546000 Cu 0.367973 0.676574 0.5 160 63.546 0.000278439 -3.54041 63.546000 Cu 0.379971 0.704005 0.5 165 63.546 0.000278309 -3.54015 63.546000 Cu 0.477659 0.673525 0.5 135 63.546 0.000289278 -3.54044 63.546000 Cu 0.428889 0.688752 1 162 63.546 0.000399298 -3.54064 63.546000 Cu 0.489691 0.700997 0.5 164 63.546 8.63993e-05 -3.54069 63.546000 Cu 0.538615 0.68579 4.80394e-19 133 63.546 0.000124331 -3.54033 63.546000 Cu 0.587443 0.670613 0.5 134 63.546 0.000166662 -3.53975 63.546000 Cu 0.599438 0.698033 0.5 139 63.546 0.000172743 -3.53978 63.546000 Cu 0.648372 0.682826 1 136 63.546 0.000186974 -3.53886 63.546000 Cu 0.758213 0.679754 1 108 63.546 0.000190139 -3.53897 63.546000 Cu 0.697313 0.66763 0.5 110 63.546 0.0004013 -3.53865 63.546000 Cu 0.709254 0.694979 0.5 138 63.546 4.91328e-05 -3.53884 63.546000 Cu 0.770187 0.707117 1.2238e-16 140 63.546 0.000113398 -3.53946 63.546000 Cu 0.819131 0.691863 0.5 114 63.546 9.41326e-05 -3.53989 63.546000 Cu 0.989691 0.700997 1.2226e-16 115 63.546 8.63993e-05 -3.54069 63.546000 Cu 0.977659 0.673525 1.04726e-16 82 63.546 0.000289278 -3.54044 63.546000 Cu 0.867973 0.676574 1 111 63.546 0.000278439 -3.54041 63.546000 Cu 0.879971 0.704005 1.05326e-16 112 63.546 0.000278309 -3.54015 63.546000 Cu 0.928889 0.688752 0.5 113 63.546 0.000399298 -3.54064 63.546000 Cu 0.160318 0.710209 0.5 91 63.546 0.000112854 -3.53977 63.546000 Cu 0.00142106 0.728471 1.30307e-16 116 63.546 2.64227e-05 -3.54073 63.546000 Cu 0.0504523 0.713242 0.5 117 63.546 6.77704e-05 -3.54062 63.546000 Cu 0.111266 0.725456 1 119 63.546 0.000157539 -3.5404 63.546000 Cu 0.0621397 0.740693 0.5 122 63.546 7.9947e-05 -3.54021 63.546000 Cu 0.172001 0.737619 0.5 121 63.546 2.24863e-05 -3.53995 63.546000 Cu 0.22115 0.722354 2.48124e-16 90 63.546 0.000133424 -3.53979 63.546000 Cu 0.330963 0.719278 1.22861e-16 191 63.546 6.96323e-05 -3.53957 63.546000 Cu 0.281892 0.734525 0.5 194 63.546 7.02994e-05 -3.53947 63.546000 Cu 0.23269 0.749764 1 222 63.546 6.47589e-05 -3.53956 63.546000 Cu 0.342565 0.746705 1 192 63.546 5.91625e-05 -3.53953 63.546000 Cu 0.391678 0.731464 0.5 193 63.546 0.000104933 -3.54012 63.546000 Cu 0.440663 0.716222 1 163 63.546 8.39525e-05 -3.54052 63.546000 Cu 0.452401 0.743698 1 195 63.546 3.20713e-05 -3.54061 63.546000 Cu 0.550452 0.713242 2.40197e-19 166 63.546 6.77704e-05 -3.54062 63.546000 Cu 0.56214 0.740693 1.73422e-16 167 63.546 7.9947e-05 -3.54021 63.546000 Cu 0.501421 0.728471 0.5 169 63.546 2.64227e-05 -3.54073 63.546000 Cu 0.660318 0.710209 2.40197e-19 137 63.546 0.000112854 -3.53977 63.546000 Cu 0.611266 0.725456 0.5 168 63.546 0.000157539 -3.5404 63.546000 Cu 0.781892 0.734525 1 141 63.546 7.02994e-05 -3.53947 63.546000 Cu 0.72115 0.722354 0.5 143 63.546 0.000133424 -3.53979 63.546000 Cu 0.672001 0.737619 1 170 63.546 2.24863e-05 -3.53995 63.546000 Cu 0.73269 0.749764 0.5 172 63.546 6.47589e-05 -3.53956 63.546000 Cu 0.830963 0.719278 0.5 142 63.546 6.96323e-05 -3.53957 63.546000 Cu 0.940663 0.716222 0.5 118 63.546 8.39525e-05 -3.54052 63.546000 Cu 0.891678 0.731464 1 144 63.546 0.000104933 -3.54012 63.546000 Cu 0.952401 0.743698 0.5 146 63.546 3.20713e-05 -3.54061 63.546000 Cu 0.842565 0.746705 0.5 147 63.546 5.91625e-05 -3.53953 63.546000 Cu 0.122842 0.752885 6.00493e-19 120 63.546 8.35796e-05 -3.54001 63.546000 Cu 0.0130939 0.755948 2.97844e-17 148 63.546 0.000144542 -3.54016 63.546000 Cu 0.0247531 0.783417 1.19978e-16 149 63.546 0.000282928 -3.54044 63.546000 Cu 0.0737893 0.768159 0.5 150 63.546 0.000142931 -3.54022 63.546000 Cu 0.134453 0.780349 1 152 63.546 0.000149246 -3.54042 63.546000 Cu 0.18355 0.765038 0.5 123 63.546 4.4653e-05 -3.53987 63.546000 Cu 0.2442 0.777185 3.01447e-17 223 63.546 0.000131731 -3.53964 63.546000 Cu 0.293369 0.761928 0.5 224 63.546 0.00011431 -3.53924 63.546000 Cu 0.304894 0.789321 0.5 228 63.546 0.000479755 -3.53909 63.546000 Cu 0.35412 0.774107 2.10172e-16 225 63.546 0.000211677 -3.53942 63.546000 Cu 0.464025 0.771162 1 196 63.546 7.16834e-05 -3.54015 63.546000 Cu 0.40328 0.758913 0.5 198 63.546 7.08248e-05 -3.54012 63.546000 Cu 0.414888 0.786336 0.5 227 63.546 0.000125728 -3.53998 63.546000 Cu 0.513094 0.755948 0.5 197 63.546 0.000144542 -3.54016 63.546000 Cu 0.573789 0.768159 2.82352e-16 199 63.546 0.000142931 -3.54022 63.546000 Cu 0.524753 0.783417 0.5 202 63.546 0.000282928 -3.54044 63.546000 Cu 0.622842 0.752885 0.5 173 63.546 8.35796e-05 -3.54001 63.546000 Cu 0.634453 0.780349 0.5 201 63.546 0.000149246 -3.54042 63.546000 Cu 0.68355 0.765038 1 171 63.546 4.4653e-05 -3.53987 63.546000 Cu 0.7442 0.777185 0.5 177 63.546 0.000131731 -3.53964 63.546000 Cu 0.793369 0.761928 1 174 63.546 0.00011431 -3.53924 63.546000 Cu 0.804894 0.789321 3.57533e-16 175 63.546 0.000479755 -3.53909 63.546000 Cu 0.90328 0.758913 1 145 63.546 7.08248e-05 -3.54012 63.546000 Cu 0.964025 0.771162 0.5 151 63.546 7.16834e-05 -3.54015 63.546000 Cu 0.85412 0.774107 0.5 176 63.546 0.000211677 -3.53942 63.546000 Cu 0.914888 0.786336 5.44046e-17 178 63.546 0.000125728 -3.53998 63.546000 Cu 0.146134 0.807857 1 153 63.546 0.00063924 -3.54084 63.546000 Cu 0.0854442 0.795654 0.5 155 63.546 0.000481277 -3.5409 63.546000 Cu 0.036513 0.810907 1.22501e-16 182 63.546 0.000673915 -3.5411 63.546000 Cu 0.0973637 0.823194 0.5 184 63.546 0.00142639 -3.54136 63.546000 Cu 0.195079 0.792492 0.5 154 63.546 0.000171688 -3.54022 63.546000 Cu 0.206873 0.819966 0.5 156 63.546 0.000501703 -3.54001 63.546000 Cu 0.25577 0.804603 1.36672e-16 256 63.546 0.000567725 -3.53926 63.546000 Cu 0.267759 0.831972 3.60296e-19 257 63.546 0.00132685 -3.53774 63.546000 Cu 0.316686 0.816675 0.5 258 63.546 0.00163785 -3.53805 63.546000 Cu 0.365683 0.801486 1.03165e-16 226 63.546 0.00094876 -3.53893 63.546000 Cu 0.377727 0.828831 1 259 63.546 0.00196815 -3.53827 63.546000 Cu 0.475636 0.798618 1 229 63.546 0.00031361 -3.54048 63.546000 Cu 0.487689 0.826081 2.45121e-16 230 63.546 0.000558398 -3.5406 63.546000 Cu 0.426667 0.813752 0.5 232 63.546 0.000314884 -3.53951 63.546000 Cu 0.536513 0.810907 0.5 231 63.546 0.000673915 -3.5411 63.546000 Cu 0.585444 0.795654 1 200 63.546 0.000481277 -3.5409 63.546000 Cu 0.597364 0.823194 1 233 63.546 0.00142639 -3.54136 63.546000 Cu 0.646134 0.807857 0.5 206 63.546 0.00063924 -3.54084 63.546000 Cu 0.695079 0.792492 1.92158e-17 203 63.546 0.000171688 -3.54022 63.546000 Cu 0.706873 0.819966 1 204 63.546 0.000501703 -3.54001 63.546000 Cu 0.75577 0.804603 0.5 205 63.546 0.000567725 -3.53926 63.546000 Cu 0.767759 0.831972 0.5 210 63.546 0.00132685 -3.53774 63.546000 Cu 0.816686 0.816675 2.97844e-17 207 63.546 0.00163785 -3.53805 63.546000 Cu 0.987689 0.826081 0.5 185 63.546 0.000558398 -3.5406 63.546000 Cu 0.926667 0.813752 1 179 63.546 0.000314884 -3.53951 63.546000 Cu 0.975636 0.798618 0.5 180 63.546 0.00031361 -3.54048 63.546000 Cu 0.865683 0.801486 0.5 181 63.546 0.00094876 -3.53893 63.546000 Cu 0.877727 0.828831 0.5 209 63.546 0.00196815 -3.53827 63.546000 Cu 0.0487795 0.838457 0 183 63.546 0.00177962 -3.54124 63.546000 Cu 0.158179 0.835395 1 186 63.546 0.00192538 -3.54078 63.546000 Cu 0.109738 0.850804 0.5 189 63.546 0.00433348 -3.5419 63.546000 Cu 0.000219459 0.85357 0.5 213 63.546 0.00113318 -3.54026 63.546000 Cu 0.0613479 0.866087 1 215 63.546 0.00538156 -3.54147 63.546000 Cu 0.170612 0.862982 2.24584e-17 187 63.546 0.00500733 -3.54166 63.546000 Cu 0.219069 0.847408 0.5 188 63.546 0.000973294 -3.53923 63.546000 Cu 0.328872 0.843965 0.5 262 63.546 0.00456415 -3.53642 63.546000 Cu 0.280087 0.859263 2.97844e-17 286 63.546 0.00503131 -3.5353 63.546000 Cu 0.231308 0.874867 0.5 289 63.546 0.00294396 -3.53965 63.546000 Cu 0.341243 0.87118 0.5 288 63.546 0.0123704 -3.53409 63.546000 Cu 0.390137 0.856139 0 260 63.546 0.00359416 -3.53724 63.546000 Cu 0.438934 0.841154 0.5 261 63.546 0.000483725 -3.53932 63.546000 Cu 0.451513 0.868534 0.5 266 63.546 0.00146538 -3.53822 63.546000 Cu 0.54878 0.838457 0.5 236 63.546 0.00177962 -3.54124 63.546000 Cu 0.500219 0.85357 2.40197e-19 263 63.546 0.00113318 -3.54026 63.546000 Cu 0.561348 0.866087 0.5 265 63.546 0.00538156 -3.54147 63.546000 Cu 0.609738 0.850804 1 234 63.546 0.00433348 -3.5419 63.546000 Cu 0.658179 0.835395 0.5 235 63.546 0.00192538 -3.54078 63.546000 Cu 0.719069 0.847408 1.68738e-16 237 63.546 0.000973294 -3.53923 63.546000 Cu 0.731308 0.874867 1 238 63.546 0.00294396 -3.53965 63.546000 Cu 0.780087 0.859263 0.5 239 63.546 0.00503131 -3.5353 63.546000 Cu 0.670612 0.862982 0.5 240 63.546 0.00500733 -3.54166 63.546000 Cu 0.828872 0.843965 6.40125e-17 208 63.546 0.00456415 -3.53642 63.546000 Cu 0.938934 0.841154 1 211 63.546 0.000483725 -3.53932 63.546000 Cu 0.951513 0.868534 2.45001e-16 212 63.546 0.00146538 -3.53822 63.546000 Cu 0.890137 0.856139 0.5 214 63.546 0.00359416 -3.53724 63.546000 Cu 0.841243 0.87118 3.24266e-18 241 63.546 0.0123704 -3.53409 63.546000 Cu 0.0736608 0.893841 2.97844e-17 216 63.546 0.0136106 -3.54176 63.546000 Cu 0.122187 0.878538 0.5 217 63.546 0.0134189 -3.54259 63.546000 Cu 0.0127417 0.881115 0.5 218 63.546 0.00296527 -3.53973 63.546000 Cu 0.134174 0.90648 0.5 221 63.546 0.0348703 -3.54063 63.546000 Cu 0.0247888 0.908762 0.5 247 63.546 0.00574705 -3.5393 63.546000 Cu 0.182682 0.890703 1.2202e-16 219 63.546 0.0139815 -3.54168 63.546000 Cu 0.292044 0.886482 8.49097e-17 287 63.546 0.0201729 -3.53125 63.546000 Cu 0.242844 0.902449 0.5 309 63.546 0.0108847 -3.53888 63.546000 Cu 0.303246 0.913573 2.97844e-17 310 63.546 0.0844221 -3.51804 63.546000 Cu 0.352995 0.898282 0.5 293 63.546 0.0350433 -3.52855 63.546000 Cu 0.402498 0.883388 1 290 63.546 0.008023 -3.53569 63.546000 Cu 0.414253 0.910566 1 291 63.546 0.017013 -3.53343 63.546000 Cu 0.463673 0.89591 0.5 292 63.546 0.0033949 -3.53807 63.546000 Cu 0.512742 0.881115 2.45001e-16 264 63.546 0.00296527 -3.53973 63.546000 Cu 0.573661 0.893841 0.5 270 63.546 0.0136106 -3.54176 63.546000 Cu 0.524789 0.908762 2.97844e-17 294 63.546 0.00574705 -3.5393 63.546000 Cu 0.622187 0.878538 2.97844e-17 267 63.546 0.0134189 -3.54259 63.546000 Cu 0.634174 0.90648 2.97844e-17 268 63.546 0.0348703 -3.54063 63.546000 Cu 0.682682 0.890703 0.5 269 63.546 0.0139815 -3.54168 63.546000 Cu 0.742844 0.902449 1.18177e-16 271 63.546 0.0108847 -3.53888 63.546000 Cu 0.792044 0.886482 0.5 244 63.546 0.0201729 -3.53125 63.546000 Cu 0.803246 0.913573 0.5 273 63.546 0.0844221 -3.51804 63.546000 Cu 0.852995 0.898282 2.97844e-17 242 63.546 0.0350433 -3.52855 63.546000 Cu 0.902498 0.883388 0.5 243 63.546 0.008023 -3.53569 63.546000 Cu 0.963673 0.89591 2.44881e-16 245 63.546 0.0033949 -3.53807 63.546000 Cu 0.914253 0.910566 0.5 248 63.546 0.017013 -3.53343 63.546000 Cu 0.0857585 0.921798 0 249 63.546 0.029925 -3.53818 63.546000 Cu 0.0984097 0.950167 7.68631e-18 250 63.546 0.0711518 -3.52712 63.546000 Cu 0.14612 0.934799 0.5 251 63.546 0.0836762 -3.53233 63.546000 Cu 0.037193 0.936575 0.5 252 63.546 0.0131345 -3.53367 63.546000 Cu 0.194302 0.918676 2.97844e-17 220 63.546 0.0428597 -3.53698 63.546000 Cu 0.206324 0.947316 1.18297e-16 253 63.546 0.223257 -3.52229 63.546000 Cu 0.314273 0.940352 1.56488e-16 311 63.546 0.509609 -3.47685 63.546000 Cu 0.253696 0.93037 0.5 313 63.546 0.0837172 -3.53177 63.546000 Cu 0.364448 0.925183 0.5 312 63.546 0.115697 -3.52045 63.546000 Cu 0.376891 0.951769 0.5 317 63.546 0.481553 -3.49273 63.546000 Cu 0.475744 0.923331 0.5 297 63.546 0.00696208 -3.53564 63.546000 Cu 0.426577 0.937649 2.97844e-17 314 63.546 0.0357396 -3.53073 63.546000 Cu 0.488105 0.950868 0.5 316 63.546 0.0213023 -3.53365 63.546000 Cu 0.537193 0.936575 2.29508e-16 295 63.546 0.0131345 -3.53367 63.546000 Cu 0.585758 0.921798 0.5 296 63.546 0.029925 -3.53818 63.546000 Cu 0.59841 0.950167 0.5 301 63.546 0.0711518 -3.52712 63.546000 Cu 0.64612 0.934799 1 298 63.546 0.0836762 -3.53233 63.546000 Cu 0.753696 0.93037 2.14616e-16 272 63.546 0.0837172 -3.53177 63.546000 Cu 0.694302 0.918676 0.5 274 63.546 0.0428597 -3.53698 63.546000 Cu 0.706324 0.947316 0.5 300 63.546 0.223257 -3.52229 63.546000 Cu 0.814273 0.940352 0.5 278 63.546 0.509609 -3.47685 63.546000 Cu 0.988105 0.950868 1.06648e-16 279 63.546 0.0213023 -3.53365 63.546000 Cu 0.975744 0.923331 1.48442e-16 246 63.546 0.00696208 -3.53564 63.546000 Cu 0.864448 0.925183 2.97844e-17 275 63.546 0.115697 -3.52045 63.546000 Cu 0.876891 0.951769 1.2214e-16 276 63.546 0.481553 -3.49273 63.546000 Cu 0.926577 0.937649 0.5 277 63.546 0.0357396 -3.53073 63.546000 Cu 0.158695 0.964089 0.5 255 63.546 0.355132 -3.49633 63.546000 Cu 0.0485681 0.964599 0.5 281 63.546 0.0826889 -3.5268 63.546000 Cu 0.10777 0.978544 1.22741e-16 283 63.546 0.326984 -3.51683 63.546000 Cu 0.15892 0.992993 0.5 284 63.546 0.349126 -3.49574 63.546000 Cu 0.0489158 0.992496 0.5 285 63.546 0.0886658 -3.52662 63.546000 Cu 0.263743 0.997332 0.5 361 63.546 5.7151 -3.46934 63.546000 Cu 0.263464 0.959639 0.5 324 63.546 5.727 -3.46914 63.546000 Cu 0.222764 0.978521 0 254 63.546 4.59523 -3.57685 63.546000 Cu 0.327686 0.96606 3.88639e-16 325 63.546 7.55644 -3.27253 63.546000 Cu 0.328165 0.991075 1 326 63.546 7.56939 -3.26832 63.546000 Cu 0.384737 0.978545 0.5 327 63.546 3.27095 -3.48633 63.546000 Cu 0.438283 0.964864 2.72984e-16 315 63.546 0.11628 -3.53227 63.546000 Cu 0.495628 0.978547 0.5 321 63.546 0.149753 -3.54513 63.546000 Cu 0.438679 0.99222 1.19138e-16 329 63.546 0.123867 -3.53254 63.546000 Cu 0.548568 0.964599 2.21222e-16 318 63.546 0.0826889 -3.5268 63.546000 Cu 0.548916 0.992496 2.78388e-16 319 63.546 0.0886658 -3.52662 63.546000 Cu 0.658695 0.964089 1.19138e-16 299 63.546 0.355132 -3.49633 63.546000 Cu 0.60777 0.978544 0.5 320 63.546 0.326984 -3.51683 63.546000 Cu 0.65892 0.992993 9.45176e-17 322 63.546 0.349126 -3.49574 63.546000 Cu 0.763743 0.997332 0 331 63.546 5.7151 -3.46934 63.546000 Cu 0.763464 0.959639 1 302 63.546 5.727 -3.46914 63.546000 Cu 0.722764 0.978521 0.5 305 63.546 4.59523 -3.57685 63.546000 Cu 0.827686 0.96606 0.5 304 63.546 7.55644 -3.27253 63.546000 Cu 0.828165 0.991075 0.5 308 63.546 7.56939 -3.26832 63.546000 Cu 0.995628 0.978547 2.97244e-16 280 63.546 0.149753 -3.54513 63.546000 Cu 0.938283 0.964864 0.5 282 63.546 0.11628 -3.53227 63.546000 Cu 0.884737 0.978545 4.45205e-16 306 63.546 3.27095 -3.48633 63.546000 Cu 0.938679 0.99222 0.5 307 63.546 0.123867 -3.53254