Number of particles = 592 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.0216 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 87.923 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62262 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 0.0834715 0.00658036 3.52679e-16 304 63.546 0.920734 -3.52555 63.546000 Cu 0.00257404 0.00659309 0.5 305 63.546 0.493284 -3.53189 63.546000 Cu 0.00961724 0.0275662 3.32807e-17 315 63.546 0.245805 -3.51431 63.546000 Cu 0.0909048 0.026398 0.5 317 63.546 0.37603 -3.50139 63.546000 Cu 0.166443 0.0065736 0.5 306 63.546 6.2249 -3.38615 63.546000 Cu 0.180096 0.0237564 4.60423e-16 319 63.546 4.19308 -3.39783 63.546000 Cu 0.277633 0.0375319 3.29455e-16 320 63.546 0.74003 -3.44896 63.546000 Cu 0.263665 0.0198758 0.5 321 63.546 9.10736 -3.31917 63.546000 Cu 0.333085 0.00654023 6.12939e-17 323 63.546 8.79549 -3.35753 63.546000 Cu 0.430187 0.0283877 0 324 63.546 0.480012 -3.45214 63.546000 Cu 0.41821 0.00659155 0.5 325 63.546 1.95605 -3.47349 63.546000 Cu 0.36016 0.032286 0.5 326 63.546 1.25307 -3.41756 63.546000 Cu 0.502574 0.00659309 7.18288e-18 327 63.546 0.493284 -3.53189 63.546000 Cu 0.590905 0.026398 1 328 63.546 0.37603 -3.50139 63.546000 Cu 0.583471 0.00658036 0.5 329 63.546 0.920734 -3.52555 63.546000 Cu 0.509617 0.0275662 0.5 330 63.546 0.245805 -3.51431 63.546000 Cu 0.666443 0.0065736 1 299 63.546 6.2249 -3.38615 63.546000 Cu 0.763665 0.0198758 1 300 63.546 9.10736 -3.31917 63.546000 Cu 0.680096 0.0237564 0.5 301 63.546 4.19308 -3.39783 63.546000 Cu 0.777633 0.0375319 0.5 309 63.546 0.74003 -3.44896 63.546000 Cu 0.833085 0.00654023 0.5 303 63.546 8.79549 -3.35753 63.546000 Cu 0.91821 0.00659155 1 302 63.546 1.95605 -3.47349 63.546000 Cu 0.86016 0.032286 1 311 63.546 1.25307 -3.41756 63.546000 Cu 0.930187 0.0283877 0.5 313 63.546 0.480012 -3.45214 63.546000 Cu 0.106381 0.0450085 1 316 63.546 0.12272 -3.52275 63.546000 Cu 0.0213455 0.0482334 0.5 318 63.546 0.300349 -3.51423 63.546000 Cu 0.0398364 0.0684124 2.87315e-18 339 63.546 0.0258977 -3.54047 63.546000 Cu 0.119857 0.0649657 0.5 341 63.546 0.0690037 -3.52756 63.546000 Cu 0.189602 0.0426808 0.5 322 63.546 0.214641 -3.51975 63.546000 Cu 0.20551 0.0612192 2.39429e-19 343 63.546 0.0710307 -3.52394 63.546000 Cu 0.299868 0.0778683 1 344 63.546 0.0145502 -3.53655 63.546000 Cu 0.288135 0.0575256 0.5 345 63.546 0.09645 -3.52204 63.546000 Cu 0.369233 0.0538526 1.65206e-16 347 63.546 0.128335 -3.52969 63.546000 Cu 0.459367 0.0721774 1.52038e-16 348 63.546 0.0886139 -3.53785 63.546000 Cu 0.445862 0.051292 0.5 349 63.546 0.135853 -3.52019 63.546000 Cu 0.379918 0.0748694 0.5 350 63.546 0.0131455 -3.53976 63.546000 Cu 0.521346 0.0482334 7.85328e-17 351 63.546 0.300349 -3.51423 63.546000 Cu 0.619857 0.0649657 3.83087e-17 352 63.546 0.0690037 -3.52756 63.546000 Cu 0.606381 0.0450085 0.5 353 63.546 0.12272 -3.52275 63.546000 Cu 0.539836 0.0684124 0.5 354 63.546 0.0258977 -3.54047 63.546000 Cu 0.689602 0.0426808 1 307 63.546 0.214641 -3.51975 63.546000 Cu 0.788135 0.0575256 6.79979e-17 308 63.546 0.09645 -3.52204 63.546000 Cu 0.70551 0.0612192 0.5 310 63.546 0.0710307 -3.52394 63.546000 Cu 0.799868 0.0778683 0.5 333 63.546 0.0145502 -3.53655 63.546000 Cu 0.945862 0.051292 1.96332e-17 312 63.546 0.135853 -3.52019 63.546000 Cu 0.869233 0.0538526 0.5 314 63.546 0.128335 -3.52969 63.546000 Cu 0.879918 0.0748694 2.71992e-16 335 63.546 0.0131455 -3.53976 63.546000 Cu 0.959367 0.0721774 0.5 337 63.546 0.0886139 -3.53785 63.546000 Cu 0.136517 0.0846999 1 340 63.546 0.0224519 -3.53849 63.546000 Cu 0.0544701 0.0886409 0.5 342 63.546 0.00856895 -3.53993 63.546000 Cu 0.0691242 0.108533 9.1462e-17 365 63.546 0.00458678 -3.5394 63.546000 Cu 0.150234 0.104962 0.5 367 63.546 0.00501155 -3.53916 63.546000 Cu 0.217829 0.0811962 0.5 346 63.546 0.0223066 -3.5353 63.546000 Cu 0.231281 0.10153 2.27458e-17 369 63.546 0.00392534 -3.53876 63.546000 Cu 0.32492 0.118772 0 370 63.546 0.00353947 -3.53987 63.546000 Cu 0.3117 0.0983304 0.5 371 63.546 0.00363101 -3.53967 63.546000 Cu 0.392336 0.0953848 2.92822e-16 373 63.546 0.0137837 -3.53973 63.546000 Cu 0.487332 0.112193 2.29852e-17 374 63.546 0.00358674 -3.53926 63.546000 Cu 0.473655 0.0921151 0.5 375 63.546 0.0103271 -3.54049 63.546000 Cu 0.405995 0.115466 0.5 376 63.546 0.00241251 -3.53993 63.546000 Cu 0.55447 0.0886409 6.63219e-17 377 63.546 0.00856895 -3.53993 63.546000 Cu 0.650234 0.104962 1.17799e-16 378 63.546 0.00501155 -3.53916 63.546000 Cu 0.636517 0.0846999 0.5 379 63.546 0.0224519 -3.53849 63.546000 Cu 0.569124 0.108533 0.5 380 63.546 0.00458678 -3.5394 63.546000 Cu 0.717829 0.0811962 1.12532e-17 331 63.546 0.0223066 -3.5353 63.546000 Cu 0.8117 0.0983304 1.34559e-16 332 63.546 0.00363101 -3.53967 63.546000 Cu 0.731281 0.10153 0.5 334 63.546 0.00392534 -3.53876 63.546000 Cu 0.82492 0.118772 0.5 359 63.546 0.00353947 -3.53987 63.546000 Cu 0.973655 0.0921151 0 336 63.546 0.0103271 -3.54049 63.546000 Cu 0.892336 0.0953848 0.5 338 63.546 0.0137837 -3.53973 63.546000 Cu 0.905995 0.115466 1.81966e-16 361 63.546 0.00241251 -3.53993 63.546000 Cu 0.987332 0.112193 0.5 363 63.546 0.00358674 -3.53926 63.546000 Cu 0.00128247 0.132172 1.83403e-16 362 63.546 0.000936279 -3.53935 63.546000 Cu 0.0826273 0.128713 0.5 368 63.546 0.00159682 -3.53936 63.546000 Cu 0.0148332 0.152338 0.5 389 63.546 0.000403466 -3.53956 63.546000 Cu 0.0960249 0.148925 0 391 63.546 0.000602958 -3.53974 63.546000 Cu 0.16376 0.125254 1.86755e-17 366 63.546 0.00183454 -3.53973 63.546000 Cu 0.244417 0.121951 0.5 372 63.546 0.000379157 -3.54 63.546000 Cu 0.176976 0.145584 0.5 393 63.546 0.000232464 -3.54004 63.546000 Cu 0.257742 0.142311 1 395 63.546 0.000803226 -3.54016 63.546000 Cu 0.352304 0.159191 0 396 63.546 0.000431039 -3.53993 63.546000 Cu 0.338664 0.138984 0.5 397 63.546 0.000816657 -3.54023 63.546000 Cu 0.419728 0.135647 8.88283e-17 399 63.546 0.00101505 -3.53962 63.546000 Cu 0.433594 0.155752 0.5 402 63.546 0.000197322 -3.5398 63.546000 Cu 0.514833 0.152338 1.48446e-17 400 63.546 0.000403466 -3.53956 63.546000 Cu 0.501282 0.132172 0.5 401 63.546 0.000936279 -3.53935 63.546000 Cu 0.582627 0.128713 0 403 63.546 0.00159682 -3.53936 63.546000 Cu 0.596025 0.148925 0.5 404 63.546 0.000602958 -3.53974 63.546000 Cu 0.66376 0.125254 0.5 356 63.546 0.00183454 -3.53973 63.546000 Cu 0.676976 0.145584 6.51248e-17 355 63.546 0.000232464 -3.54004 63.546000 Cu 0.744417 0.121951 1 357 63.546 0.000379157 -3.54 63.546000 Cu 0.757742 0.142311 0.5 360 63.546 0.000803226 -3.54016 63.546000 Cu 0.838664 0.138984 1 358 63.546 0.000816657 -3.54023 63.546000 Cu 0.919728 0.135647 0.5 364 63.546 0.00101505 -3.53962 63.546000 Cu 0.852304 0.159191 0.5 385 63.546 0.000431039 -3.53993 63.546000 Cu 0.933594 0.155752 1 387 63.546 0.000197322 -3.5398 63.546000 Cu 0.0283253 0.172534 1.68798e-16 388 63.546 0.000286599 -3.53983 63.546000 Cu 0.109343 0.169187 0.5 394 63.546 7.50099e-05 -3.53993 63.546000 Cu 0.0416987 0.192775 0.5 413 63.546 6.40251e-05 -3.53994 63.546000 Cu 0.122692 0.189443 1 415 63.546 2.84881e-05 -3.54002 63.546000 Cu 0.190302 0.165872 1 392 63.546 0.000117071 -3.54008 63.546000 Cu 0.271279 0.162545 0.5 398 63.546 0.000334506 -3.54015 63.546000 Cu 0.203689 0.186108 0.5 417 63.546 0.000168333 -3.54004 63.546000 Cu 0.284783 0.18275 8.49974e-17 419 63.546 0.000198666 -3.53997 63.546000 Cu 0.379481 0.199523 0 420 63.546 6.38309e-05 -3.53988 63.546000 Cu 0.365989 0.179342 0.5 421 63.546 6.19924e-05 -3.53991 63.546000 Cu 0.447182 0.175931 1 423 63.546 0.000181405 -3.53979 63.546000 Cu 0.460622 0.196131 0.5 426 63.546 0.0001397 -3.5399 63.546000 Cu 0.541699 0.192775 1 424 63.546 6.40251e-05 -3.53994 63.546000 Cu 0.528325 0.172534 0.5 425 63.546 0.000286599 -3.53983 63.546000 Cu 0.609343 0.169187 9.8166e-17 427 63.546 7.50099e-05 -3.53993 63.546000 Cu 0.622692 0.189443 0.5 428 63.546 2.84881e-05 -3.54002 63.546000 Cu 0.703689 0.186108 8.83494e-17 381 63.546 0.000168333 -3.54004 63.546000 Cu 0.690302 0.165872 0.5 382 63.546 0.000117071 -3.54008 63.546000 Cu 0.771279 0.162545 1.53235e-16 383 63.546 0.000334506 -3.54015 63.546000 Cu 0.784783 0.18275 0.5 386 63.546 0.000198666 -3.53997 63.546000 Cu 0.865989 0.179342 2.01121e-17 384 63.546 6.19924e-05 -3.53991 63.546000 Cu 0.947182 0.175931 0.5 390 63.546 0.000181405 -3.53979 63.546000 Cu 0.879481 0.199523 0.5 409 63.546 6.38309e-05 -3.53988 63.546000 Cu 0.960622 0.196131 1 411 63.546 0.0001397 -3.5399 63.546000 Cu 0.0549957 0.21301 1 412 63.546 5.82244e-06 -3.53999 63.546000 Cu 0.136032 0.209671 0.5 418 63.546 8.22382e-05 -3.54003 63.546000 Cu 0.0683197 0.233234 0.5 439 63.546 7.44726e-05 -3.53999 63.546000 Cu 0.149411 0.229871 2.57626e-16 441 63.546 5.95393e-05 -3.53999 63.546000 Cu 0.217111 0.206315 0 416 63.546 0.000143475 -3.54 63.546000 Cu 0.29828 0.202913 0.5 422 63.546 1.63119e-05 -3.53991 63.546000 Cu 0.230529 0.226487 0.5 443 63.546 1.14121e-05 -3.53995 63.546000 Cu 0.311711 0.223096 1.55629e-17 445 63.546 3.64151e-05 -3.53985 63.546000 Cu 0.406182 0.239929 1 446 63.546 1.41701e-05 -3.53992 63.546000 Cu 0.392896 0.219715 0.5 447 63.546 0.000102872 -3.53989 63.546000 Cu 0.473957 0.216352 1.08701e-16 449 63.546 3.62335e-05 -3.53995 63.546000 Cu 0.487272 0.236574 0.5 452 63.546 1.22979e-05 -3.53998 63.546000 Cu 0.56832 0.233234 1.81248e-16 450 63.546 7.44726e-05 -3.53999 63.546000 Cu 0.554996 0.21301 0.5 451 63.546 5.82244e-06 -3.53999 63.546000 Cu 0.636032 0.209671 1.31926e-16 453 63.546 8.22382e-05 -3.54003 63.546000 Cu 0.649411 0.229871 0.5 454 63.546 5.95393e-05 -3.53999 63.546000 Cu 0.730529 0.226487 2.71752e-16 405 63.546 1.14121e-05 -3.53995 63.546000 Cu 0.717111 0.206315 0.5 406 63.546 0.000143475 -3.54 63.546000 Cu 0.79828 0.202913 1.27137e-16 407 63.546 1.63119e-05 -3.53991 63.546000 Cu 0.811711 0.223096 0.5 410 63.546 3.64151e-05 -3.53985 63.546000 Cu 0.892896 0.219715 1 408 63.546 0.000102872 -3.53989 63.546000 Cu 0.973957 0.216352 0.5 414 63.546 3.62335e-05 -3.53995 63.546000 Cu 0.906182 0.239929 0.5 435 63.546 1.41701e-05 -3.53992 63.546000 Cu 0.987272 0.236574 3.19159e-16 437 63.546 1.22979e-05 -3.53998 63.546000 Cu 0.081687 0.253429 1 438 63.546 4.10209e-05 -3.53998 63.546000 Cu 0.000561228 0.256786 0.5 440 63.546 2.3632e-05 -3.53999 63.546000 Cu 0.0139074 0.276984 1 463 63.546 2.58053e-05 -3.53996 63.546000 Cu 0.0950599 0.273609 0.5 465 63.546 7.77701e-06 -3.53992 63.546000 Cu 0.162832 0.250048 0.5 444 63.546 8.74837e-06 -3.53996 63.546000 Cu 0.243956 0.246668 0 442 63.546 9.54145e-06 -3.53992 63.546000 Cu 0.325075 0.243289 0.5 448 63.546 4.05065e-05 -3.53992 63.546000 Cu 0.176194 0.270229 3.66327e-17 467 63.546 4.66857e-06 -3.53988 63.546000 Cu 0.257346 0.266846 0.5 469 63.546 4.18987e-05 -3.53991 63.546000 Cu 0.338407 0.263484 0 471 63.546 1.44051e-05 -3.53999 63.546000 Cu 0.419462 0.260135 0.5 473 63.546 1.54135e-05 -3.53997 63.546000 Cu 0.500561 0.256786 3.83087e-17 475 63.546 2.3632e-05 -3.53999 63.546000 Cu 0.59506 0.273609 1 476 63.546 7.77701e-06 -3.53992 63.546000 Cu 0.581687 0.253429 0.5 477 63.546 4.10209e-05 -3.53998 63.546000 Cu 0.513907 0.276984 0.5 478 63.546 2.58053e-05 -3.53996 63.546000 Cu 0.662832 0.250048 1 429 63.546 8.74837e-06 -3.53996 63.546000 Cu 0.757346 0.266846 1.36714e-16 430 63.546 4.18987e-05 -3.53991 63.546000 Cu 0.743956 0.246668 0.5 431 63.546 9.54145e-06 -3.53992 63.546000 Cu 0.676194 0.270229 0.5 432 63.546 4.66857e-06 -3.53988 63.546000 Cu 0.825075 0.243289 1 433 63.546 4.05065e-05 -3.53992 63.546000 Cu 0.919462 0.260135 0 434 63.546 1.54135e-05 -3.53997 63.546000 Cu 0.838407 0.263484 0.5 436 63.546 1.44051e-05 -3.53999 63.546000 Cu 0.108373 0.293793 1 464 63.546 6.96893e-06 -3.53988 63.546000 Cu 0.0272716 0.297175 0.5 466 63.546 3.78215e-05 -3.53995 63.546000 Cu 0.0405568 0.317361 1 487 63.546 6.35164e-05 -3.53988 63.546000 Cu 0.121705 0.313968 0.5 489 63.546 2.34105e-05 -3.53984 63.546000 Cu 0.270664 0.287036 1.10616e-16 468 63.546 1.70983e-05 -3.53993 63.546000 Cu 0.189524 0.290414 0.5 470 63.546 4.79109e-06 -3.53986 63.546000 Cu 0.202854 0.310585 1 491 63.546 2.6e-05 -3.53993 63.546000 Cu 0.283993 0.307219 0.5 493 63.546 2.69224e-05 -3.53998 63.546000 Cu 0.432808 0.280336 1.10137e-16 472 63.546 1.39745e-05 -3.54001 63.546000 Cu 0.351748 0.283676 0.5 474 63.546 1.17621e-05 -3.54 63.546000 Cu 0.36511 0.30387 7.70962e-17 495 63.546 1.06662e-05 -3.54004 63.546000 Cu 0.446182 0.300526 0.5 497 63.546 1.07793e-05 -3.54002 63.546000 Cu 0.527272 0.297175 2.41824e-17 499 63.546 3.78215e-05 -3.53995 63.546000 Cu 0.621705 0.313968 9.93632e-17 500 63.546 2.34105e-05 -3.53984 63.546000 Cu 0.608373 0.293793 0.5 501 63.546 6.96893e-06 -3.53988 63.546000 Cu 0.540557 0.317361 0.5 502 63.546 6.35164e-05 -3.53988 63.546000 Cu 0.689524 0.290414 0 455 63.546 4.79109e-06 -3.53986 63.546000 Cu 0.783993 0.307219 1 456 63.546 2.69224e-05 -3.53998 63.546000 Cu 0.770664 0.287036 0.5 457 63.546 1.70983e-05 -3.53993 63.546000 Cu 0.702854 0.310585 0.5 458 63.546 2.6e-05 -3.53993 63.546000 Cu 0.851748 0.283676 1 459 63.546 1.17621e-05 -3.54 63.546000 Cu 0.946182 0.300526 1.20672e-16 460 63.546 1.07793e-05 -3.54002 63.546000 Cu 0.932808 0.280336 0.5 461 63.546 1.39745e-05 -3.54001 63.546000 Cu 0.86511 0.30387 0.5 462 63.546 1.06662e-05 -3.54004 63.546000 Cu 0.135092 0.334136 1.58023e-17 488 63.546 5.25477e-05 -3.5399 63.546000 Cu 0.0539133 0.337543 0.5 490 63.546 0.000128091 -3.53977 63.546000 Cu 0.0673707 0.3577 1 513 63.546 0.000227802 -3.5398 63.546000 Cu 0.148638 0.35427 0.5 515 63.546 0.000298299 -3.53996 63.546000 Cu 0.297376 0.327405 1.86994e-16 492 63.546 6.08126e-05 -3.54007 63.546000 Cu 0.216295 0.330744 0.5 494 63.546 0.000120898 -3.53998 63.546000 Cu 0.229707 0.350918 1.65446e-16 517 63.546 0.000294968 -3.54017 63.546000 Cu 0.310745 0.347598 0.5 519 63.546 0.000197667 -3.54012 63.546000 Cu 0.459492 0.320727 6.91951e-17 496 63.546 3.17396e-05 -3.53993 63.546000 Cu 0.378437 0.324066 0.5 498 63.546 3.26368e-05 -3.54002 63.546000 Cu 0.391695 0.344291 1 521 63.546 9.65802e-05 -3.53992 63.546000 Cu 0.472737 0.340935 0.5 523 63.546 0.000218779 -3.53977 63.546000 Cu 0.553913 0.337543 3.00963e-16 525 63.546 0.000128091 -3.53977 63.546000 Cu 0.648638 0.35427 4.78859e-17 526 63.546 0.000298299 -3.53996 63.546000 Cu 0.635092 0.334136 0.5 527 63.546 5.25477e-05 -3.5399 63.546000 Cu 0.567371 0.3577 0.5 528 63.546 0.000227802 -3.5398 63.546000 Cu 0.716295 0.330744 1 479 63.546 0.000120898 -3.53998 63.546000 Cu 0.810745 0.347598 9.57717e-19 480 63.546 0.000197667 -3.54012 63.546000 Cu 0.797376 0.327405 0.5 481 63.546 6.08126e-05 -3.54007 63.546000 Cu 0.729707 0.350918 0.5 482 63.546 0.000294968 -3.54017 63.546000 Cu 0.878437 0.324066 1 483 63.546 3.26368e-05 -3.54002 63.546000 Cu 0.972737 0.340935 5.88996e-17 484 63.546 0.000218779 -3.53977 63.546000 Cu 0.959492 0.320727 0.5 485 63.546 3.17396e-05 -3.53993 63.546000 Cu 0.891695 0.344291 0.5 486 63.546 9.65802e-05 -3.53992 63.546000 Cu 0.0811142 0.377776 0.5 516 63.546 0.000972389 -3.53963 63.546000 Cu 0.0947183 0.397908 1.58502e-16 539 63.546 0.00249703 -3.53993 63.546000 Cu 0.162205 0.374442 2.68161e-17 514 63.546 0.000793473 -3.54024 63.546000 Cu 0.323893 0.367845 1 518 63.546 0.000246145 -3.54011 63.546000 Cu 0.243148 0.371116 0.5 520 63.546 0.000897028 -3.54022 63.546000 Cu 0.175843 0.394619 0.5 541 63.546 0.00380189 -3.53994 63.546000 Cu 0.256363 0.391442 3.83087e-17 543 63.546 0.000418526 -3.54008 63.546000 Cu 0.486125 0.361107 4.78859e-17 522 63.546 0.000371466 -3.53949 63.546000 Cu 0.404873 0.36452 0.5 524 63.546 0.00071013 -3.53972 63.546000 Cu 0.336987 0.388141 0.5 545 63.546 0.00179895 -3.53975 63.546000 Cu 0.418115 0.384687 1 547 63.546 0.00171751 -3.53928 63.546000 Cu 0.499511 0.381238 0.5 549 63.546 0.00103058 -3.53928 63.546000 Cu 0.581114 0.377776 1 551 63.546 0.000972389 -3.53963 63.546000 Cu 0.594718 0.397908 0.5 552 63.546 0.00249703 -3.53993 63.546000 Cu 0.662205 0.374442 0.5 504 63.546 0.000793473 -3.54024 63.546000 Cu 0.675843 0.394619 1.06307e-16 503 63.546 0.00380189 -3.53994 63.546000 Cu 0.743148 0.371116 1 505 63.546 0.000897028 -3.54022 63.546000 Cu 0.823893 0.367845 0.5 507 63.546 0.000246145 -3.54011 63.546000 Cu 0.756363 0.391442 0.5 508 63.546 0.000418526 -3.54008 63.546000 Cu 0.999511 0.381238 1 510 63.546 0.00103058 -3.53928 63.546000 Cu 0.836987 0.388141 0 506 63.546 0.00179895 -3.53975 63.546000 Cu 0.904873 0.36452 1.05588e-16 509 63.546 0.00071013 -3.53972 63.546000 Cu 0.986125 0.361107 0.5 511 63.546 0.000371466 -3.53949 63.546000 Cu 0.918115 0.384687 0.5 512 63.546 0.00171751 -3.53928 63.546000 Cu 0.0268814 0.421216 5.72236e-17 536 63.546 0.0109146 -3.54037 63.546000 Cu 0.0133039 0.401172 0.5 537 63.546 0.00391881 -3.53911 63.546000 Cu 0.108238 0.417959 0.5 542 63.546 0.0139942 -3.53966 63.546000 Cu 0.120465 0.438436 1 563 63.546 0.0135068 -3.53986 63.546000 Cu 0.188889 0.415021 1 540 63.546 0.00351843 -3.53975 63.546000 Cu 0.269317 0.411841 0.5 546 63.546 0.00422121 -3.5388 63.546000 Cu 0.200568 0.435454 0.5 565 63.546 0.0145392 -3.53648 63.546000 Cu 0.282652 0.432153 3.83087e-17 567 63.546 0.0237243 -3.5354 63.546000 Cu 0.350368 0.408411 0 544 63.546 0.00547138 -3.53915 63.546000 Cu 0.431473 0.404839 0.5 550 63.546 0.0052069 -3.53925 63.546000 Cu 0.36396 0.428645 0.5 569 63.546 0.0237886 -3.53849 63.546000 Cu 0.446047 0.424686 1 571 63.546 0.00925023 -3.53988 63.546000 Cu 0.513304 0.401172 1.02955e-17 548 63.546 0.00391881 -3.53911 63.546000 Cu 0.526881 0.421216 0.5 573 63.546 0.0109146 -3.54037 63.546000 Cu 0.608238 0.417959 2.08304e-17 575 63.546 0.0139942 -3.53966 63.546000 Cu 0.620465 0.438436 0.5 576 63.546 0.0135068 -3.53986 63.546000 Cu 0.700568 0.435454 1 529 63.546 0.0145392 -3.53648 63.546000 Cu 0.688889 0.415021 0.5 530 63.546 0.00351843 -3.53975 63.546000 Cu 0.769317 0.411841 2.39429e-19 531 63.546 0.00422121 -3.5388 63.546000 Cu 0.782652 0.432153 0.5 534 63.546 0.0237243 -3.5354 63.546000 Cu 0.86396 0.428645 1 532 63.546 0.0237886 -3.53849 63.546000 Cu 0.850368 0.408411 0.5 533 63.546 0.00547138 -3.53915 63.546000 Cu 0.931473 0.404839 1.22109e-17 535 63.546 0.0052069 -3.53925 63.546000 Cu 0.946047 0.424686 0.5 538 63.546 0.00925023 -3.53988 63.546000 Cu 0.0544356 0.461984 1 560 63.546 0.13958 -3.51974 63.546000 Cu 0.0410154 0.441104 0.5 561 63.546 0.0941305 -3.53785 63.546000 Cu 0.131017 0.459432 0.5 566 63.546 0.133195 -3.52934 63.546000 Cu 0.212191 0.455768 2.16923e-16 564 63.546 0.0987205 -3.52188 63.546000 Cu 0.294877 0.45209 0.5 570 63.546 0.0720581 -3.52357 63.546000 Cu 0.222581 0.475716 0.5 585 63.546 0.741075 -3.44803 63.546000 Cu 0.310731 0.470583 1 587 63.546 0.217595 -3.51898 63.546000 Cu 0.380597 0.448344 1 568 63.546 0.0712745 -3.52745 63.546000 Cu 0.460597 0.444879 0.5 574 63.546 0.0266196 -3.54045 63.546000 Cu 0.393991 0.46827 0.5 589 63.546 0.124508 -3.52268 63.546000 Cu 0.479038 0.465063 0 591 63.546 0.308184 -3.51446 63.546000 Cu 0.631017 0.459432 6.84768e-17 15 63.546 0.133195 -3.52934 63.546000 Cu 0.554436 0.461984 0.5 298 63.546 0.13958 -3.51974 63.546000 Cu 0.541015 0.441104 2.41824e-17 572 63.546 0.0941305 -3.53785 63.546000 Cu 0.722581 0.475716 1.11694e-15 553 63.546 0.741075 -3.44803 63.546000 Cu 0.712191 0.455768 0.5 554 63.546 0.0987205 -3.52188 63.546000 Cu 0.794877 0.45209 1 555 63.546 0.0720581 -3.52357 63.546000 Cu 0.810731 0.470583 0.5 558 63.546 0.217595 -3.51898 63.546000 Cu 0.893991 0.46827 1.78375e-16 556 63.546 0.124508 -3.52268 63.546000 Cu 0.880597 0.448344 0.5 557 63.546 0.0712745 -3.52745 63.546000 Cu 0.960597 0.444879 1.20672e-16 559 63.546 0.0266196 -3.54045 63.546000 Cu 0.979038 0.465063 0.5 562 63.546 0.308184 -3.51446 63.546000 Cu 0.139953 0.480989 1 583 63.546 1.25901 -3.41749 63.546000 Cu 0.0817215 0.506703 4.78859e-19 3 63.546 1.94599 -3.47316 63.546000 Cu 0.0699736 0.48492 0.5 582 63.546 0.488955 -3.45342 63.546000 Cu 0.236485 0.493356 1 584 63.546 9.10445 -3.31809 63.546000 Cu 0.166909 0.506683 0.5 586 63.546 8.79194 -3.35691 63.546000 Cu 0.320107 0.489482 0.5 590 63.546 4.19623 -3.39787 63.546000 Cu 0.333613 0.506681 1 8 63.546 6.22317 -3.38649 63.546000 Cu 0.416548 0.506686 0.5 10 63.546 0.923846 -3.52568 63.546000 Cu 0.497397 0.506699 8.66734e-17 11 63.546 0.493182 -3.53184 63.546000 Cu 0.490601 0.485712 0.5 293 63.546 0.250411 -3.5154 63.546000 Cu 0.409354 0.48686 1 588 63.546 0.384253 -3.50192 63.546000 Cu 0.639953 0.480989 0.5 6 63.546 1.25901 -3.41749 63.546000 Cu 0.581722 0.506703 0.5 13 63.546 1.94599 -3.47316 63.546000 Cu 0.569974 0.48492 3.52201e-16 592 63.546 0.488955 -3.45342 63.546000 Cu 0.666909 0.506683 1 577 63.546 8.79194 -3.35691 63.546000 Cu 0.736485 0.493356 0.5 578 63.546 9.10445 -3.31809 63.546000 Cu 0.820107 0.489482 4.23335e-15 579 63.546 4.19623 -3.39787 63.546000 Cu 0.833613 0.506681 0.5 2 63.546 6.22317 -3.38649 63.546000 Cu 0.916548 0.506686 2.90955e-15 1 63.546 0.923846 -3.52568 63.546000 Cu 0.997397 0.506699 0.5 4 63.546 0.493182 -3.53184 63.546000 Cu 0.909354 0.48686 0.5 580 63.546 0.384253 -3.50192 63.546000 Cu 0.990601 0.485712 2.37753e-16 581 63.546 0.250411 -3.5154 63.546000 Cu 0.0542086 0.551401 5.26745e-17 24 63.546 0.133909 -3.52022 63.546000 Cu 0.0698042 0.528501 0.5 25 63.546 0.475801 -3.45273 63.546000 Cu 0.139881 0.532393 1 27 63.546 1.25565 -3.41818 63.546000 Cu 0.130831 0.553949 0.5 30 63.546 0.130734 -3.52975 63.546000 Cu 0.236501 0.520012 1 5 63.546 9.10607 -3.31881 63.546000 Cu 0.320036 0.52389 0.5 7 63.546 4.18559 -3.39855 63.546000 Cu 0.211971 0.557637 0 28 63.546 0.0976746 -3.52192 63.546000 Cu 0.222504 0.537666 0.5 29 63.546 0.734145 -3.44854 63.546000 Cu 0.310571 0.542818 1 31 63.546 0.217646 -3.51955 63.546000 Cu 0.409172 0.526526 1 9 63.546 0.377166 -3.50204 63.546000 Cu 0.490386 0.527686 0.5 14 63.546 0.242579 -3.51461 63.546000 Cu 0.393763 0.545148 0.5 34 63.546 0.122087 -3.52303 63.546000 Cu 0.478712 0.548362 1.82206e-16 35 63.546 0.297335 -3.51434 63.546000 Cu 0.569804 0.528501 0 12 63.546 0.475801 -3.45273 63.546000 Cu 0.639881 0.532393 0.5 18 63.546 1.25565 -3.41818 63.546000 Cu 0.554209 0.551401 0.5 37 63.546 0.133909 -3.52022 63.546000 Cu 0.630831 0.553949 1.81487e-16 39 63.546 0.130734 -3.52975 63.546000 Cu 0.736501 0.520012 0.5 17 63.546 9.10607 -3.31881 63.546000 Cu 0.722504 0.537666 7.38879e-16 16 63.546 0.734145 -3.44854 63.546000 Cu 0.820036 0.52389 3.96591e-15 19 63.546 4.18559 -3.39855 63.546000 Cu 0.810571 0.542818 0.5 22 63.546 0.217646 -3.51955 63.546000 Cu 0.711971 0.557637 0.5 41 63.546 0.0976746 -3.52192 63.546000 Cu 0.893763 0.545148 1.02955e-17 20 63.546 0.122087 -3.52303 63.546000 Cu 0.909172 0.526526 0.5 21 63.546 0.377166 -3.50204 63.546000 Cu 0.990386 0.527686 5.62659e-17 23 63.546 0.242579 -3.51461 63.546000 Cu 0.978712 0.548362 0.5 26 63.546 0.297335 -3.51434 63.546000 Cu 0.0265177 0.59223 1 48 63.546 0.0107755 -3.54046 63.546000 Cu 0.0407612 0.572292 0.5 49 63.546 0.0890548 -3.53778 63.546000 Cu 0.120191 0.574966 2.81808e-16 51 63.546 0.013058 -3.53975 63.546000 Cu 0.107813 0.595482 0.5 54 63.546 0.0136991 -3.5397 63.546000 Cu 0.294611 0.561339 0.5 32 63.546 0.0711529 -3.52385 63.546000 Cu 0.188405 0.598418 2.67682e-16 52 63.546 0.00353185 -3.53966 63.546000 Cu 0.200222 0.577962 0.5 53 63.546 0.0155493 -3.53651 63.546000 Cu 0.282287 0.581299 2.07585e-16 55 63.546 0.0227306 -3.53534 63.546000 Cu 0.380281 0.565102 3.7351e-17 33 63.546 0.0691494 -3.52758 63.546000 Cu 0.460308 0.568546 0.5 38 63.546 0.0259672 -3.54046 63.546000 Cu 0.363617 0.584816 0.5 58 63.546 0.0220691 -3.53847 63.546000 Cu 0.4457 0.588763 4.19001e-17 59 63.546 0.00907322 -3.53987 63.546000 Cu 0.540761 0.572292 5.0759e-17 36 63.546 0.0890548 -3.53778 63.546000 Cu 0.620191 0.574966 0.5 42 63.546 0.013058 -3.53975 63.546000 Cu 0.526518 0.59223 0.5 61 63.546 0.0107755 -3.54046 63.546000 Cu 0.607813 0.595482 1 63 63.546 0.0136991 -3.5397 63.546000 Cu 0.700222 0.577962 1 40 63.546 0.0155493 -3.53651 63.546000 Cu 0.794611 0.561339 1 43 63.546 0.0711529 -3.52385 63.546000 Cu 0.782287 0.581299 0.5 46 63.546 0.0227306 -3.53534 63.546000 Cu 0.688405 0.598418 0.5 65 63.546 0.00353185 -3.53966 63.546000 Cu 0.863617 0.584816 1 44 63.546 0.0220691 -3.53847 63.546000 Cu 0.880281 0.565102 0.5 45 63.546 0.0691494 -3.52758 63.546000 Cu 0.960308 0.568546 1 47 63.546 0.0259672 -3.54046 63.546000 Cu 0.9457 0.588763 0.5 50 63.546 0.00907322 -3.53987 63.546000 Cu 0.0128722 0.6123 0.5 73 63.546 0.00399257 -3.53922 63.546000 Cu 0.0941781 0.615565 2.39429e-19 75 63.546 0.00251972 -3.53993 63.546000 Cu 0.161515 0.63906 1.01279e-16 76 63.546 0.00081778 -3.54025 63.546000 Cu 0.0804673 0.63574 0.5 78 63.546 0.00115288 -3.53963 63.546000 Cu 0.268804 0.601614 0.5 56 63.546 0.00448823 -3.53877 63.546000 Cu 0.175219 0.618859 0.5 77 63.546 0.00356608 -3.53987 63.546000 Cu 0.255712 0.622021 1.5084e-16 79 63.546 0.000498344 -3.54002 63.546000 Cu 0.33638 0.625329 0.5 82 63.546 0.00202958 -3.5397 63.546000 Cu 0.349887 0.605058 1 57 63.546 0.00510543 -3.53914 63.546000 Cu 0.431038 0.608637 0.5 62 63.546 0.00451151 -3.53935 63.546000 Cu 0.417553 0.628798 1 83 63.546 0.00155704 -3.53931 63.546000 Cu 0.498905 0.632268 0.5 85 63.546 0.000952263 -3.53933 63.546000 Cu 0.512872 0.6123 3.3999e-16 60 63.546 0.00399257 -3.53922 63.546000 Cu 0.594178 0.615565 0.5 66 63.546 0.00251972 -3.53993 63.546000 Cu 0.580467 0.63574 3.83087e-17 87 63.546 0.00115288 -3.53963 63.546000 Cu 0.661515 0.63906 0.5 89 63.546 0.00081778 -3.54025 63.546000 Cu 0.675219 0.618859 4.52521e-17 64 63.546 0.00356608 -3.53987 63.546000 Cu 0.768804 0.601614 5.79419e-17 67 63.546 0.00448823 -3.53877 63.546000 Cu 0.755712 0.622021 0.5 70 63.546 0.000498344 -3.54002 63.546000 Cu 0.83638 0.625329 5.77025e-17 68 63.546 0.00202958 -3.5397 63.546000 Cu 0.849887 0.605058 0.5 69 63.546 0.00510543 -3.53914 63.546000 Cu 0.931038 0.608637 1.89149e-17 71 63.546 0.00451151 -3.53935 63.546000 Cu 0.998905 0.632268 5.38716e-17 72 63.546 0.000952263 -3.53933 63.546000 Cu 0.917553 0.628798 0.5 74 63.546 0.00155704 -3.53931 63.546000 Cu 0.0666629 0.655831 1.02955e-16 99 63.546 0.000207502 -3.53981 63.546000 Cu 0.134363 0.679407 9.36169e-17 100 63.546 4.9567e-05 -3.53993 63.546000 Cu 0.147954 0.659262 0.5 101 63.546 0.000502918 -3.53995 63.546000 Cu 0.053168 0.675998 0.5 102 63.546 0.000101065 -3.53978 63.546000 Cu 0.32319 0.645643 5.7463e-18 80 63.546 0.000320708 -3.54004 63.546000 Cu 0.242431 0.642374 0.5 81 63.546 0.000723427 -3.54018 63.546000 Cu 0.228952 0.662599 1.06307e-16 103 63.546 0.000287694 -3.5402 63.546000 Cu 0.309945 0.665916 0.5 105 63.546 8.00034e-05 -3.54011 63.546000 Cu 0.485402 0.652419 4.52521e-17 84 63.546 0.000362527 -3.53954 63.546000 Cu 0.404164 0.648993 0.5 86 63.546 0.000685851 -3.5397 63.546000 Cu 0.390941 0.669236 1 107 63.546 0.000108629 -3.53994 63.546000 Cu 0.47199 0.672596 0.5 109 63.546 0.000231111 -3.53982 63.546000 Cu 0.647954 0.659262 2.52359e-16 88 63.546 0.000502918 -3.53995 63.546000 Cu 0.566663 0.655831 0.5 90 63.546 0.000207502 -3.53981 63.546000 Cu 0.553168 0.675998 7.90117e-18 111 63.546 0.000101065 -3.53978 63.546000 Cu 0.634363 0.679407 0.5 113 63.546 4.9567e-05 -3.53993 63.546000 Cu 0.742431 0.642374 5.02802e-17 91 63.546 0.000723427 -3.54018 63.546000 Cu 0.809945 0.665916 1.03673e-16 92 63.546 8.00034e-05 -3.54011 63.546000 Cu 0.82319 0.645643 0.5 93 63.546 0.000320708 -3.54004 63.546000 Cu 0.728952 0.662599 0.5 94 63.546 0.000287694 -3.5402 63.546000 Cu 0.904164 0.648993 3.35201e-17 95 63.546 0.000685851 -3.5397 63.546000 Cu 0.97199 0.672596 2.39429e-19 96 63.546 0.000231111 -3.53982 63.546000 Cu 0.985402 0.652419 0.5 97 63.546 0.000362527 -3.53954 63.546000 Cu 0.890941 0.669236 0.5 98 63.546 0.000108629 -3.53994 63.546000 Cu 0.0397619 0.696183 1 123 63.546 7.68397e-05 -3.5399 63.546000 Cu 0.107474 0.719757 3.59144e-17 124 63.546 5.28046e-05 -3.53989 63.546000 Cu 0.120929 0.699575 0.5 125 63.546 2.28414e-05 -3.53987 63.546000 Cu 0.0264023 0.716385 0.5 126 63.546 3.133e-05 -3.53992 63.546000 Cu 0.296649 0.68614 1 104 63.546 0.000110991 -3.54007 63.546000 Cu 0.215571 0.682799 0.5 106 63.546 0.000208412 -3.53999 63.546000 Cu 0.202116 0.70296 1 127 63.546 2.05873e-05 -3.53993 63.546000 Cu 0.283244 0.706345 0.5 129 63.546 0.000115274 -3.53999 63.546000 Cu 0.458656 0.692816 5.36322e-17 108 63.546 5.88971e-05 -3.53992 63.546000 Cu 0.377638 0.689473 0.5 110 63.546 9.17388e-06 -3.54003 63.546000 Cu 0.364308 0.709693 0 131 63.546 5.53733e-05 -3.54001 63.546000 Cu 0.44534 0.71303 0.5 133 63.546 1.05098e-05 -3.53996 63.546000 Cu 0.620929 0.699575 8.88283e-17 112 63.546 2.28414e-05 -3.53987 63.546000 Cu 0.539762 0.696183 0.5 114 63.546 7.68397e-05 -3.5399 63.546000 Cu 0.526402 0.716385 2.80132e-17 135 63.546 3.133e-05 -3.53992 63.546000 Cu 0.607474 0.719757 0.5 137 63.546 5.28046e-05 -3.53989 63.546000 Cu 0.715571 0.682799 1.15405e-16 115 63.546 0.000208412 -3.53999 63.546000 Cu 0.783244 0.706345 1.27855e-16 116 63.546 0.000115274 -3.53999 63.546000 Cu 0.796649 0.68614 0.5 117 63.546 0.000110991 -3.54007 63.546000 Cu 0.702116 0.70296 0.5 118 63.546 2.05873e-05 -3.53993 63.546000 Cu 0.877638 0.689473 0 119 63.546 9.17388e-06 -3.54003 63.546000 Cu 0.94534 0.71303 1 120 63.546 1.05098e-05 -3.53996 63.546000 Cu 0.958656 0.692816 0.5 121 63.546 5.88971e-05 -3.53992 63.546000 Cu 0.864308 0.709693 0.5 122 63.546 5.53733e-05 -3.54001 63.546000 Cu 0.0130185 0.736594 1 147 63.546 1.04947e-05 -3.53994 63.546000 Cu 0.0941124 0.739958 0.5 149 63.546 1.0568e-05 -3.53991 63.546000 Cu 0.269798 0.726516 1.22348e-16 128 63.546 2.21318e-05 -3.53997 63.546000 Cu 0.188636 0.723138 0.5 130 63.546 1.46179e-05 -3.53987 63.546000 Cu 0.175203 0.743321 6.51248e-17 151 63.546 2.77786e-05 -3.53994 63.546000 Cu 0.256289 0.746689 0.5 153 63.546 9.83408e-06 -3.53995 63.546000 Cu 0.33739 0.750059 4.26184e-17 156 63.546 1.14568e-05 -3.53996 63.546000 Cu 0.431975 0.733245 2.51161e-16 132 63.546 5.30317e-05 -3.53994 63.546000 Cu 0.350879 0.729888 0.5 134 63.546 5.12172e-05 -3.53997 63.546000 Cu 0.418526 0.753431 0.5 158 63.546 2.35725e-05 -3.53996 63.546000 Cu 0.499672 0.756795 3.5675e-17 159 63.546 3.26951e-05 -3.53996 63.546000 Cu 0.594112 0.739958 2.39429e-19 136 63.546 1.0568e-05 -3.53991 63.546000 Cu 0.513019 0.736594 0.5 138 63.546 1.04947e-05 -3.53994 63.546000 Cu 0.688636 0.723138 1 139 63.546 1.46179e-05 -3.53987 63.546000 Cu 0.756289 0.746689 7.85328e-17 140 63.546 9.83408e-06 -3.53995 63.546000 Cu 0.769798 0.726516 0.5 141 63.546 2.21318e-05 -3.53997 63.546000 Cu 0.675203 0.743321 0.5 142 63.546 2.77786e-05 -3.53994 63.546000 Cu 0.83739 0.750059 0.5 146 63.546 1.14568e-05 -3.53996 63.546000 Cu 0.850879 0.729888 1.52038e-16 143 63.546 5.12172e-05 -3.53997 63.546000 Cu 0.918526 0.753431 1.53714e-16 144 63.546 2.35725e-05 -3.53996 63.546000 Cu 0.931975 0.733245 0.5 145 63.546 5.30317e-05 -3.53994 63.546000 Cu 0.999672 0.756795 0.5 150 63.546 3.26951e-05 -3.53996 63.546000 Cu 0.0807513 0.760155 2.39429e-19 148 63.546 1.68096e-05 -3.53995 63.546000 Cu 0.161794 0.763506 0.5 154 63.546 5.60055e-06 -3.53997 63.546000 Cu 0.0673467 0.780345 0.5 173 63.546 2.51332e-05 -3.53997 63.546000 Cu 0.148394 0.783693 2.39429e-19 175 63.546 6.65296e-06 -3.53999 63.546000 Cu 0.242824 0.766861 1.66164e-16 152 63.546 5.17027e-05 -3.53994 63.546000 Cu 0.323952 0.770228 0.5 155 63.546 1.67223e-05 -3.5399 63.546000 Cu 0.229469 0.787045 0.5 177 63.546 7.28916e-06 -3.53994 63.546000 Cu 0.310585 0.790406 1.07743e-17 179 63.546 5.05744e-06 -3.5399 63.546000 Cu 0.405094 0.7736 1 157 63.546 7.57779e-06 -3.53993 63.546000 Cu 0.486236 0.77698 0.5 162 63.546 1.32467e-05 -3.53993 63.546000 Cu 0.391692 0.793775 0.5 182 63.546 6.72402e-06 -3.53991 63.546000 Cu 0.472787 0.79716 1 183 63.546 3.22003e-05 -3.53994 63.546000 Cu 0.567347 0.780345 1 160 63.546 2.51332e-05 -3.53997 63.546000 Cu 0.580751 0.760155 0.5 161 63.546 1.68096e-05 -3.53995 63.546000 Cu 0.661794 0.763506 1 163 63.546 5.60055e-06 -3.53997 63.546000 Cu 0.648394 0.783693 0.5 166 63.546 6.65296e-06 -3.53999 63.546000 Cu 0.729469 0.787045 1 164 63.546 7.28916e-06 -3.53994 63.546000 Cu 0.742824 0.766861 0.5 165 63.546 5.17027e-05 -3.53994 63.546000 Cu 0.823952 0.770228 2.08304e-17 167 63.546 1.67223e-05 -3.5399 63.546000 Cu 0.810585 0.790406 0.5 170 63.546 5.05744e-06 -3.5399 63.546000 Cu 0.891692 0.793775 1.14926e-17 168 63.546 6.72402e-06 -3.53991 63.546000 Cu 0.905094 0.7736 0.5 169 63.546 7.57779e-06 -3.53993 63.546000 Cu 0.986236 0.77698 3.83087e-17 171 63.546 1.32467e-05 -3.53993 63.546000 Cu 0.972787 0.79716 0.5 174 63.546 3.22003e-05 -3.53994 63.546000 Cu 0.0539065 0.800522 0 172 63.546 1.09766e-05 -3.53998 63.546000 Cu 0.135014 0.803875 0.5 178 63.546 1.35394e-06 -3.54001 63.546000 Cu 0.0405238 0.820702 0.5 197 63.546 1.94661e-05 -3.53992 63.546000 Cu 0.121619 0.824059 1 199 63.546 1.61942e-05 -3.53999 63.546000 Cu 0.216118 0.807225 6.96739e-17 176 63.546 1.67104e-05 -3.53997 63.546000 Cu 0.297213 0.810578 0.5 180 63.546 2.35136e-05 -3.53994 63.546000 Cu 0.202683 0.827411 0.5 201 63.546 2.65377e-05 -3.54004 63.546000 Cu 0.283743 0.830741 2.35838e-16 203 63.546 6.69259e-05 -3.53996 63.546000 Cu 0.378304 0.813946 0 181 63.546 1.08267e-05 -3.53988 63.546000 Cu 0.459434 0.817327 0.5 186 63.546 1.05352e-05 -3.5399 63.546000 Cu 0.36491 0.834112 0.5 206 63.546 5.3261e-05 -3.53992 63.546000 Cu 0.446046 0.837502 9.57717e-18 207 63.546 5.49562e-05 -3.53977 63.546000 Cu 0.540524 0.820702 0 184 63.546 1.94661e-05 -3.53992 63.546000 Cu 0.553906 0.800522 0.5 185 63.546 1.09766e-05 -3.53998 63.546000 Cu 0.635014 0.803875 5.48293e-17 187 63.546 1.35394e-06 -3.54001 63.546000 Cu 0.621619 0.824059 0.5 190 63.546 1.61942e-05 -3.53999 63.546000 Cu 0.702683 0.827411 1.74783e-17 188 63.546 2.65377e-05 -3.54004 63.546000 Cu 0.716118 0.807225 0.5 189 63.546 1.67104e-05 -3.53997 63.546000 Cu 0.797213 0.810578 1.33123e-16 191 63.546 2.35136e-05 -3.53994 63.546000 Cu 0.783743 0.830741 0.5 194 63.546 6.69259e-05 -3.53996 63.546000 Cu 0.86491 0.834112 0 192 63.546 5.3261e-05 -3.53992 63.546000 Cu 0.878304 0.813946 0.5 193 63.546 1.08267e-05 -3.53988 63.546000 Cu 0.959434 0.817327 8.06877e-17 195 63.546 1.05352e-05 -3.5399 63.546000 Cu 0.946046 0.837502 0.5 198 63.546 5.49562e-05 -3.53977 63.546000 Cu 0.0272 0.840893 1 196 63.546 9.39413e-05 -3.53978 63.546000 Cu 0.108246 0.844264 0.5 202 63.546 6.88261e-05 -3.5399 63.546000 Cu 0.013762 0.861062 0.5 221 63.546 0.000272003 -3.5395 63.546000 Cu 0.0949867 0.86448 1 223 63.546 0.000499211 -3.53971 63.546000 Cu 0.189232 0.847594 0 200 63.546 0.000132036 -3.54008 63.546000 Cu 0.2703 0.850913 0.5 204 63.546 0.000154985 -3.54014 63.546000 Cu 0.176 0.867817 0.5 225 63.546 0.000238134 -3.54008 63.546000 Cu 0.256796 0.871096 2.06149e-16 227 63.546 0.000762827 -3.54019 63.546000 Cu 0.337744 0.874424 0.5 230 63.546 0.000587486 -3.54022 63.546000 Cu 0.351352 0.854251 2.84921e-17 205 63.546 0.000227785 -3.53995 63.546000 Cu 0.432563 0.857664 0.5 210 63.546 0.000213883 -3.53981 63.546000 Cu 0.418804 0.877743 1.04391e-16 231 63.546 0.00097824 -3.53964 63.546000 Cu 0.513762 0.861062 0 208 63.546 0.000272003 -3.5395 63.546000 Cu 0.5272 0.840893 0.5 209 63.546 9.39413e-05 -3.53978 63.546000 Cu 0.608246 0.844264 1 211 63.546 6.88261e-05 -3.5399 63.546000 Cu 0.594987 0.86448 0.5 214 63.546 0.000499211 -3.53971 63.546000 Cu 0.676 0.867817 1.2163e-16 212 63.546 0.000238134 -3.54008 63.546000 Cu 0.689232 0.847594 0.5 213 63.546 0.000132036 -3.54008 63.546000 Cu 0.7703 0.850913 1.31686e-17 215 63.546 0.000154985 -3.54014 63.546000 Cu 0.756796 0.871096 0.5 218 63.546 0.000762827 -3.54019 63.546000 Cu 0.837744 0.874424 1 216 63.546 0.000587486 -3.54022 63.546000 Cu 0.851352 0.854251 0.5 217 63.546 0.000227785 -3.53995 63.546000 Cu 0.932563 0.857664 1 219 63.546 0.000213883 -3.53981 63.546000 Cu 0.918804 0.877743 0.5 222 63.546 0.00097824 -3.53964 63.546000 Cu 0.162881 0.888092 1 224 63.546 0.00156482 -3.53975 63.546000 Cu 0.0817279 0.884636 0.5 226 63.546 0.00139373 -3.53927 63.546000 Cu 0.0684301 0.904781 1.36475e-17 247 63.546 0.00513777 -3.53924 63.546000 Cu 0.149538 0.908344 0.5 249 63.546 0.00510017 -3.53917 63.546000 Cu 0.00034821 0.881199 1 220 63.546 0.000988081 -3.53931 63.546000 Cu 0.324097 0.894589 1.74783e-17 228 63.546 0.00337265 -3.53995 63.546000 Cu 0.243542 0.8914 0.5 229 63.546 0.000436813 -3.5401 63.546000 Cu 0.230591 0.91178 9.57717e-19 251 63.546 0.00398843 -3.53884 63.546000 Cu 0.311022 0.91497 0.5 253 63.546 0.00365039 -3.53976 63.546000 Cu 0.486595 0.901129 1 232 63.546 0.00379701 -3.5391 63.546000 Cu 0.40521 0.897878 0.5 234 63.546 0.00230472 -3.53993 63.546000 Cu 0.391718 0.917918 9.05043e-17 255 63.546 0.0127985 -3.53964 63.546000 Cu 0.500348 0.881199 0.5 233 63.546 0.000988081 -3.53931 63.546000 Cu 0.581728 0.884636 1 235 63.546 0.00139373 -3.53927 63.546000 Cu 0.649538 0.908344 3.83087e-17 236 63.546 0.00510017 -3.53917 63.546000 Cu 0.662881 0.888092 0.5 237 63.546 0.00156482 -3.53975 63.546000 Cu 0.56843 0.904781 0.5 238 63.546 0.00513777 -3.53924 63.546000 Cu 0.743542 0.8914 3.59144e-18 239 63.546 0.000436813 -3.5401 63.546000 Cu 0.811022 0.91497 0 240 63.546 0.00365039 -3.53976 63.546000 Cu 0.824097 0.894589 0.5 241 63.546 0.00337265 -3.53995 63.546000 Cu 0.730591 0.91178 0.5 242 63.546 0.00398843 -3.53884 63.546000 Cu 0.90521 0.897878 1 243 63.546 0.00230472 -3.53993 63.546000 Cu 0.986595 0.901129 0.5 245 63.546 0.00379701 -3.5391 63.546000 Cu 0.891718 0.917918 0.5 246 63.546 0.0127985 -3.53964 63.546000 Cu 0.135964 0.928571 1 248 63.546 0.0238756 -3.53855 63.546000 Cu 0.0539078 0.924617 0.5 250 63.546 0.00969446 -3.53985 63.546000 Cu 0.0393625 0.944805 3.92664e-17 271 63.546 0.0264746 -3.54038 63.546000 Cu 0.119294 0.948264 0.5 273 63.546 0.0726841 -3.52719 63.546000 Cu 0.299337 0.93538 3.83087e-17 252 63.546 0.014147 -3.5365 63.546000 Cu 0.217229 0.932077 0.5 254 63.546 0.0235261 -3.53548 63.546000 Cu 0.20502 0.952002 6.12939e-17 275 63.546 0.0726159 -3.52359 63.546000 Cu 0.287704 0.955665 0.5 277 63.546 0.0973145 -3.52204 63.546000 Cu 0.458971 0.941038 1 256 63.546 0.0928268 -3.53782 63.546000 Cu 0.473098 0.921162 0.5 257 63.546 0.0106643 -3.54031 63.546000 Cu 0.379486 0.938363 0.5 258 63.546 0.0137542 -3.53991 63.546000 Cu 0.368925 0.959341 1.79093e-16 279 63.546 0.134943 -3.52961 63.546000 Cu 0.553908 0.924617 1 259 63.546 0.00969446 -3.53985 63.546000 Cu 0.619294 0.948264 3.83087e-17 260 63.546 0.0726841 -3.52719 63.546000 Cu 0.635964 0.928571 0.5 261 63.546 0.0238756 -3.53855 63.546000 Cu 0.539363 0.944805 0.5 262 63.546 0.0264746 -3.54038 63.546000 Cu 0.717229 0.932077 1 263 63.546 0.0235261 -3.53548 63.546000 Cu 0.787704 0.955665 1.74783e-17 264 63.546 0.0973145 -3.52204 63.546000 Cu 0.799337 0.93538 0.5 265 63.546 0.014147 -3.5365 63.546000 Cu 0.70502 0.952002 0.5 266 63.546 0.0726159 -3.52359 63.546000 Cu 0.973098 0.921162 1 244 63.546 0.0106643 -3.54031 63.546000 Cu 0.879486 0.938363 1 267 63.546 0.0137542 -3.53991 63.546000 Cu 0.958971 0.941038 0.5 269 63.546 0.0928268 -3.53782 63.546000 Cu 0.868925 0.959341 0.5 270 63.546 0.134943 -3.52961 63.546000 Cu 0.10587 0.968189 7.42231e-17 272 63.546 0.12669 -3.52254 63.546000 Cu 0.0208927 0.964999 0.5 274 63.546 0.305116 -3.5143 63.546000 Cu 0.00930488 0.985629 1.30489e-16 294 63.546 0.25233 -3.51581 63.546000 Cu 0.0905857 0.986773 0.5 295 63.546 0.381192 -3.50181 63.546000 Cu 0.277281 0.975597 1.13011e-16 276 63.546 0.736301 -3.44742 63.546000 Cu 0.189128 0.97048 0.5 278 63.546 0.220514 -3.5187 63.546000 Cu 0.179864 0.98937 1.24527e-15 296 63.546 4.19433 -3.39788 63.546000 Cu 0.263458 0.993209 0.5 297 63.546 9.09849 -3.31846 63.546000 Cu 0.429928 0.984825 2.27218e-16 280 63.546 0.492208 -3.45423 63.546000 Cu 0.445504 0.961895 0.5 281 63.546 0.140752 -3.5198 63.546000 Cu 0.359985 0.980868 0.5 282 63.546 1.26001 -3.41761 63.546000 Cu 0.520893 0.964999 1 283 63.546 0.305116 -3.5143 63.546000 Cu 0.590586 0.986773 1 284 63.546 0.381192 -3.50181 63.546000 Cu 0.60587 0.968189 0.5 285 63.546 0.12669 -3.52254 63.546000 Cu 0.509305 0.985629 0.5 286 63.546 0.25233 -3.51581 63.546000 Cu 0.689128 0.97048 1 287 63.546 0.220514 -3.5187 63.546000 Cu 0.763458 0.993209 1 288 63.546 9.09849 -3.31846 63.546000 Cu 0.777281 0.975597 0.5 289 63.546 0.736301 -3.44742 63.546000 Cu 0.679864 0.98937 0.5 290 63.546 4.19433 -3.39788 63.546000 Cu 0.945504 0.961895 1 268 63.546 0.140752 -3.5198 63.546000 Cu 0.859985 0.980868 1 291 63.546 1.26001 -3.41761 63.546000 Cu 0.929928 0.984825 0.5 292 63.546 0.492208 -3.45423