Number of particles = 588 A = 1 Angstrom (basic length-scale) H0(1,1) = 21.9806 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 88.3538 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60888 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 0.0381866 0.0150213 1.03347e-17 317 63.546 6.41115 -3.51119 63.546000 Cu 0.136379 0.0341787 2.40341e-19 318 63.546 0.432372 -3.4763 63.546000 Cu 0.123235 0.0113283 0.5 319 63.546 3.02966 -3.50298 63.546000 Cu 0.0629934 0.0391916 0.5 320 63.546 0.62445 -3.45081 63.546000 Cu 0.210375 0.0116324 0 321 63.546 0.578469 -3.52263 63.546000 Cu 0.2154 0.0326454 0.5 324 63.546 0.361247 -3.52054 63.546000 Cu 0.297829 0.0318961 6.36904e-17 322 63.546 0.354041 -3.51023 63.546000 Cu 0.293399 0.0117495 0.5 323 63.546 0.710425 -3.49717 63.546000 Cu 0.373213 0.0119202 1.63913e-16 325 63.546 6.6723 -3.25171 63.546000 Cu 0.38628 0.0297834 0.5 328 63.546 3.93331 -3.46913 63.546000 Cu 0.538187 0.0150213 0.5 299 63.546 6.41115 -3.51119 63.546000 Cu 0.562993 0.0391916 0 305 63.546 0.62445 -3.45081 63.546000 Cu 0.466665 0.0260674 7.93126e-17 326 63.546 8.60938 -3.32389 63.546000 Cu 0.482665 0.0447138 0.5 351 63.546 0.58084 -3.46161 63.546000 Cu 0.623235 0.0113283 0 298 63.546 3.02966 -3.50298 63.546000 Cu 0.793399 0.0117495 0 300 63.546 0.710425 -3.49717 63.546000 Cu 0.710375 0.0116324 0.5 301 63.546 0.578469 -3.52263 63.546000 Cu 0.636379 0.0341787 0.5 307 63.546 0.432372 -3.4763 63.546000 Cu 0.7154 0.0326454 1 309 63.546 0.361247 -3.52054 63.546000 Cu 0.797829 0.0318961 0.5 311 63.546 0.354041 -3.51023 63.546000 Cu 0.873213 0.0119202 0.5 303 63.546 6.6723 -3.25171 63.546000 Cu 0.88628 0.0297834 0 313 63.546 3.93331 -3.46913 63.546000 Cu 0.982665 0.0447138 0 314 63.546 0.58084 -3.46161 63.546000 Cu 0.966665 0.0260674 0.5 315 63.546 8.60938 -3.32389 63.546000 Cu 0.0752515 0.0604462 4.56648e-17 341 63.546 0.133212 -3.50654 63.546000 Cu 0.1662 0.0780159 1 342 63.546 0.0328106 -3.51622 63.546000 Cu 0.152525 0.0569208 0.5 343 63.546 0.0632983 -3.49549 63.546000 Cu 0.0864384 0.0810791 0.5 344 63.546 0.0106464 -3.53161 63.546000 Cu 0.00542029 0.0843258 1.43003e-16 338 63.546 0.0114203 -3.5485 63.546000 Cu 0.229348 0.0538999 2.40341e-19 345 63.546 0.139018 -3.51836 63.546000 Cu 0.32625 0.0712923 0 346 63.546 0.0339515 -3.54164 63.546000 Cu 0.311526 0.0512995 0.5 347 63.546 0.107277 -3.54084 63.546000 Cu 0.2455 0.0745615 0.5 348 63.546 0.0185081 -3.52675 63.546000 Cu 0.396085 0.0488238 2.0429e-17 349 63.546 0.0824375 -3.51832 63.546000 Cu 0.410117 0.0679427 0.5 352 63.546 0.0238482 -3.5448 63.546000 Cu 0.423343 0.08777 2.40341e-19 375 63.546 0.011607 -3.5502 63.546000 Cu 0.575251 0.0604462 0.5 308 63.546 0.133212 -3.50654 63.546000 Cu 0.586438 0.0810791 4.80682e-19 329 63.546 0.0106464 -3.53161 63.546000 Cu 0.493862 0.0642166 2.69182e-17 350 63.546 0.0590167 -3.5431 63.546000 Cu 0.50542 0.0843258 0.5 377 63.546 0.0114203 -3.5485 63.546000 Cu 0.652525 0.0569208 2.40341e-19 306 63.546 0.0632983 -3.49549 63.546000 Cu 0.729348 0.0538999 0.5 312 63.546 0.139018 -3.51836 63.546000 Cu 0.6662 0.0780159 0.5 331 63.546 0.0328106 -3.51622 63.546000 Cu 0.7455 0.0745615 9.63768e-17 333 63.546 0.0185081 -3.52675 63.546000 Cu 0.811526 0.0512995 0 310 63.546 0.107277 -3.54084 63.546000 Cu 0.896085 0.0488238 0.5 316 63.546 0.0824375 -3.51832 63.546000 Cu 0.82625 0.0712923 0.5 335 63.546 0.0339515 -3.54164 63.546000 Cu 0.910117 0.0679427 2.01887e-17 337 63.546 0.0238482 -3.5448 63.546000 Cu 0.993862 0.0642166 0.5 339 63.546 0.0590167 -3.5431 63.546000 Cu 0.923343 0.08777 0.5 340 63.546 0.011607 -3.5502 63.546000 Cu 0.0307653 0.125082 1.00222e-16 364 63.546 0.00058012 -3.53955 63.546000 Cu 0.0986276 0.101526 1.98281e-16 367 63.546 0.00211918 -3.53716 63.546000 Cu 0.192981 0.118533 1.55741e-16 368 63.546 0.00122002 -3.53896 63.546000 Cu 0.179524 0.098336 0.5 369 63.546 0.00687217 -3.53225 63.546000 Cu 0.111728 0.12183 0.5 370 63.546 0.00128172 -3.53886 63.546000 Cu 0.0177249 0.104682 0.5 365 63.546 0.00203491 -3.54293 63.546000 Cu 0.260316 0.0949113 1.21853e-16 371 63.546 0.00401984 -3.53269 63.546000 Cu 0.355557 0.111517 3.12444e-17 372 63.546 0.0013139 -3.54167 63.546000 Cu 0.341451 0.091299 0.5 373 63.546 0.00532872 -3.54209 63.546000 Cu 0.274341 0.115076 0.5 374 63.546 0.000848592 -3.53876 63.546000 Cu 0.28787 0.135278 8.1716e-17 397 63.546 0.000327985 -3.54101 63.546000 Cu 0.36907 0.1318 0.5 399 63.546 0.000783833 -3.54069 63.546000 Cu 0.598628 0.101526 0.5 332 63.546 0.00211918 -3.53716 63.546000 Cu 0.530765 0.125082 0.5 354 63.546 0.00058012 -3.53955 63.546000 Cu 0.517725 0.104682 4.80682e-19 376 63.546 0.00203491 -3.54293 63.546000 Cu 0.436683 0.108 0.5 378 63.546 0.00351752 -3.54471 63.546000 Cu 0.449983 0.128387 2.40341e-19 401 63.546 0.000467166 -3.54039 63.546000 Cu 0.611728 0.12183 0 355 63.546 0.00128172 -3.53886 63.546000 Cu 0.679524 0.098336 4.27807e-17 330 63.546 0.00687217 -3.53225 63.546000 Cu 0.760316 0.0949113 0.5 336 63.546 0.00401984 -3.53269 63.546000 Cu 0.692981 0.118533 0.5 357 63.546 0.00122002 -3.53896 63.546000 Cu 0.774341 0.115076 6.08063e-17 359 63.546 0.000848592 -3.53876 63.546000 Cu 0.78787 0.135278 0.5 362 63.546 0.000327985 -3.54101 63.546000 Cu 0.841451 0.091299 0 334 63.546 0.00532872 -3.54209 63.546000 Cu 0.86907 0.1318 0 360 63.546 0.000783833 -3.54069 63.546000 Cu 0.855557 0.111517 0.5 361 63.546 0.0013139 -3.54167 63.546000 Cu 0.936683 0.108 5.52785e-18 363 63.546 0.00351752 -3.54471 63.546000 Cu 0.949983 0.128387 0.5 366 63.546 0.000467166 -3.54039 63.546000 Cu 0.0577034 0.165714 4.03773e-17 390 63.546 9.68872e-05 -3.53931 63.546000 Cu 0.0442086 0.145427 0.5 391 63.546 0.000266042 -3.53888 63.546000 Cu 0.12524 0.142087 8.96473e-17 393 63.546 0.000352799 -3.53975 63.546000 Cu 0.138791 0.162346 0.5 396 63.546 8.73288e-05 -3.54014 63.546000 Cu 0.219997 0.158943 0 394 63.546 4.35901e-05 -3.54099 63.546000 Cu 0.20651 0.138712 0.5 395 63.546 0.000161936 -3.54075 63.546000 Cu 0.382379 0.152111 1 398 63.546 0.000273536 -3.54007 63.546000 Cu 0.301215 0.155517 0.5 400 63.546 0.00014095 -3.54097 63.546000 Cu 0.233424 0.179191 0.5 419 63.546 2.65958e-05 -3.54036 63.546000 Cu 0.31457 0.175786 0 421 63.546 8.46267e-05 -3.54033 63.546000 Cu 0.395632 0.17241 0.5 423 63.546 3.72658e-05 -3.53961 63.546000 Cu 0.544209 0.145427 2.40341e-19 353 63.546 0.000266042 -3.53888 63.546000 Cu 0.557703 0.165714 0.5 380 63.546 9.68872e-05 -3.53931 63.546000 Cu 0.463314 0.148749 0.5 402 63.546 9.34521e-05 -3.53895 63.546000 Cu 0.476645 0.169068 4.80682e-19 425 63.546 8.57958e-05 -3.53914 63.546000 Cu 0.70651 0.138712 0 356 63.546 0.000161936 -3.54075 63.546000 Cu 0.62524 0.142087 0.5 358 63.546 0.000352799 -3.53975 63.546000 Cu 0.638791 0.162346 4.80682e-19 381 63.546 8.73288e-05 -3.54014 63.546000 Cu 0.733424 0.179191 4.92699e-17 382 63.546 2.65958e-05 -3.54036 63.546000 Cu 0.719997 0.158943 0.5 383 63.546 4.35901e-05 -3.54099 63.546000 Cu 0.801215 0.155517 1.0575e-16 385 63.546 0.00014095 -3.54097 63.546000 Cu 0.81457 0.175786 0.5 388 63.546 8.46267e-05 -3.54033 63.546000 Cu 0.895632 0.17241 0 386 63.546 3.72658e-05 -3.53961 63.546000 Cu 0.882379 0.152111 0.5 387 63.546 0.000273536 -3.54007 63.546000 Cu 0.963314 0.148749 1.07432e-16 389 63.546 9.34521e-05 -3.53895 63.546000 Cu 0.976645 0.169068 0.5 392 63.546 8.57958e-05 -3.53914 63.546000 Cu 0.0845074 0.206229 0 414 63.546 2.02179e-05 -3.53991 63.546000 Cu 0.0711064 0.185982 0.5 415 63.546 5.51276e-05 -3.53975 63.546000 Cu 0.152256 0.182597 1.46368e-16 417 63.546 2.12273e-05 -3.54011 63.546000 Cu 0.165688 0.202842 0.5 420 63.546 1.48904e-05 -3.54012 63.546000 Cu 0.0979087 0.226469 0.5 441 63.546 3.09849e-05 -3.53999 63.546000 Cu 0.179075 0.223081 1 443 63.546 1.80855e-05 -3.54005 63.546000 Cu 0.00337712 0.209604 0.5 416 63.546 3.56204e-05 -3.53973 63.546000 Cu 0.24682 0.199444 0 418 63.546 3.15704e-05 -3.5401 63.546000 Cu 0.32789 0.196062 0.5 424 63.546 2.14236e-05 -3.53989 63.546000 Cu 0.260188 0.219706 0.5 445 63.546 9.12987e-06 -3.5399 63.546000 Cu 0.341275 0.216333 0 447 63.546 1.02533e-05 -3.53969 63.546000 Cu 0.408937 0.192697 0 422 63.546 1.36798e-05 -3.53963 63.546000 Cu 0.422299 0.212967 0.5 449 63.546 2.081e-05 -3.53957 63.546000 Cu 0.571106 0.185982 2.40341e-19 379 63.546 5.51276e-05 -3.53975 63.546000 Cu 0.597909 0.226469 2.37938e-17 403 63.546 3.09849e-05 -3.53999 63.546000 Cu 0.584507 0.206229 0.5 404 63.546 2.02179e-05 -3.53991 63.546000 Cu 0.490011 0.189339 0.5 426 63.546 1.95506e-05 -3.53956 63.546000 Cu 0.503377 0.209604 0 451 63.546 3.56204e-05 -3.53973 63.546000 Cu 0.652256 0.182597 0.5 384 63.546 2.12273e-05 -3.54011 63.546000 Cu 0.665688 0.202842 1 405 63.546 1.48904e-05 -3.54012 63.546000 Cu 0.760188 0.219706 1.82659e-17 406 63.546 9.12987e-06 -3.5399 63.546000 Cu 0.74682 0.199444 0.5 407 63.546 3.15704e-05 -3.5401 63.546000 Cu 0.679075 0.223081 0.5 408 63.546 1.80855e-05 -3.54005 63.546000 Cu 0.82789 0.196062 2.40341e-19 409 63.546 2.14236e-05 -3.53989 63.546000 Cu 0.922299 0.212967 2.09097e-17 410 63.546 2.081e-05 -3.53957 63.546000 Cu 0.908937 0.192697 0.5 411 63.546 1.36798e-05 -3.53963 63.546000 Cu 0.841275 0.216333 0.5 412 63.546 1.02533e-05 -3.53969 63.546000 Cu 0.990011 0.189339 1.17046e-16 413 63.546 1.95506e-05 -3.53956 63.546000 Cu 0.111405 0.24671 0 440 63.546 1.42742e-05 -3.54004 63.546000 Cu 0.0303035 0.250098 0.5 442 63.546 1.21347e-05 -3.54006 63.546000 Cu 0.192504 0.243332 0.5 446 63.546 1.68804e-05 -3.53987 63.546000 Cu 0.0438645 0.270338 4.97506e-17 465 63.546 6.18139e-06 -3.53996 63.546000 Cu 0.124951 0.26696 0.5 467 63.546 8.64553e-06 -3.53981 63.546000 Cu 0.016812 0.22985 2.40341e-19 439 63.546 1.42479e-05 -3.53977 63.546000 Cu 0.205999 0.26358 2.40341e-19 469 63.546 1.12591e-05 -3.53968 63.546000 Cu 0.273572 0.239956 1 444 63.546 1.99754e-05 -3.53976 63.546000 Cu 0.354666 0.236589 0.5 450 63.546 6.67344e-06 -3.53961 63.546000 Cu 0.287047 0.26021 0.5 471 63.546 7.2381e-06 -3.53981 63.546000 Cu 0.368115 0.25684 0 473 63.546 6.34592e-06 -3.53998 63.546000 Cu 0.530304 0.250098 0 427 63.546 1.21347e-05 -3.54006 63.546000 Cu 0.543864 0.270338 0.5 430 63.546 6.18139e-06 -3.53996 63.546000 Cu 0.435721 0.233224 7.85916e-17 448 63.546 1.90628e-05 -3.5396 63.546000 Cu 0.516812 0.22985 0.5 452 63.546 1.42479e-05 -3.53977 63.546000 Cu 0.449198 0.253473 0.5 475 63.546 1.60019e-05 -3.5401 63.546000 Cu 0.611405 0.24671 0.5 429 63.546 1.42742e-05 -3.54004 63.546000 Cu 0.624951 0.26696 2.61972e-17 428 63.546 8.64553e-06 -3.53981 63.546000 Cu 0.692504 0.243332 4.39824e-17 431 63.546 1.68804e-05 -3.53987 63.546000 Cu 0.787047 0.26021 3.05233e-17 432 63.546 7.2381e-06 -3.53981 63.546000 Cu 0.773572 0.239956 0.5 433 63.546 1.99754e-05 -3.53976 63.546000 Cu 0.705999 0.26358 0.5 434 63.546 1.12591e-05 -3.53968 63.546000 Cu 0.854666 0.236589 1.0599e-16 435 63.546 6.67344e-06 -3.53961 63.546000 Cu 0.949198 0.253473 2.40341e-19 436 63.546 1.60019e-05 -3.5401 63.546000 Cu 0.935721 0.233224 0.5 437 63.546 1.90628e-05 -3.5396 63.546000 Cu 0.868115 0.25684 0.5 438 63.546 6.34592e-06 -3.53998 63.546000 Cu 0.138501 0.287209 1 466 63.546 3.53843e-05 -3.53979 63.546000 Cu 0.0574036 0.29058 0.5 468 63.546 1.59008e-05 -3.53986 63.546000 Cu 0.0709073 0.310829 5.64802e-17 489 63.546 3.17192e-05 -3.5398 63.546000 Cu 0.151979 0.307471 0.5 491 63.546 6.24244e-06 -3.53966 63.546000 Cu 0.219515 0.283842 0.5 472 63.546 4.36831e-06 -3.53984 63.546000 Cu 0.300538 0.280469 3.60512e-18 470 63.546 1.00739e-05 -3.53998 63.546000 Cu 0.38159 0.2771 0.5 476 63.546 4.06103e-05 -3.54007 63.546000 Cu 0.233019 0.304113 0 493 63.546 2.10632e-05 -3.53979 63.546000 Cu 0.314065 0.30074 0.5 495 63.546 4.09259e-05 -3.53997 63.546000 Cu 0.395138 0.297347 0 497 63.546 2.57651e-05 -3.54002 63.546000 Cu 0.408757 0.317595 0.5 500 63.546 8.34602e-06 -3.54012 63.546000 Cu 0.557404 0.29058 2.40341e-19 453 63.546 1.59008e-05 -3.53986 63.546000 Cu 0.570907 0.310829 0.5 456 63.546 3.17192e-05 -3.5398 63.546000 Cu 0.462729 0.273723 4.87893e-17 474 63.546 1.29604e-05 -3.54013 63.546000 Cu 0.489849 0.314206 7.23427e-17 498 63.546 1.71476e-05 -3.54011 63.546000 Cu 0.476284 0.293955 0.5 499 63.546 2.11555e-05 -3.53997 63.546000 Cu 0.651979 0.307471 4.80682e-19 454 63.546 6.24244e-06 -3.53966 63.546000 Cu 0.638501 0.287209 0.5 455 63.546 3.53843e-05 -3.53979 63.546000 Cu 0.719515 0.283842 1 457 63.546 4.36831e-06 -3.53984 63.546000 Cu 0.733019 0.304113 0.5 460 63.546 2.10632e-05 -3.53979 63.546000 Cu 0.814065 0.30074 4.80682e-19 458 63.546 4.09259e-05 -3.53997 63.546000 Cu 0.800538 0.280469 0.5 459 63.546 1.00739e-05 -3.53998 63.546000 Cu 0.88159 0.2771 4.80682e-19 461 63.546 4.06103e-05 -3.54007 63.546000 Cu 0.976284 0.293955 1.27381e-17 462 63.546 2.11555e-05 -3.53997 63.546000 Cu 0.962729 0.273723 0.5 463 63.546 1.29604e-05 -3.54013 63.546000 Cu 0.895138 0.297347 0.5 464 63.546 2.57651e-05 -3.54002 63.546000 Cu 0.908757 0.317595 0 485 63.546 8.34602e-06 -3.54012 63.546000 Cu 0.989849 0.314206 0.5 487 63.546 1.71476e-05 -3.54011 63.546000 Cu 0.165466 0.32774 9.13296e-18 490 63.546 2.81198e-05 -3.53963 63.546000 Cu 0.0844643 0.331094 0.5 492 63.546 3.24001e-05 -3.53956 63.546000 Cu 0.098052 0.351376 1.68239e-17 515 63.546 2.10376e-05 -3.53952 63.546000 Cu 0.179048 0.348028 0.5 517 63.546 6.73608e-05 -3.5402 63.546000 Cu 0.00342416 0.334461 0 486 63.546 3.60051e-05 -3.53965 63.546000 Cu 0.0170521 0.354714 0.5 513 63.546 0.000166863 -3.53919 63.546000 Cu 0.327641 0.320988 3.26864e-17 494 63.546 9.35284e-06 -3.54007 63.546000 Cu 0.246491 0.324377 0.5 496 63.546 7.84821e-05 -3.53996 63.546000 Cu 0.260086 0.344643 0 519 63.546 8.14077e-05 -3.5406 63.546000 Cu 0.354923 0.361486 0 520 63.546 6.57172e-05 -3.54022 63.546000 Cu 0.341179 0.34124 0.5 521 63.546 7.30261e-05 -3.54036 63.546000 Cu 0.422301 0.337845 0 523 63.546 4.7196e-05 -3.53992 63.546000 Cu 0.584464 0.331094 1.68239e-18 477 63.546 3.24001e-05 -3.53956 63.546000 Cu 0.598052 0.351376 0.5 480 63.546 2.10376e-05 -3.53952 63.546000 Cu 0.517052 0.354714 0 524 63.546 0.000166863 -3.53919 63.546000 Cu 0.503424 0.334461 0.5 525 63.546 3.60051e-05 -3.53965 63.546000 Cu 0.436007 0.358086 0.5 526 63.546 0.000133935 -3.53951 63.546000 Cu 0.679048 0.348028 0 478 63.546 6.73608e-05 -3.5402 63.546000 Cu 0.665466 0.32774 0.5 479 63.546 2.81198e-05 -3.53963 63.546000 Cu 0.746491 0.324377 1 481 63.546 7.84821e-05 -3.53996 63.546000 Cu 0.760086 0.344643 0.5 484 63.546 8.14077e-05 -3.5406 63.546000 Cu 0.841179 0.34124 1.00943e-17 482 63.546 7.30261e-05 -3.54036 63.546000 Cu 0.827641 0.320988 0.5 483 63.546 9.35284e-06 -3.54007 63.546000 Cu 0.922301 0.337845 0.5 488 63.546 4.7196e-05 -3.53992 63.546000 Cu 0.854923 0.361486 0.5 509 63.546 6.57172e-05 -3.54022 63.546000 Cu 0.936007 0.358086 0 511 63.546 0.000133935 -3.53951 63.546000 Cu 0.0307817 0.375007 2.83603e-17 512 63.546 0.000148191 -3.53897 63.546000 Cu 0.192662 0.368309 0 516 63.546 0.000256488 -3.54066 63.546000 Cu 0.111664 0.371678 0.5 518 63.546 0.000134498 -3.53979 63.546000 Cu 0.0445126 0.395358 0.5 539 63.546 0.000176279 -3.53959 63.546000 Cu 0.125312 0.39199 1 541 63.546 0.000595586 -3.5402 63.546000 Cu 0.220192 0.408772 1 542 63.546 0.000532881 -3.53988 63.546000 Cu 0.206395 0.388558 0.5 543 63.546 0.000347432 -3.54087 63.546000 Cu 0.273787 0.3649 0.5 522 63.546 0.000126342 -3.54088 63.546000 Cu 0.28763 0.385118 1.71604e-16 545 63.546 8.53275e-05 -3.5409 63.546000 Cu 0.382797 0.401933 1 546 63.546 0.00110681 -3.53944 63.546000 Cu 0.368859 0.38171 0.5 547 63.546 0.000229734 -3.5401 63.546000 Cu 0.301519 0.40529 0.5 548 63.546 0.000506801 -3.54038 63.546000 Cu 0.544513 0.395358 2.40341e-19 501 63.546 0.000176279 -3.53959 63.546000 Cu 0.530782 0.375007 0.5 502 63.546 0.000148191 -3.53897 63.546000 Cu 0.449906 0.378345 2.40341e-19 549 63.546 0.000336535 -3.53906 63.546000 Cu 0.46377 0.398645 0.5 550 63.546 0.000694772 -3.539 63.546000 Cu 0.611664 0.371678 1 503 63.546 0.000134498 -3.53979 63.546000 Cu 0.706395 0.388558 1 504 63.546 0.000347432 -3.54087 63.546000 Cu 0.692662 0.368309 0.5 505 63.546 0.000256488 -3.54066 63.546000 Cu 0.625312 0.39199 0.5 506 63.546 0.000595586 -3.5402 63.546000 Cu 0.773787 0.3649 1.61029e-17 507 63.546 0.000126342 -3.54088 63.546000 Cu 0.78763 0.385118 0.5 510 63.546 8.53275e-05 -3.5409 63.546000 Cu 0.720192 0.408772 0.5 531 63.546 0.000532881 -3.53988 63.546000 Cu 0.801519 0.40529 6.48921e-18 533 63.546 0.000506801 -3.54038 63.546000 Cu 0.868859 0.38171 1 508 63.546 0.000229734 -3.5401 63.546000 Cu 0.949906 0.378345 0.5 514 63.546 0.000336535 -3.53906 63.546000 Cu 0.882797 0.401933 0.5 535 63.546 0.00110681 -3.53944 63.546000 Cu 0.96377 0.398645 1 537 63.546 0.000694772 -3.539 63.546000 Cu 0.0581658 0.415742 4.80682e-19 538 63.546 0.00181001 -3.54267 63.546000 Cu 0.139089 0.412296 0.5 544 63.546 0.00103455 -3.54106 63.546000 Cu 0.0717155 0.436045 0.5 563 63.546 0.00744762 -3.54821 63.546000 Cu 0.153148 0.432569 1 565 63.546 0.00364675 -3.54256 63.546000 Cu 0.168063 0.452671 0.5 568 63.546 0.0182934 -3.54683 63.546000 Cu 0.249096 0.449209 0 566 63.546 0.0107364 -3.53146 63.546000 Cu 0.234284 0.42895 0.5 567 63.546 0.00136936 -3.5368 63.546000 Cu 0.315316 0.425447 0 569 63.546 0.00399617 -3.53549 63.546000 Cu 0.396442 0.42217 0.5 571 63.546 0.0026889 -3.53734 63.546000 Cu 0.329254 0.445617 0.5 572 63.546 0.0292763 -3.51803 63.546000 Cu 0.40935 0.442538 0 570 63.546 0.00582432 -3.53162 63.546000 Cu 0.571715 0.436045 4.56648e-18 527 63.546 0.00744762 -3.54821 63.546000 Cu 0.558166 0.415742 0.5 528 63.546 0.00181001 -3.54267 63.546000 Cu 0.477317 0.419011 0 573 63.546 0.00111832 -3.5414 63.546000 Cu 0.490149 0.439379 0.5 574 63.546 0.00516426 -3.5453 63.546000 Cu 0.639089 0.412296 1 529 63.546 0.00103455 -3.54106 63.546000 Cu 0.734284 0.42895 2.40341e-19 530 63.546 0.00136936 -3.5368 63.546000 Cu 0.653148 0.432569 0.5 532 63.546 0.00364675 -3.54256 63.546000 Cu 0.668063 0.452671 4.80682e-19 553 63.546 0.0182934 -3.54683 63.546000 Cu 0.749096 0.449209 0.5 555 63.546 0.0107364 -3.53146 63.546000 Cu 0.815316 0.425447 0.5 536 63.546 0.00399617 -3.53549 63.546000 Cu 0.896442 0.42217 5.04716e-17 534 63.546 0.0026889 -3.53734 63.546000 Cu 0.977317 0.419011 0.5 540 63.546 0.00111832 -3.5414 63.546000 Cu 0.829254 0.445617 2.40341e-19 557 63.546 0.0292763 -3.51803 63.546000 Cu 0.90935 0.442538 0.5 559 63.546 0.00582432 -3.53162 63.546000 Cu 0.990149 0.439379 2.40341e-19 561 63.546 0.00516426 -3.5453 63.546000 Cu 0.0848568 0.456087 1.21853e-16 562 63.546 0.0180028 -3.54743 63.546000 Cu 0.108203 0.494564 9.63768e-17 582 63.546 4.80359 -3.46427 63.546000 Cu 0.098469 0.475518 0.5 583 63.546 0.0536406 -3.5267 63.546000 Cu 0.183046 0.472647 0 585 63.546 0.0898715 -3.54375 63.546000 Cu 0.199694 0.491662 0.5 588 63.546 0.466964 -3.4887 63.546000 Cu 0.00214958 0.459558 0.5 564 63.546 0.0293805 -3.54512 63.546000 Cu 0.0132079 0.479454 0 581 63.546 1.43374 -3.46296 63.546000 Cu 0.0262203 0.499015 0.5 584 63.546 9.74959 -3.35657 63.546000 Cu 0.359963 0.488724 0.5 8 63.546 0.667042 -3.46762 63.546000 Cu 0.343458 0.466396 5.47978e-17 296 63.546 0.0627667 -3.50018 63.546000 Cu 0.28149 0.490565 1 586 63.546 0.28147 -3.5071 63.546000 Cu 0.266254 0.469511 0.5 587 63.546 0.13072 -3.51321 63.546000 Cu 0.421168 0.463065 0.5 10 63.546 0.0844272 -3.50158 63.546000 Cu 0.513208 0.479454 0.5 1 63.546 1.43374 -3.46296 63.546000 Cu 0.50215 0.459558 0 2 63.546 0.0293805 -3.54512 63.546000 Cu 0.433628 0.48415 1.22093e-16 288 63.546 1.97613 -3.41943 63.546000 Cu 0.598469 0.475518 1 551 63.546 0.0536406 -3.5267 63.546000 Cu 0.584857 0.456087 0.5 552 63.546 0.0180028 -3.54743 63.546000 Cu 0.52622 0.499015 5.96046e-17 575 63.546 9.74959 -3.35657 63.546000 Cu 0.608203 0.494564 0.5 576 63.546 4.80359 -3.46427 63.546000 Cu 0.766254 0.469511 3.14847e-17 554 63.546 0.13072 -3.51321 63.546000 Cu 0.683046 0.472647 0.5 556 63.546 0.0898715 -3.54375 63.546000 Cu 0.699694 0.491662 2.9562e-17 577 63.546 0.466964 -3.4887 63.546000 Cu 0.78149 0.490565 0.5 578 63.546 0.28147 -3.5071 63.546000 Cu 0.921168 0.463065 0 558 63.546 0.0844272 -3.50158 63.546000 Cu 0.843458 0.466396 0.5 560 63.546 0.0627667 -3.50018 63.546000 Cu 0.859963 0.488724 2.64375e-18 579 63.546 0.667042 -3.46762 63.546000 Cu 0.933628 0.48415 0.5 580 63.546 1.97613 -3.41943 63.546000 Cu 0.127155 0.511882 0.5 4 63.546 6.66593 -3.2526 63.546000 Cu 0.0173722 0.544673 1.21853e-16 20 63.546 0.571824 -3.46202 63.546000 Cu 0.0335351 0.52606 0.5 21 63.546 8.60602 -3.32278 63.546000 Cu 0.113875 0.529766 0 23 63.546 3.9568 -3.4712 63.546000 Cu 0.206889 0.511747 2.40341e-19 3 63.546 0.709069 -3.49614 63.546000 Cu 0.376999 0.511376 6.87376e-17 5 63.546 3.01461 -3.5034 63.546000 Cu 0.28983 0.511648 0.5 6 63.546 0.578604 -3.52249 63.546000 Cu 0.20224 0.531896 0.5 25 63.546 0.352211 -3.50981 63.546000 Cu 0.284601 0.532667 6.24887e-18 27 63.546 0.351156 -3.5201 63.546000 Cu 0.363653 0.534194 0.5 29 63.546 0.422165 -3.47684 63.546000 Cu 0.462098 0.51505 0.5 7 63.546 6.4023 -3.51169 63.546000 Cu 0.533535 0.52606 0 9 63.546 8.60602 -3.32278 63.546000 Cu 0.437125 0.539138 1 31 63.546 0.612846 -3.4519 63.546000 Cu 0.517372 0.544673 0.5 34 63.546 0.571824 -3.46202 63.546000 Cu 0.627155 0.511882 1 11 63.546 6.66593 -3.2526 63.546000 Cu 0.70224 0.531896 2.40341e-19 12 63.546 0.352211 -3.50981 63.546000 Cu 0.706889 0.511747 0.5 13 63.546 0.709069 -3.49614 63.546000 Cu 0.613875 0.529766 0.5 14 63.546 3.9568 -3.4712 63.546000 Cu 0.78983 0.511648 0 15 63.546 0.578604 -3.52249 63.546000 Cu 0.784601 0.532667 0.5 18 63.546 0.351156 -3.5201 63.546000 Cu 0.863653 0.534194 1.73046e-17 16 63.546 0.422165 -3.47684 63.546000 Cu 0.876999 0.511376 0.5 17 63.546 3.01461 -3.5034 63.546000 Cu 0.962098 0.51505 0 19 63.546 6.4023 -3.51169 63.546000 Cu 0.937125 0.539138 0.5 22 63.546 0.612846 -3.4519 63.546000 Cu 0.103839 0.548804 0.5 26 63.546 0.0806568 -3.51821 63.546000 Cu 0.0060084 0.564183 0.5 45 63.546 0.0593594 -3.54383 63.546000 Cu 0.0896926 0.567936 1.03587e-16 47 63.546 0.0232357 -3.54528 63.546000 Cu 0.173516 0.571291 0.5 49 63.546 0.0327823 -3.54165 63.546000 Cu 0.076331 0.587762 0.5 50 63.546 0.0108677 -3.55034 63.546000 Cu 0.18834 0.551307 1.21853e-16 24 63.546 0.103902 -3.54053 63.546000 Cu 0.347433 0.556916 1.21853e-16 28 63.546 0.0620402 -3.49624 63.546000 Cu 0.270544 0.553922 0.5 30 63.546 0.137175 -3.51809 63.546000 Cu 0.254272 0.57457 8.72438e-17 51 63.546 0.0181727 -3.52691 63.546000 Cu 0.333601 0.578004 0.5 53 63.546 0.0317415 -3.51634 63.546000 Cu 0.424673 0.560423 0.5 32 63.546 0.131652 -3.50737 63.546000 Cu 0.506008 0.564183 2.57165e-17 33 63.546 0.0593594 -3.54383 63.546000 Cu 0.413349 0.581062 1.63432e-17 55 63.546 0.0104638 -3.5314 63.546000 Cu 0.494308 0.584295 0.5 58 63.546 0.0120326 -3.54844 63.546000 Cu 0.589693 0.567936 0.5 38 63.546 0.0232357 -3.54528 63.546000 Cu 0.576331 0.587762 3.07637e-17 59 63.546 0.0108677 -3.55034 63.546000 Cu 0.603839 0.548804 1 35 63.546 0.0806568 -3.51821 63.546000 Cu 0.673516 0.571291 1.22093e-16 36 63.546 0.0327823 -3.54165 63.546000 Cu 0.68834 0.551307 0.5 37 63.546 0.103902 -3.54053 63.546000 Cu 0.770544 0.553922 5.67205e-17 39 63.546 0.137175 -3.51809 63.546000 Cu 0.754272 0.57457 0.5 42 63.546 0.0181727 -3.52691 63.546000 Cu 0.994308 0.584295 0 44 63.546 0.0120326 -3.54844 63.546000 Cu 0.833601 0.578004 1.18248e-16 40 63.546 0.0317415 -3.51634 63.546000 Cu 0.847433 0.556916 0.5 41 63.546 0.0620402 -3.49624 63.546000 Cu 0.924673 0.560423 7.42654e-17 43 63.546 0.131652 -3.50737 63.546000 Cu 0.913349 0.581062 0.5 46 63.546 0.0104638 -3.5314 63.546000 Cu 0.158252 0.591303 0 48 63.546 0.00514894 -3.54243 63.546000 Cu 0.0629679 0.607981 1.16565e-16 71 63.546 0.00353983 -3.54455 63.546000 Cu 0.130636 0.631774 2.35534e-17 72 63.546 0.00104119 -3.54078 63.546000 Cu 0.144166 0.611508 0.5 73 63.546 0.00119413 -3.54177 63.546000 Cu 0.0497082 0.62835 0.5 74 63.546 0.000652859 -3.54032 63.546000 Cu 0.320207 0.598331 0 52 63.546 0.00665951 -3.53232 63.546000 Cu 0.239404 0.594918 0.5 54 63.546 0.00446702 -3.53308 63.546000 Cu 0.225435 0.615087 3.24461e-17 75 63.546 0.000938129 -3.5389 63.546000 Cu 0.306784 0.618535 0.5 77 63.546 0.00139379 -3.53892 63.546000 Cu 0.211918 0.63527 0.5 78 63.546 0.000301324 -3.5411 63.546000 Cu 0.387997 0.621818 1.15844e-16 79 63.546 0.00115414 -3.53857 63.546000 Cu 0.401066 0.601511 0.5 56 63.546 0.00182396 -3.5369 63.546000 Cu 0.481935 0.604656 4.97506e-17 57 63.546 0.00200175 -3.54259 63.546000 Cu 0.562968 0.607981 0.5 62 63.546 0.00353983 -3.54455 63.546000 Cu 0.468918 0.625051 0.5 82 63.546 0.000455932 -3.53921 63.546000 Cu 0.549708 0.62835 4.80682e-19 83 63.546 0.000652859 -3.54032 63.546000 Cu 0.644166 0.611508 0 60 63.546 0.00119413 -3.54177 63.546000 Cu 0.658252 0.591303 0.5 61 63.546 0.00514894 -3.54243 63.546000 Cu 0.739404 0.594918 0 63 63.546 0.00446702 -3.53308 63.546000 Cu 0.725435 0.615087 0.5 66 63.546 0.000938129 -3.5389 63.546000 Cu 0.630636 0.631774 0.5 85 63.546 0.00104119 -3.54078 63.546000 Cu 0.711918 0.63527 1.29544e-16 87 63.546 0.000301324 -3.5411 63.546000 Cu 0.981935 0.604656 0.5 69 63.546 0.00200175 -3.54259 63.546000 Cu 0.806784 0.618535 5.31154e-17 64 63.546 0.00139379 -3.53892 63.546000 Cu 0.820207 0.598331 0.5 65 63.546 0.00665951 -3.53232 63.546000 Cu 0.901066 0.601511 9.63768e-17 67 63.546 0.00182396 -3.5369 63.546000 Cu 0.968918 0.625051 2.88409e-17 68 63.546 0.000455932 -3.53921 63.546000 Cu 0.887997 0.621818 0.5 70 63.546 0.00115414 -3.53857 63.546000 Cu 0.0364171 0.648713 0 95 63.546 0.000174504 -3.53896 63.546000 Cu 0.104295 0.672363 2.40341e-19 96 63.546 9.55154e-05 -3.5396 63.546000 Cu 0.117385 0.652071 0.5 97 63.546 0.000470992 -3.54011 63.546000 Cu 0.0232286 0.669029 0.5 98 63.546 5.12733e-05 -3.53906 63.546000 Cu 0.198594 0.65549 0 99 63.546 0.000232294 -3.54098 63.546000 Cu 0.185393 0.675746 0.5 102 63.546 0.000139743 -3.54041 63.546000 Cu 0.293329 0.638717 7.81109e-17 76 63.546 0.000280649 -3.54061 63.546000 Cu 0.37458 0.642082 0.5 81 63.546 0.000481343 -3.53958 63.546000 Cu 0.266557 0.679171 1.49012e-17 100 63.546 2.71967e-05 -3.54049 63.546000 Cu 0.279892 0.658931 0.5 101 63.546 7.40638e-05 -3.54089 63.546000 Cu 0.361114 0.662343 9.39734e-17 103 63.546 0.000196906 -3.54003 63.546000 Cu 0.455569 0.645398 2.40341e-19 80 63.546 0.000205344 -3.53874 63.546000 Cu 0.536417 0.648713 0.5 86 63.546 0.000174504 -3.53896 63.546000 Cu 0.442184 0.6657 0.5 105 63.546 0.000177427 -3.5392 63.546000 Cu 0.523229 0.669029 9.63768e-17 107 63.546 5.12733e-05 -3.53906 63.546000 Cu 0.617385 0.652071 3.60512e-18 84 63.546 0.000470992 -3.54011 63.546000 Cu 0.698594 0.65549 0.5 90 63.546 0.000232294 -3.54098 63.546000 Cu 0.604295 0.672363 0.5 109 63.546 9.55154e-05 -3.5396 63.546000 Cu 0.685393 0.675746 0 111 63.546 0.000139743 -3.54041 63.546000 Cu 0.766557 0.679171 0.5 113 63.546 2.71967e-05 -3.54049 63.546000 Cu 0.779892 0.658931 1 88 63.546 7.40638e-05 -3.54089 63.546000 Cu 0.793329 0.638717 0.5 89 63.546 0.000280649 -3.54061 63.546000 Cu 0.87458 0.642082 1.6199e-16 91 63.546 0.000481343 -3.53958 63.546000 Cu 0.942184 0.6657 0 92 63.546 0.000177427 -3.5392 63.546000 Cu 0.955569 0.645398 0.5 93 63.546 0.000205344 -3.53874 63.546000 Cu 0.861114 0.662343 0.5 94 63.546 0.000196906 -3.54003 63.546000 Cu 0.0100454 0.689313 0 119 63.546 4.33446e-05 -3.53946 63.546000 Cu 0.077824 0.712943 4.1579e-17 120 63.546 3.03623e-05 -3.53951 63.546000 Cu 0.0910962 0.692655 0.5 121 63.546 2.59533e-05 -3.5397 63.546000 Cu 0.172143 0.696023 0 123 63.546 6.22343e-05 -3.53995 63.546000 Cu 0.158861 0.716291 0.5 126 63.546 2.88306e-05 -3.53958 63.546000 Cu 0.347732 0.682588 0.5 106 63.546 8.41361e-05 -3.54003 63.546000 Cu 0.239994 0.719657 4.13387e-17 124 63.546 6.81556e-05 -3.53988 63.546000 Cu 0.253263 0.699416 0.5 125 63.546 4.34911e-05 -3.54002 63.546000 Cu 0.334482 0.702818 0 127 63.546 2.25658e-05 -3.53998 63.546000 Cu 0.321137 0.723047 0.5 130 63.546 5.9078e-05 -3.53997 63.546000 Cu 0.428928 0.68597 7.61881e-17 104 63.546 0.000119469 -3.5396 63.546000 Cu 0.510045 0.689313 0.5 110 63.546 4.33446e-05 -3.53946 63.546000 Cu 0.40228 0.726447 6.84972e-17 128 63.546 3.96194e-05 -3.53992 63.546000 Cu 0.415688 0.706212 0.5 129 63.546 0.000127173 -3.53972 63.546000 Cu 0.496784 0.709586 1.17767e-17 131 63.546 9.78131e-05 -3.53963 63.546000 Cu 0.591096 0.692655 9.99819e-17 108 63.546 2.59533e-05 -3.5397 63.546000 Cu 0.577824 0.712943 0.5 133 63.546 3.03623e-05 -3.53951 63.546000 Cu 0.753263 0.699416 1.43003e-16 112 63.546 4.34911e-05 -3.54002 63.546000 Cu 0.672143 0.696023 0.5 114 63.546 6.22343e-05 -3.53995 63.546000 Cu 0.658861 0.716291 0 135 63.546 2.88306e-05 -3.53958 63.546000 Cu 0.739994 0.719657 0.5 137 63.546 6.81556e-05 -3.53988 63.546000 Cu 0.996784 0.709586 0.5 122 63.546 9.78131e-05 -3.53963 63.546000 Cu 0.847732 0.682588 1.21853e-16 115 63.546 8.41361e-05 -3.54003 63.546000 Cu 0.915688 0.706212 1 116 63.546 0.000127173 -3.53972 63.546000 Cu 0.928928 0.68597 0.5 117 63.546 0.000119469 -3.5396 63.546000 Cu 0.834482 0.702818 0.5 118 63.546 2.25658e-05 -3.53998 63.546000 Cu 0.821137 0.723047 1.29544e-16 139 63.546 5.9078e-05 -3.53997 63.546000 Cu 0.90228 0.726447 0.5 141 63.546 3.96194e-05 -3.53992 63.546000 Cu 0.0509874 0.753453 4.80682e-19 144 63.546 1.61344e-05 -3.54001 63.546000 Cu 0.0645017 0.733204 0.5 145 63.546 9.97786e-05 -3.53958 63.546000 Cu 0.145559 0.736552 1 147 63.546 5.64765e-05 -3.53983 63.546000 Cu 0.132079 0.756819 0.5 150 63.546 1.05977e-05 -3.53985 63.546000 Cu 0.21314 0.760179 4.80682e-19 148 63.546 1.13442e-05 -3.53978 63.546000 Cu 0.226619 0.739913 0.5 149 63.546 4.97702e-05 -3.54002 63.546000 Cu 0.307658 0.74329 9.37331e-17 151 63.546 4.27948e-05 -3.54009 63.546000 Cu 0.375235 0.766934 1.25458e-16 152 63.546 1.15781e-05 -3.54002 63.546000 Cu 0.294182 0.763553 0.5 154 63.546 1.18481e-05 -3.53991 63.546000 Cu 0.388769 0.746686 0.5 153 63.546 8.63304e-06 -3.54014 63.546000 Cu 0.564502 0.733204 2.40341e-19 132 63.546 9.97786e-05 -3.53958 63.546000 Cu 0.483389 0.729838 0.5 134 63.546 6.38366e-05 -3.53973 63.546000 Cu 0.456333 0.770316 0.5 155 63.546 7.81833e-06 -3.54 63.546000 Cu 0.469885 0.750079 1.22334e-16 156 63.546 1.2732e-05 -3.53998 63.546000 Cu 0.550987 0.753453 0.5 158 63.546 1.61344e-05 -3.54001 63.546000 Cu 0.726619 0.739913 1.22334e-16 136 63.546 4.97702e-05 -3.54002 63.546000 Cu 0.645559 0.736552 0.5 138 63.546 5.64765e-05 -3.53983 63.546000 Cu 0.632079 0.756819 3.55705e-17 159 63.546 1.05977e-05 -3.53985 63.546000 Cu 0.71314 0.760179 0.5 161 63.546 1.13442e-05 -3.53978 63.546000 Cu 0.794182 0.763553 4.80682e-19 163 63.546 1.18481e-05 -3.53991 63.546000 Cu 0.983389 0.729838 2.90813e-17 143 63.546 6.38366e-05 -3.53973 63.546000 Cu 0.888769 0.746686 2.40341e-19 140 63.546 8.63304e-06 -3.54014 63.546000 Cu 0.807658 0.74329 0.5 142 63.546 4.27948e-05 -3.54009 63.546000 Cu 0.969885 0.750079 0.5 146 63.546 1.2732e-05 -3.53998 63.546000 Cu 0.875235 0.766934 0.5 165 63.546 1.15781e-05 -3.54002 63.546000 Cu 0.956333 0.770316 4.80682e-19 167 63.546 7.81833e-06 -3.54 63.546000 Cu 0.0239198 0.793946 7.21023e-19 168 63.546 1.42039e-05 -3.54014 63.546000 Cu 0.0374825 0.773703 0.5 169 63.546 1.80502e-05 -3.54 63.546000 Cu 0.118593 0.777075 6.70552e-17 171 63.546 4.7595e-05 -3.53986 63.546000 Cu 0.105005 0.79734 0.5 174 63.546 1.50844e-05 -3.54007 63.546000 Cu 0.0103553 0.814211 0.5 193 63.546 3.12765e-05 -3.54017 63.546000 Cu 0.0914495 0.817593 2.57165e-17 195 63.546 4.05204e-05 -3.53994 63.546000 Cu 0.186047 0.800719 8.41194e-18 172 63.546 4.23176e-05 -3.5398 63.546000 Cu 0.199606 0.780446 0.5 173 63.546 2.84685e-06 -3.53991 63.546000 Cu 0.28064 0.783815 0 175 63.546 7.12283e-06 -3.53991 63.546000 Cu 0.348203 0.807443 4.51841e-17 176 63.546 1.70409e-05 -3.53998 63.546000 Cu 0.361692 0.787185 0.5 177 63.546 2.51769e-05 -3.54003 63.546000 Cu 0.267111 0.804082 0.5 178 63.546 1.37405e-05 -3.53978 63.546000 Cu 0.537483 0.773703 4.80682e-19 157 63.546 1.80502e-05 -3.54 63.546000 Cu 0.442841 0.790562 2.40341e-19 179 63.546 2.40174e-05 -3.54017 63.546000 Cu 0.429287 0.810823 0.5 180 63.546 4.90945e-06 -3.54009 63.546000 Cu 0.510355 0.814211 1.1296e-17 181 63.546 3.12765e-05 -3.54017 63.546000 Cu 0.52392 0.793946 0.5 182 63.546 1.42039e-05 -3.54014 63.546000 Cu 0.59145 0.817593 0.5 186 63.546 4.05204e-05 -3.53994 63.546000 Cu 0.699606 0.780446 4.80682e-19 160 63.546 2.84685e-06 -3.53991 63.546000 Cu 0.618593 0.777075 0.5 162 63.546 4.7595e-05 -3.53986 63.546000 Cu 0.605005 0.79734 4.80682e-19 183 63.546 1.50844e-05 -3.54007 63.546000 Cu 0.686047 0.800719 0.5 185 63.546 4.23176e-05 -3.5398 63.546000 Cu 0.767111 0.804082 4.80682e-19 187 63.546 1.37405e-05 -3.53978 63.546000 Cu 0.78064 0.783815 0.5 166 63.546 7.12283e-06 -3.53991 63.546000 Cu 0.861692 0.787185 1 164 63.546 2.51769e-05 -3.54003 63.546000 Cu 0.942841 0.790562 0.5 170 63.546 2.40174e-05 -3.54017 63.546000 Cu 0.848203 0.807443 0.5 189 63.546 1.70409e-05 -3.53998 63.546000 Cu 0.929287 0.810823 3.34074e-17 191 63.546 4.90945e-06 -3.54009 63.546000 Cu 0.159131 0.841225 5.84029e-17 196 63.546 9.31031e-05 -3.54009 63.546000 Cu 0.172562 0.820967 0.5 197 63.546 8.89821e-06 -3.53962 63.546000 Cu 0.0780583 0.837848 0.5 198 63.546 0.000157482 -3.53995 63.546000 Cu 0.0643938 0.858087 1.1296e-16 219 63.546 6.42369e-05 -3.53972 63.546000 Cu 0.145504 0.861489 0.5 221 63.546 7.39429e-05 -3.54011 63.546000 Cu 0.253667 0.824338 9.03683e-17 199 63.546 2.56422e-05 -3.53964 63.546000 Cu 0.321194 0.847991 5.31154e-17 200 63.546 7.81737e-06 -3.54004 63.546000 Cu 0.334697 0.827715 0.5 201 63.546 5.21033e-06 -3.53968 63.546000 Cu 0.24017 0.844611 0.5 202 63.546 2.61809e-05 -3.54032 63.546000 Cu 0.415762 0.831086 8.60421e-17 203 63.546 1.36075e-05 -3.53955 63.546000 Cu 0.402239 0.851354 0.5 204 63.546 2.69886e-05 -3.53961 63.546000 Cu 0.483295 0.85471 0 205 63.546 0.000104434 -3.53948 63.546000 Cu 0.496873 0.834462 0.5 206 63.546 2.49596e-05 -3.53973 63.546000 Cu 0.564394 0.858087 0.5 210 63.546 6.42369e-05 -3.53972 63.546000 Cu 0.578058 0.837848 1.16806e-16 207 63.546 0.000157482 -3.53995 63.546000 Cu 0.672562 0.820967 1.21853e-16 184 63.546 8.89821e-06 -3.53962 63.546000 Cu 0.753667 0.824338 0.5 190 63.546 2.56422e-05 -3.53964 63.546000 Cu 0.645504 0.861489 4.56648e-18 208 63.546 7.39429e-05 -3.54011 63.546000 Cu 0.659131 0.841225 0.5 209 63.546 9.31031e-05 -3.54009 63.546000 Cu 0.74017 0.844611 7.49864e-17 211 63.546 2.61809e-05 -3.54032 63.546000 Cu 0.996873 0.834462 7.21023e-19 192 63.546 2.49596e-05 -3.53973 63.546000 Cu 0.983295 0.85471 0.5 217 63.546 0.000104434 -3.53948 63.546000 Cu 0.834697 0.827715 2.40341e-19 188 63.546 5.21033e-06 -3.53968 63.546000 Cu 0.915762 0.831086 0.5 194 63.546 1.36075e-05 -3.53955 63.546000 Cu 0.821194 0.847991 0.5 213 63.546 7.81737e-06 -3.54004 63.546000 Cu 0.902239 0.851354 1.29784e-17 215 63.546 2.69886e-05 -3.53961 63.546000 Cu 0.13169 0.881724 6.75359e-17 220 63.546 0.000104492 -3.54028 63.546000 Cu 0.0506284 0.878346 0.5 222 63.546 0.000194105 -3.53939 63.546000 Cu 0.0368105 0.898639 1.21853e-16 243 63.546 0.000603098 -3.53919 63.546000 Cu 0.117888 0.901951 0.5 245 63.546 0.000598062 -3.53972 63.546000 Cu 0.199173 0.905321 1.08394e-16 247 63.546 0.000222506 -3.54044 63.546000 Cu 0.226594 0.864885 0 223 63.546 0.000101075 -3.5407 63.546000 Cu 0.294129 0.888544 0 224 63.546 0.000292653 -3.54078 63.546000 Cu 0.307695 0.868276 0.5 225 63.546 0.00010107 -3.5406 63.546000 Cu 0.212902 0.885124 0.5 226 63.546 8.04037e-05 -3.54098 63.546000 Cu 0.375192 0.891955 0.5 229 63.546 0.000386248 -3.53988 63.546000 Cu 0.280479 0.908776 0.5 249 63.546 0.000720204 -3.53978 63.546000 Cu 0.388699 0.871645 0 227 63.546 4.81984e-05 -3.53976 63.546000 Cu 0.456018 0.895322 0 228 63.546 9.52529e-05 -3.5394 63.546000 Cu 0.469669 0.87499 0.5 230 63.546 0.00014622 -3.53914 63.546000 Cu 0.550628 0.878346 1.8987e-17 231 63.546 0.000194105 -3.53939 63.546000 Cu 0.536811 0.898639 0.5 234 63.546 0.000603098 -3.53919 63.546000 Cu 0.726594 0.864885 0.5 214 63.546 0.000101075 -3.5407 63.546000 Cu 0.617888 0.901951 2.40341e-19 232 63.546 0.000598062 -3.53972 63.546000 Cu 0.63169 0.881724 0.5 233 63.546 0.000104492 -3.54028 63.546000 Cu 0.712902 0.885124 7.42654e-17 235 63.546 8.04037e-05 -3.54098 63.546000 Cu 0.699173 0.905321 0.5 238 63.546 0.000222506 -3.54044 63.546000 Cu 0.780479 0.908776 2.40341e-19 236 63.546 0.000720204 -3.53978 63.546000 Cu 0.794129 0.888544 0.5 237 63.546 0.000292653 -3.54078 63.546000 Cu 0.807695 0.868276 9.54154e-17 212 63.546 0.00010107 -3.5406 63.546000 Cu 0.969669 0.87499 1.2666e-16 216 63.546 0.00014622 -3.53914 63.546000 Cu 0.888699 0.871645 0.5 218 63.546 4.81984e-05 -3.53976 63.546000 Cu 0.875192 0.891955 4.9991e-17 239 63.546 0.000386248 -3.53988 63.546000 Cu 0.956018 0.895322 0.5 241 63.546 9.52529e-05 -3.5394 63.546000 Cu 0.104235 0.922165 0 244 63.546 0.00243288 -3.53748 63.546000 Cu 0.0232564 0.918976 0.5 246 63.546 0.00102368 -3.54144 63.546000 Cu 0.0103936 0.939336 9.61365e-19 267 63.546 0.00392856 -3.54546 63.546000 Cu 0.0912455 0.942502 0.5 269 63.546 0.00592132 -3.53214 63.546000 Cu 0.17144 0.945616 0 271 63.546 0.0293886 -3.51839 63.546000 Cu 0.185462 0.925472 0.5 250 63.546 0.00339224 -3.53564 63.546000 Cu 0.266491 0.928977 4.0858e-18 248 63.546 0.00176424 -3.53668 63.546000 Cu 0.361528 0.912276 0 251 63.546 0.000907743 -3.54071 63.546000 Cu 0.347493 0.93258 0.5 254 63.546 0.003802 -3.54243 63.546000 Cu 0.251631 0.949248 0.5 273 63.546 0.0101219 -3.53154 63.546000 Cu 0.332595 0.95272 0 275 63.546 0.0192853 -3.54702 63.546000 Cu 0.428849 0.936027 1 252 63.546 0.0069085 -3.54827 63.546000 Cu 0.442373 0.915703 0.5 253 63.546 0.00124856 -3.54247 63.546000 Cu 0.523256 0.918976 1 255 63.546 0.00102368 -3.54144 63.546000 Cu 0.510394 0.939336 0.5 258 63.546 0.00392856 -3.54546 63.546000 Cu 0.591245 0.942502 5.28751e-18 256 63.546 0.00592132 -3.53214 63.546000 Cu 0.604235 0.922165 0.5 257 63.546 0.00243288 -3.53748 63.546000 Cu 0.685462 0.925472 1.22093e-16 259 63.546 0.00339224 -3.53564 63.546000 Cu 0.751631 0.949248 2.40341e-19 260 63.546 0.0101219 -3.53154 63.546000 Cu 0.766491 0.928977 0.5 261 63.546 0.00176424 -3.53668 63.546000 Cu 0.67144 0.945616 0.5 262 63.546 0.0293886 -3.51839 63.546000 Cu 0.942373 0.915703 4.44631e-17 240 63.546 0.00124856 -3.54247 63.546000 Cu 0.861528 0.912276 0.5 242 63.546 0.000907743 -3.54071 63.546000 Cu 0.847493 0.93258 4.80682e-19 263 63.546 0.003802 -3.54243 63.546000 Cu 0.928849 0.936027 0.5 265 63.546 0.0069085 -3.54827 63.546000 Cu 0.832595 0.95272 0.5 266 63.546 0.0192853 -3.54702 63.546000 Cu 0.0793122 0.963014 2.40341e-19 268 63.546 0.0826658 -3.50222 63.546000 Cu 0.157091 0.966357 0.5 274 63.546 0.0650752 -3.50053 63.546000 Cu 0.0667518 0.984079 0.5 292 63.546 1.99024 -3.4197 63.546000 Cu 0.140418 0.988669 1.70642e-17 293 63.546 0.672367 -3.46813 63.546000 Cu 0.392545 0.994634 0.5 327 63.546 4.85913 -3.46536 63.546000 Cu 0.234284 0.969537 3.84546e-17 272 63.546 0.130586 -3.5126 63.546000 Cu 0.317601 0.972708 0.5 278 63.546 0.0923725 -3.54366 63.546000 Cu 0.218817 0.990564 0.5 294 63.546 0.291252 -3.50656 63.546000 Cu 0.300717 0.991674 0 295 63.546 0.476835 -3.48785 63.546000 Cu 0.474388 0.999034 0 297 63.546 9.71267 -3.35661 63.546000 Cu 0.402152 0.975562 3.26864e-17 276 63.546 0.0541515 -3.52729 63.546000 Cu 0.415721 0.956098 0.5 277 63.546 0.0177964 -3.54785 63.546000 Cu 0.498348 0.959525 0 279 63.546 0.0269617 -3.54531 63.546000 Cu 0.566752 0.984079 4.27807e-17 280 63.546 1.99024 -3.4197 63.546000 Cu 0.487296 0.979441 0.5 282 63.546 1.4364 -3.46342 63.546000 Cu 0.579312 0.963014 0.5 281 63.546 0.0826658 -3.50222 63.546000 Cu 0.657091 0.966357 2.40341e-19 283 63.546 0.0650752 -3.50053 63.546000 Cu 0.718817 0.990564 0 284 63.546 0.291252 -3.50656 63.546000 Cu 0.734284 0.969537 0.5 285 63.546 0.130586 -3.5126 63.546000 Cu 0.640418 0.988669 0.5 286 63.546 0.672367 -3.46813 63.546000 Cu 0.974388 0.999034 0.5 304 63.546 9.71267 -3.35661 63.546000 Cu 0.892545 0.994634 1.21372e-16 302 63.546 4.85913 -3.46536 63.546000 Cu 0.998348 0.959525 0.5 270 63.546 0.0269617 -3.54531 63.546000 Cu 0.987296 0.979441 0 291 63.546 1.4364 -3.46342 63.546000 Cu 0.915721 0.956098 6.17677e-17 264 63.546 0.0177964 -3.54785 63.546000 Cu 0.817601 0.972708 4.37421e-17 287 63.546 0.0923725 -3.54366 63.546000 Cu 0.902152 0.975562 0.5 289 63.546 0.0541515 -3.52729 63.546000 Cu 0.800717 0.991674 0.5 290 63.546 0.476835 -3.48785