Number of particles = 652 A = 1 Angstrom (basic length-scale) H0(1,1) = 23.3234 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 93.2134 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62824 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 0.0496757 0.0169344 1 385 63.546 0.121252 -3.27614 63.546000 Cu 0.160253 0.0172981 0 386 63.546 0.406238 -3.25153 63.546000 Cu 0.108585 0.00302094 0.5 387 63.546 0.351815 -3.26571 63.546000 Cu 0.0986685 0.0312011 0.5 388 63.546 0.0353476 -3.27204 63.546000 Cu 0.223523 0.00304009 0.5 389 63.546 4.64242 -3.23455 63.546000 Cu 0.207761 0.0333314 0.5 417 63.546 0.3969 -3.24845 63.546000 Cu 0.385439 0.00308088 1.17139e-17 331 63.546 3.61453 -3.19938 63.546000 Cu 0.266596 0.0226444 5.35492e-17 419 63.546 5.77242 -3.09786 63.546000 Cu 0.377026 0.0296163 3.92056e-17 420 63.546 0.377179 -3.27286 63.546000 Cu 0.32789 0.015356 0.5 421 63.546 7.178 -2.99513 63.546000 Cu 0.314118 0.0408243 0.5 422 63.546 0.390652 -3.25127 63.546000 Cu 0.496364 0.0030522 1.29809e-16 332 63.546 0.200648 -3.28902 63.546000 Cu 0.438611 0.0166648 0.5 333 63.546 0.140249 -3.27914 63.546000 Cu 0.488283 0.0306055 6.78927e-17 337 63.546 0.0243597 -3.27638 63.546000 Cu 0.598668 0.0312011 1 338 63.546 0.0353476 -3.27204 63.546000 Cu 0.549676 0.0169344 0.5 339 63.546 0.121252 -3.27614 63.546000 Cu 0.608585 0.00302094 1.67102e-16 341 63.546 0.351815 -3.26571 63.546000 Cu 0.723523 0.00304009 3.22729e-17 342 63.546 4.64242 -3.23455 63.546000 Cu 0.660253 0.0172981 0.5 343 63.546 0.406238 -3.25153 63.546000 Cu 0.707761 0.0333314 1 355 63.546 0.3969 -3.24845 63.546000 Cu 0.766596 0.0226444 0.5 357 63.546 5.77242 -3.09786 63.546000 Cu 0.814118 0.0408243 8.128e-18 356 63.546 0.390652 -3.25127 63.546000 Cu 0.82789 0.015356 4.78117e-19 359 63.546 7.178 -2.99513 63.546000 Cu 0.938611 0.0166648 1 360 63.546 0.140249 -3.27914 63.546000 Cu 0.885439 0.00308088 0.5 361 63.546 3.61453 -3.19938 63.546000 Cu 0.877026 0.0296163 0.5 362 63.546 0.377179 -3.27286 63.546000 Cu 0.996364 0.0030522 0.5 363 63.546 0.200648 -3.28902 63.546000 Cu 0.988283 0.0306055 0.5 383 63.546 0.0243597 -3.27638 63.546000 Cu 0.0370349 0.0448222 2.48621e-17 382 63.546 0.00589737 -3.27775 63.546000 Cu 0.0241316 0.072586 2.39059e-19 411 63.546 0.00368829 -3.28008 63.546000 Cu 0.13385 0.0744261 4.78117e-19 412 63.546 0.0701655 -3.28031 63.546000 Cu 0.0854794 0.0593631 0.5 413 63.546 0.0240674 -3.2766 63.546000 Cu 0.146703 0.0460437 6.9088e-17 415 63.546 0.149593 -3.27143 63.546000 Cu 0.194434 0.0620711 0.5 418 63.546 0.104717 -3.27626 63.546000 Cu 0.254069 0.0508932 1 416 63.546 0.0480223 -3.25966 63.546000 Cu 0.242279 0.0787221 1 451 63.546 0.0123874 -3.2765 63.546000 Cu 0.352093 0.0830776 0 452 63.546 0.0428803 -3.2791 63.546000 Cu 0.302765 0.0676121 0.5 453 63.546 0.0790218 -3.27456 63.546000 Cu 0.364202 0.0562123 0 455 63.546 0.134548 -3.2768 63.546000 Cu 0.42586 0.043734 0.5 335 63.546 0.0382304 -3.27654 63.546000 Cu 0.413514 0.070891 0.5 336 63.546 0.0288286 -3.2779 63.546000 Cu 0.475124 0.0580777 9.25157e-17 334 63.546 0.00741203 -3.2806 63.546000 Cu 0.537035 0.0448222 0.5 340 63.546 0.00589737 -3.27775 63.546000 Cu 0.462633 0.0854881 1 347 63.546 0.00552096 -3.28104 63.546000 Cu 0.524132 0.072586 0.5 349 63.546 0.00368829 -3.28008 63.546000 Cu 0.585479 0.0593631 1.0423e-16 351 63.546 0.0240674 -3.2766 63.546000 Cu 0.694434 0.0620711 0 352 63.546 0.104717 -3.27626 63.546000 Cu 0.646703 0.0460437 0.5 353 63.546 0.149593 -3.27143 63.546000 Cu 0.63385 0.0744261 0.5 354 63.546 0.0701655 -3.28031 63.546000 Cu 0.754069 0.0508932 0.5 358 63.546 0.0480223 -3.25966 63.546000 Cu 0.742279 0.0787221 0.5 375 63.546 0.0123874 -3.2765 63.546000 Cu 0.92586 0.043734 1 381 63.546 0.0382304 -3.27654 63.546000 Cu 0.802765 0.0676121 0 377 63.546 0.0790218 -3.27456 63.546000 Cu 0.913514 0.070891 1 378 63.546 0.0288286 -3.2779 63.546000 Cu 0.864202 0.0562123 0.5 379 63.546 0.134548 -3.2768 63.546000 Cu 0.852093 0.0830776 0.5 380 63.546 0.0428803 -3.2791 63.546000 Cu 0.975124 0.0580777 0.5 384 63.546 0.00741203 -3.2806 63.546000 Cu 0.962633 0.0854881 0.5 409 63.546 0.00552096 -3.28104 63.546000 Cu 0.0728074 0.0873241 0.5 414 63.546 0.0148731 -3.28063 63.546000 Cu 0.060159 0.11512 0.5 445 63.546 0.00720579 -3.28245 63.546000 Cu 0.121223 0.102494 1 447 63.546 0.0281415 -3.28292 63.546000 Cu 0.181933 0.0902677 0.5 449 63.546 0.0305962 -3.2813 63.546000 Cu 0.169402 0.118129 0.5 450 63.546 0.0101909 -3.28298 63.546000 Cu 0.011519 0.10021 1 408 63.546 0.00202167 -3.28181 63.546000 Cu 0.108581 0.130338 0 444 63.546 0.010188 -3.28357 63.546000 Cu 0.388714 0.125265 0.5 346 63.546 0.00626973 -3.28159 63.546000 Cu 0.23016 0.106319 0 448 63.546 0.00352959 -3.28102 63.546000 Cu 0.290963 0.0947521 0.5 454 63.546 0.0204377 -3.27978 63.546000 Cu 0.278734 0.122033 0.5 485 63.546 0.00639527 -3.28144 63.546000 Cu 0.339865 0.110174 1.2192e-17 487 63.546 0.0154605 -3.28081 63.546000 Cu 0.401178 0.0980317 0.5 345 63.546 0.0137501 -3.28031 63.546000 Cu 0.45008 0.112863 0 344 63.546 0.00281687 -3.28185 63.546000 Cu 0.572807 0.0873241 1 348 63.546 0.0148731 -3.28063 63.546000 Cu 0.511519 0.10021 0.5 350 63.546 0.00202167 -3.28181 63.546000 Cu 0.498831 0.127759 0.5 367 63.546 0.000844093 -3.2825 63.546000 Cu 0.560159 0.11512 1.24311e-17 369 63.546 0.00720579 -3.28245 63.546000 Cu 0.669402 0.118129 0 370 63.546 0.0101909 -3.28298 63.546000 Cu 0.621223 0.102494 0.5 371 63.546 0.0281415 -3.28292 63.546000 Cu 0.681933 0.0902677 0 373 63.546 0.0305962 -3.2813 63.546000 Cu 0.790963 0.0947521 9.53844e-17 374 63.546 0.0204377 -3.27978 63.546000 Cu 0.73016 0.106319 0.5 376 63.546 0.00352959 -3.28102 63.546000 Cu 0.778734 0.122033 1 403 63.546 0.00639527 -3.28144 63.546000 Cu 0.608581 0.130338 0.5 372 63.546 0.010188 -3.28357 63.546000 Cu 0.888714 0.125265 0 404 63.546 0.00626973 -3.28159 63.546000 Cu 0.839865 0.110174 0.5 405 63.546 0.0154605 -3.28081 63.546000 Cu 0.901178 0.0980317 1 407 63.546 0.0137501 -3.28031 63.546000 Cu 0.95008 0.112863 0.5 410 63.546 0.00281687 -3.28185 63.546000 Cu 0.998831 0.127759 0 443 63.546 0.000844093 -3.2825 63.546000 Cu 0.0474944 0.142786 0.5 446 63.546 0.00332556 -3.28315 63.546000 Cu 0.0348959 0.170394 0.5 477 63.546 0.00107669 -3.28333 63.546000 Cu 0.0959573 0.158041 1.00405e-16 479 63.546 0.00307152 -3.28356 63.546000 Cu 0.15694 0.145822 0.5 481 63.546 0.00347155 -3.28337 63.546000 Cu 0.144472 0.173422 0.5 482 63.546 0.00136176 -3.28331 63.546000 Cu 0.205405 0.161339 0 480 63.546 0.000516943 -3.2828 63.546000 Cu 0.217854 0.133851 0 483 63.546 0.00124416 -3.28229 63.546000 Cu 0.327527 0.137401 0 484 63.546 0.00557344 -3.28174 63.546000 Cu 0.266413 0.149373 0.5 486 63.546 0.00174963 -3.28218 63.546000 Cu 0.31508 0.164723 2.22325e-17 519 63.546 0.0024623 -3.28239 63.546000 Cu 0.376276 0.152568 0.5 520 63.546 0.00281555 -3.28224 63.546000 Cu 0.425033 0.167655 5.49835e-17 364 63.546 0.000631612 -3.28271 63.546000 Cu 0.437559 0.140252 5.09195e-17 365 63.546 0.00144925 -3.28227 63.546000 Cu 0.547494 0.142786 1.03034e-16 366 63.546 0.00332556 -3.28315 63.546000 Cu 0.486253 0.155261 0.5 368 63.546 0.000498264 -3.2828 63.546000 Cu 0.534896 0.170394 6.16771e-17 395 63.546 0.00107669 -3.28333 63.546000 Cu 0.595957 0.158041 0.5 397 63.546 0.00307152 -3.28356 63.546000 Cu 0.644472 0.173422 2.97628e-16 396 63.546 0.00136176 -3.28331 63.546000 Cu 0.65694 0.145822 1.50607e-16 399 63.546 0.00347155 -3.28337 63.546000 Cu 0.766413 0.149373 1 400 63.546 0.00174963 -3.28218 63.546000 Cu 0.717854 0.133851 0.5 401 63.546 0.00124416 -3.28229 63.546000 Cu 0.705405 0.161339 0.5 402 63.546 0.000516943 -3.2828 63.546000 Cu 0.81508 0.164723 0.5 437 63.546 0.0024623 -3.28239 63.546000 Cu 0.827527 0.137401 0.5 406 63.546 0.00557344 -3.28174 63.546000 Cu 0.876276 0.152568 0 439 63.546 0.00281555 -3.28224 63.546000 Cu 0.986253 0.155261 7.17176e-19 440 63.546 0.000498264 -3.2828 63.546000 Cu 0.937559 0.140252 0.5 441 63.546 0.00144925 -3.28227 63.546000 Cu 0.925033 0.167655 0.5 442 63.546 0.000631612 -3.28271 63.546000 Cu 0.0835535 0.185645 1.69732e-17 476 63.546 0.00116181 -3.28345 63.546000 Cu 0.0225528 0.197949 0.5 478 63.546 0.000440343 -3.28329 63.546000 Cu 0.0714408 0.213198 1.84075e-17 511 63.546 0.000441501 -3.28325 63.546000 Cu 0.18111 0.216323 0 512 63.546 0.000108593 -3.28303 63.546000 Cu 0.132267 0.200977 0.5 513 63.546 0.000520383 -3.28325 63.546000 Cu 0.193144 0.188836 3.53807e-17 515 63.546 0.000272156 -3.28304 63.546000 Cu 0.302868 0.192106 7.91284e-17 516 63.546 0.000959533 -3.28267 63.546000 Cu 0.254081 0.176775 0.5 517 63.546 0.000608313 -3.28262 63.546000 Cu 0.241985 0.204208 0.5 518 63.546 0.00012096 -3.28282 63.546000 Cu 0.363912 0.179934 0.5 521 63.546 0.00121875 -3.2827 63.546000 Cu 0.35179 0.207355 0.5 552 63.546 0.000657886 -3.28283 63.546000 Cu 0.412746 0.195101 0 391 63.546 0.00034615 -3.28292 63.546000 Cu 0.522553 0.197949 1.83597e-16 392 63.546 0.000440343 -3.28329 63.546000 Cu 0.473802 0.182766 0.5 393 63.546 0.000194644 -3.28305 63.546000 Cu 0.46165 0.210261 0.5 394 63.546 8.33826e-05 -3.28313 63.546000 Cu 0.583554 0.185645 0.5 398 63.546 0.00116181 -3.28345 63.546000 Cu 0.571441 0.213198 0.5 429 63.546 0.000441501 -3.28325 63.546000 Cu 0.632267 0.200977 1.05186e-16 431 63.546 0.000520383 -3.28325 63.546000 Cu 0.741985 0.204208 1.59213e-16 432 63.546 0.00012096 -3.28282 63.546000 Cu 0.693144 0.188836 0.5 433 63.546 0.000272156 -3.28304 63.546000 Cu 0.68111 0.216323 0.5 434 63.546 0.000108593 -3.28303 63.546000 Cu 0.754081 0.176775 6.31115e-17 435 63.546 0.000608313 -3.28262 63.546000 Cu 0.802868 0.192106 0.5 438 63.546 0.000959533 -3.28267 63.546000 Cu 0.863912 0.179934 5.35492e-17 436 63.546 0.00121875 -3.2827 63.546000 Cu 0.85179 0.207355 0 471 63.546 0.000657886 -3.28283 63.546000 Cu 0.96165 0.210261 0 472 63.546 8.33826e-05 -3.28313 63.546000 Cu 0.912746 0.195101 0.5 473 63.546 0.00034615 -3.28292 63.546000 Cu 0.973802 0.182766 0 475 63.546 0.000194644 -3.28305 63.546000 Cu 0.0593118 0.240715 0 508 63.546 0.000411057 -3.28321 63.546000 Cu 0.120209 0.22849 0.5 514 63.546 0.000316681 -3.28311 63.546000 Cu 0.108291 0.25599 0.5 545 63.546 0.000370603 -3.28313 63.546000 Cu 0.169103 0.243803 1 547 63.546 0.000175882 -3.28297 63.546000 Cu 0.0104612 0.225471 0.5 509 63.546 0.000172095 -3.28327 63.546000 Cu 0.218107 0.259119 0.5 550 63.546 9.96227e-05 -3.28282 63.546000 Cu 0.388696 0.250051 1 423 63.546 0.000250026 -3.28316 63.546000 Cu 0.278868 0.246977 1.20007e-16 548 63.546 0.000233862 -3.28281 63.546000 Cu 0.229935 0.231667 0.5 549 63.546 8.54088e-05 -3.28286 63.546000 Cu 0.290856 0.219528 1 551 63.546 0.000313821 -3.28281 63.546000 Cu 0.339715 0.234802 0.5 553 63.546 0.000378142 -3.28288 63.546000 Cu 0.400649 0.222566 1 390 63.546 0.000252161 -3.28303 63.546000 Cu 0.498517 0.253011 1 424 63.546 5.79933e-05 -3.28329 63.546000 Cu 0.449542 0.237778 0.5 425 63.546 0.000103966 -3.28326 63.546000 Cu 0.510461 0.225471 9.08423e-18 427 63.546 0.000172095 -3.28327 63.546000 Cu 0.559312 0.240715 0.5 430 63.546 0.000411057 -3.28321 63.546000 Cu 0.608291 0.25599 1 463 63.546 0.000370603 -3.28313 63.546000 Cu 0.620209 0.22849 1.46304e-16 428 63.546 0.000316681 -3.28311 63.546000 Cu 0.718107 0.259119 1 464 63.546 9.96227e-05 -3.28282 63.546000 Cu 0.669103 0.243803 0.5 465 63.546 0.000175882 -3.28297 63.546000 Cu 0.729935 0.231667 2.77308e-17 467 63.546 8.54088e-05 -3.28286 63.546000 Cu 0.790856 0.219528 0.5 469 63.546 0.000313821 -3.28281 63.546000 Cu 0.778868 0.246977 0.5 470 63.546 0.000233862 -3.28281 63.546000 Cu 0.839715 0.234802 7.41082e-18 468 63.546 0.000378142 -3.28288 63.546000 Cu 0.900649 0.222566 0.5 474 63.546 0.000252161 -3.28303 63.546000 Cu 0.888696 0.250051 0.5 505 63.546 0.000250026 -3.28316 63.546000 Cu 0.949542 0.237778 0 507 63.546 0.000103966 -3.28326 63.546000 Cu 0.998517 0.253011 0.5 510 63.546 5.79933e-05 -3.28329 63.546000 Cu 0.0359368 0.295768 1 540 63.546 0.00016013 -3.28321 63.546000 Cu 0.0475632 0.268244 1 543 63.546 0.000141445 -3.28321 63.546000 Cu 0.157412 0.271274 1 544 63.546 0.000200689 -3.28295 63.546000 Cu 0.096715 0.283483 0.5 546 63.546 0.000319888 -3.28309 63.546000 Cu 0.145813 0.298729 1 579 63.546 0.000446326 -3.28274 63.546000 Cu 0.206566 0.286565 0.5 581 63.546 0.000178509 -3.28278 63.546000 Cu 0.255655 0.301877 9.53844e-17 580 63.546 0.000169744 -3.28268 63.546000 Cu 0.267304 0.274432 1 583 63.546 5.3061e-05 -3.28283 63.546000 Cu 0.377107 0.277573 1 584 63.546 0.000379401 -3.28323 63.546000 Cu 0.327933 0.262274 0.5 585 63.546 0.000270092 -3.28297 63.546000 Cu 0.316403 0.289764 0.5 586 63.546 0.000248221 -3.28296 63.546000 Cu 0.437726 0.265308 0.5 426 63.546 0.000197935 -3.2833 63.546000 Cu 0.426164 0.292867 0.5 457 63.546 0.000599615 -3.28339 63.546000 Cu 0.486869 0.280546 1 459 63.546 4.50238e-05 -3.28332 63.546000 Cu 0.596715 0.283483 8.91689e-17 460 63.546 0.000319888 -3.28309 63.546000 Cu 0.547563 0.268244 0.5 461 63.546 0.000141445 -3.28321 63.546000 Cu 0.535937 0.295768 0.5 462 63.546 0.00016013 -3.28321 63.546000 Cu 0.657412 0.271274 0.5 466 63.546 0.000200689 -3.28295 63.546000 Cu 0.645813 0.298729 0.5 497 63.546 0.000446326 -3.28274 63.546000 Cu 0.706566 0.286565 1 499 63.546 0.000178509 -3.28278 63.546000 Cu 0.767304 0.274432 0.5 501 63.546 5.3061e-05 -3.28283 63.546000 Cu 0.755655 0.301877 0.5 502 63.546 0.000169744 -3.28268 63.546000 Cu 0.816403 0.289764 1.02795e-17 500 63.546 0.000248221 -3.28296 63.546000 Cu 0.827933 0.262274 0 503 63.546 0.000270092 -3.28297 63.546000 Cu 0.937726 0.265308 1 504 63.546 0.000197935 -3.2833 63.546000 Cu 0.877107 0.277573 0.5 506 63.546 0.000379401 -3.28323 63.546000 Cu 0.926164 0.292867 1 539 63.546 0.000599615 -3.28339 63.546000 Cu 0.986869 0.280546 0.5 541 63.546 4.50238e-05 -3.28332 63.546000 Cu 0.0240169 0.32328 8.65393e-17 575 63.546 0.000196901 -3.28313 63.546000 Cu 0.133946 0.326143 1 576 63.546 0.00104722 -3.28257 63.546000 Cu 0.0849495 0.310955 0.5 577 63.546 0.000476603 -3.28293 63.546000 Cu 0.0730658 0.338406 0.5 578 63.546 0.00085185 -3.28282 63.546000 Cu 0.19482 0.313986 0.5 582 63.546 0.000590053 -3.28255 63.546000 Cu 0.183042 0.341366 0.5 611 63.546 0.00199835 -3.2823 63.546000 Cu 0.243848 0.329307 1 613 63.546 0.00055779 -3.28255 63.546000 Cu 0.353548 0.33266 1 614 63.546 0.00140678 -3.28326 63.546000 Cu 0.30462 0.317247 0.5 615 63.546 0.000195763 -3.28284 63.546000 Cu 0.292833 0.344736 0.5 616 63.546 0.000433239 -3.28272 63.546000 Cu 0.365373 0.305109 1.6256e-17 617 63.546 0.000685487 -3.28322 63.546000 Cu 0.414275 0.320438 0.5 458 63.546 0.00142729 -3.28339 63.546000 Cu 0.475096 0.308105 5.16367e-17 456 63.546 0.000274979 -3.28331 63.546000 Cu 0.463193 0.335678 0 491 63.546 0.00102125 -3.28335 63.546000 Cu 0.573066 0.338406 5.23539e-17 492 63.546 0.00085185 -3.28282 63.546000 Cu 0.524017 0.32328 0.5 493 63.546 0.000196901 -3.28313 63.546000 Cu 0.58495 0.310955 1 495 63.546 0.000476603 -3.28293 63.546000 Cu 0.69482 0.313986 3.99228e-17 496 63.546 0.000590053 -3.28255 63.546000 Cu 0.633946 0.326143 0.5 498 63.546 0.00104722 -3.28257 63.546000 Cu 0.683042 0.341366 0 531 63.546 0.00199835 -3.2823 63.546000 Cu 0.792833 0.344736 1 532 63.546 0.000433239 -3.28272 63.546000 Cu 0.743848 0.329307 0.5 533 63.546 0.00055779 -3.28255 63.546000 Cu 0.80462 0.317247 6.69364e-18 535 63.546 0.000195763 -3.28284 63.546000 Cu 0.914275 0.320438 0 536 63.546 0.00142729 -3.28339 63.546000 Cu 0.865373 0.305109 0.5 537 63.546 0.000685487 -3.28322 63.546000 Cu 0.853548 0.33266 0.5 538 63.546 0.00140678 -3.28326 63.546000 Cu 0.975096 0.308105 0.5 542 63.546 0.000274979 -3.28331 63.546000 Cu 0.963193 0.335678 0.5 573 63.546 0.00102125 -3.28335 63.546000 Cu 0.11057 0.380844 1.29092e-17 606 63.546 0.006027 -3.28176 63.546000 Cu 0.0613494 0.365835 0.5 607 63.546 0.00161826 -3.28255 63.546000 Cu 0.122255 0.353523 6.5263e-17 609 63.546 0.00254756 -3.28232 63.546000 Cu 0.171474 0.368707 0.5 612 63.546 0.00509581 -3.28182 63.546000 Cu 0.0122198 0.350807 1.24311e-17 572 63.546 0.000361179 -3.28308 63.546000 Cu 0.000408669 0.37834 1.12597e-16 605 63.546 0.000919464 -3.28272 63.546000 Cu 0.220665 0.384082 0 635 63.546 0.00561386 -3.28132 63.546000 Cu 0.390684 0.375754 0.5 490 63.546 0.0100129 -3.28363 63.546000 Cu 0.232226 0.35672 1.24311e-17 610 63.546 0.00172008 -3.28211 63.546000 Cu 0.330146 0.387955 1 636 63.546 0.00923122 -3.28285 63.546000 Cu 0.281319 0.372251 0.5 637 63.546 0.001174 -3.28212 63.546000 Cu 0.341842 0.360266 1 639 63.546 0.00346568 -3.2832 63.546000 Cu 0.402441 0.348045 0.5 489 63.546 0.00345634 -3.28364 63.546000 Cu 0.45138 0.36329 1 488 63.546 0.00284937 -3.28337 63.546000 Cu 0.51222 0.350807 0.5 494 63.546 0.000361179 -3.28308 63.546000 Cu 0.43954 0.390976 1.16183e-16 523 63.546 0.00713055 -3.28278 63.546000 Cu 0.500409 0.37834 0.5 525 63.546 0.000919464 -3.28272 63.546000 Cu 0.561349 0.365835 1 527 63.546 0.00161826 -3.28255 63.546000 Cu 0.61057 0.380844 0.5 530 63.546 0.006027 -3.28176 63.546000 Cu 0.671474 0.368707 1 528 63.546 0.00509581 -3.28182 63.546000 Cu 0.622255 0.353523 0.5 529 63.546 0.00254756 -3.28232 63.546000 Cu 0.732226 0.35672 0.5 534 63.546 0.00172008 -3.28211 63.546000 Cu 0.720665 0.384082 0.5 565 63.546 0.00561386 -3.28132 63.546000 Cu 0.781319 0.372251 1 567 63.546 0.001174 -3.28212 63.546000 Cu 0.902441 0.348045 5.54616e-17 571 63.546 0.00345634 -3.28364 63.546000 Cu 0.890684 0.375754 0 568 63.546 0.0100129 -3.28363 63.546000 Cu 0.841842 0.360266 0.5 569 63.546 0.00346568 -3.2832 63.546000 Cu 0.830146 0.387955 0.5 570 63.546 0.00923122 -3.28285 63.546000 Cu 0.95138 0.36329 0.5 574 63.546 0.00284937 -3.28337 63.546000 Cu 0.93954 0.390976 0.5 603 63.546 0.00713055 -3.28278 63.546000 Cu 0.049585 0.393233 0.5 608 63.546 0.00319922 -3.28208 63.546000 Cu 0.0375469 0.420619 0.5 629 63.546 0.00514259 -3.28128 63.546000 Cu 0.0987989 0.408086 0 631 63.546 0.0133351 -3.28048 63.546000 Cu 0.159869 0.395953 0.5 633 63.546 0.0139049 -3.28069 63.546000 Cu 0.148048 0.423045 0.5 634 63.546 0.041582 -3.27894 63.546000 Cu 0.209044 0.411367 1.06142e-16 632 63.546 0.0191256 -3.27958 63.546000 Cu 0.366358 0.431632 0.5 326 63.546 0.0665668 -3.28051 63.546000 Cu 0.378754 0.403586 0.5 330 63.546 0.0269606 -3.28316 63.546000 Cu 0.269696 0.399778 0.5 638 63.546 0.00367111 -3.28086 63.546000 Cu 0.257908 0.427378 0.5 650 63.546 0.0120731 -3.27666 63.546000 Cu 0.318179 0.41581 0 652 63.546 0.0290793 -3.28139 63.546000 Cu 0.427326 0.418749 0 522 63.546 0.0139555 -3.2809 63.546000 Cu 0.549585 0.393233 1 524 63.546 0.00319922 -3.28208 63.546000 Cu 0.488498 0.405888 0.5 526 63.546 0.00174818 -3.28203 63.546000 Cu 0.476095 0.433496 0.5 557 63.546 0.00349004 -3.28029 63.546000 Cu 0.537547 0.420619 1.17139e-17 559 63.546 0.00514259 -3.28128 63.546000 Cu 0.598799 0.408086 0.5 561 63.546 0.0133351 -3.28048 63.546000 Cu 0.648048 0.423045 0 560 63.546 0.041582 -3.27894 63.546000 Cu 0.659869 0.395953 1 563 63.546 0.0139049 -3.28069 63.546000 Cu 0.769696 0.399778 1 564 63.546 0.00367111 -3.28086 63.546000 Cu 0.709044 0.411367 0.5 566 63.546 0.0191256 -3.27958 63.546000 Cu 0.757908 0.427378 1 597 63.546 0.0120731 -3.27666 63.546000 Cu 0.818179 0.41581 0.5 599 63.546 0.0290793 -3.28139 63.546000 Cu 0.866358 0.431632 0 598 63.546 0.0665668 -3.28051 63.546000 Cu 0.878754 0.403586 1 601 63.546 0.0269606 -3.28316 63.546000 Cu 0.988498 0.405888 1 602 63.546 0.00174818 -3.28203 63.546000 Cu 0.927326 0.418749 0.5 604 63.546 0.0139555 -3.2809 63.546000 Cu 0.976095 0.433496 0 627 63.546 0.00349004 -3.28029 63.546000 Cu 0.0866567 0.435239 1 628 63.546 0.026558 -3.278 63.546000 Cu 0.0251018 0.448026 0.5 630 63.546 0.00707975 -3.28085 63.546000 Cu 0.0744112 0.462382 1 644 63.546 0.0362607 -3.27646 63.546000 Cu 0.186057 0.465283 0 645 63.546 0.382128 -3.25164 63.546000 Cu 0.136019 0.449911 0.5 646 63.546 0.130662 -3.27662 63.546000 Cu 0.19743 0.438511 0 648 63.546 0.0749191 -3.27453 63.546000 Cu 0.011925 0.475477 0.5 643 63.546 0.0233066 -3.27652 63.546000 Cu 0.123112 0.476507 0.5 647 63.546 0.364714 -3.27262 63.546000 Cu 0.35358 0.460003 0.5 4 63.546 0.145615 -3.27171 63.546000 Cu 0.292521 0.472713 4.35087e-17 33 63.546 0.387637 -3.24855 63.546000 Cu 0.305816 0.443986 1 649 63.546 0.0994615 -3.27685 63.546000 Cu 0.246121 0.455193 0.5 651 63.546 0.0472436 -3.26056 63.546000 Cu 0.401542 0.474841 8.89298e-17 554 63.546 0.0337657 -3.27206 63.546000 Cu 0.414796 0.446698 1.84553e-16 555 63.546 0.0231398 -3.27693 63.546000 Cu 0.525102 0.448026 0 556 63.546 0.00707975 -3.28085 63.546000 Cu 0.46327 0.46124 0.5 558 63.546 0.00565553 -3.27786 63.546000 Cu 0.586657 0.435239 0.5 562 63.546 0.026558 -3.278 63.546000 Cu 0.511925 0.475477 1 589 63.546 0.0233066 -3.27652 63.546000 Cu 0.574411 0.462382 0.5 591 63.546 0.0362607 -3.27646 63.546000 Cu 0.636019 0.449911 1 593 63.546 0.130662 -3.27662 63.546000 Cu 0.746121 0.455193 1 594 63.546 0.0472436 -3.26056 63.546000 Cu 0.69743 0.438511 0.5 595 63.546 0.0749191 -3.27453 63.546000 Cu 0.686057 0.465283 0.5 596 63.546 0.382128 -3.25164 63.546000 Cu 0.792521 0.472713 0.5 621 63.546 0.387637 -3.24855 63.546000 Cu 0.623112 0.476507 1 590 63.546 0.364714 -3.27262 63.546000 Cu 0.805816 0.443986 0.5 600 63.546 0.0994615 -3.27685 63.546000 Cu 0.85358 0.460003 0 623 63.546 0.145615 -3.27171 63.546000 Cu 0.96327 0.46124 1 624 63.546 0.00565553 -3.27786 63.546000 Cu 0.914796 0.446698 0.5 625 63.546 0.0231398 -3.27693 63.546000 Cu 0.901542 0.474841 0.5 626 63.546 0.0337657 -3.27206 63.546000 Cu 0.0614259 0.516632 0 13 63.546 0.139571 -3.27909 63.546000 Cu 0.114523 0.503037 0.5 14 63.546 3.61281 -3.19916 63.546000 Cu 0.00360643 0.503026 0.5 15 63.546 0.200574 -3.28901 63.546000 Cu 0.172122 0.515309 4.0879e-17 16 63.546 7.18836 -2.9945 63.546000 Cu 0.172248 0.490752 8.58221e-17 323 63.546 7.1962 -2.99611 63.546000 Cu 0.0615426 0.489438 1 642 63.546 0.133733 -3.27898 63.546000 Cu 0.339879 0.488739 0.5 3 63.546 0.401127 -3.25111 63.546000 Cu 0.339797 0.517276 0.5 7 63.546 0.402725 -3.25136 63.546000 Cu 0.233607 0.483424 0.5 34 63.546 5.786 -3.09936 63.546000 Cu 0.276436 0.503008 1 308 63.546 4.6384 -3.23587 63.546000 Cu 0.391441 0.503017 1 587 63.546 0.347288 -3.26571 63.546000 Cu 0.503606 0.503026 1 1 63.546 0.200574 -3.28901 63.546000 Cu 0.561426 0.516632 0.5 2 63.546 0.139571 -3.27909 63.546000 Cu 0.450417 0.516922 0.5 6 63.546 0.116956 -3.27624 63.546000 Cu 0.450472 0.489119 0.5 588 63.546 0.117707 -3.27616 63.546000 Cu 0.561543 0.489438 0.5 592 63.546 0.133733 -3.27898 63.546000 Cu 0.614523 0.503037 1 58 63.546 3.61281 -3.19916 63.546000 Cu 0.672122 0.515309 0.5 60 63.546 7.18836 -2.9945 63.546000 Cu 0.672248 0.490752 0.5 618 63.546 7.1962 -2.99611 63.546000 Cu 0.733607 0.483424 2.39059e-19 619 63.546 5.786 -3.09936 63.546000 Cu 0.776436 0.503008 0.5 622 63.546 4.6384 -3.23587 63.546000 Cu 0.839797 0.517276 1 32 63.546 0.402725 -3.25136 63.546000 Cu 0.950417 0.516922 6.16771e-17 35 63.546 0.116956 -3.27624 63.546000 Cu 0.839879 0.488739 1 620 63.546 0.401127 -3.25111 63.546000 Cu 0.891441 0.503017 0.5 640 63.546 0.347288 -3.26571 63.546000 Cu 0.950472 0.489119 1 641 63.546 0.117707 -3.27616 63.546000 Cu 0.12299 0.529564 0.5 19 63.546 0.375728 -3.27269 63.546000 Cu 0.0117886 0.530584 0.5 37 63.546 0.0245618 -3.27639 63.546000 Cu 0.0742925 0.543692 1.30765e-16 39 63.546 0.0382557 -3.27635 63.546000 Cu 0.135899 0.556162 0.5 41 63.546 0.137263 -3.27679 63.546000 Cu 0.0249785 0.558032 0.5 42 63.546 0.00709475 -3.28069 63.546000 Cu 0.185942 0.540758 1.79533e-16 17 63.546 0.385846 -3.25064 63.546000 Cu 0.233452 0.522574 0.5 18 63.546 5.74802 -3.0987 63.546000 Cu 0.292334 0.533286 1 20 63.546 0.396832 -3.24915 63.546000 Cu 0.305679 0.562008 1 21 63.546 0.107018 -3.27676 63.546000 Cu 0.353421 0.546011 0.5 22 63.546 0.147137 -3.27143 63.546000 Cu 0.245975 0.550813 0.5 23 63.546 0.0474966 -3.25982 63.546000 Cu 0.401408 0.53119 1.45826e-17 5 63.546 0.0340672 -3.27205 63.546000 Cu 0.511789 0.530584 0 8 63.546 0.0245618 -3.27639 63.546000 Cu 0.524979 0.558032 1.92442e-16 9 63.546 0.00709475 -3.28069 63.546000 Cu 0.574293 0.543692 0.5 10 63.546 0.0382557 -3.27635 63.546000 Cu 0.463089 0.544807 0.5 11 63.546 0.00610131 -3.27785 63.546000 Cu 0.414651 0.559348 8.9408e-17 24 63.546 0.0217874 -3.27668 63.546000 Cu 0.62299 0.529564 9.87312e-17 59 63.546 0.375728 -3.27269 63.546000 Cu 0.733452 0.522574 1 61 63.546 5.74802 -3.0987 63.546000 Cu 0.745975 0.550813 9.70578e-17 62 63.546 0.0474966 -3.25982 63.546000 Cu 0.685942 0.540758 0.5 64 63.546 0.385846 -3.25064 63.546000 Cu 0.635899 0.556162 7.57816e-17 92 63.546 0.137263 -3.27679 63.546000 Cu 0.792334 0.533286 0.5 63 63.546 0.396832 -3.24915 63.546000 Cu 0.963089 0.544807 6.00037e-17 36 63.546 0.00610131 -3.27785 63.546000 Cu 0.901408 0.53119 0.5 38 63.546 0.0340672 -3.27205 63.546000 Cu 0.853421 0.546011 1 65 63.546 0.147137 -3.27143 63.546000 Cu 0.914651 0.559348 0.5 67 63.546 0.0217874 -3.27668 63.546000 Cu 0.805679 0.562008 0.5 68 63.546 0.107018 -3.27676 63.546000 Cu 0.0865759 0.570827 1.31243e-16 40 63.546 0.0273584 -3.27782 63.546000 Cu 0.148056 0.583028 0.5 46 63.546 0.0451853 -3.27905 63.546000 Cu 0.0375485 0.585434 0.5 71 63.546 0.00477806 -3.28112 63.546000 Cu 0.0989487 0.597979 4.78117e-19 73 63.546 0.0142246 -3.28036 63.546000 Cu 0.197336 0.56754 1 43 63.546 0.0775655 -3.27446 63.546000 Cu 0.366268 0.574386 0.5 27 63.546 0.0690507 -3.28025 63.546000 Cu 0.209177 0.594674 0 44 63.546 0.0193211 -3.27956 63.546000 Cu 0.257875 0.578643 0.5 45 63.546 0.0125887 -3.27659 63.546000 Cu 0.318236 0.5902 1 47 63.546 0.0318666 -3.28138 63.546000 Cu 0.378904 0.602447 0.5 49 63.546 0.0269405 -3.283 63.546000 Cu 0.269941 0.606237 0.5 50 63.546 0.00359556 -3.28093 63.546000 Cu 0.427342 0.587303 3.77713e-17 25 63.546 0.013086 -3.28066 63.546000 Cu 0.475992 0.572557 0.5 26 63.546 0.00363521 -3.28021 63.546000 Cu 0.537548 0.585434 5.06804e-17 28 63.546 0.00477806 -3.28112 63.546000 Cu 0.488671 0.600162 0.5 31 63.546 0.00158862 -3.2819 63.546000 Cu 0.586576 0.570827 0.5 12 63.546 0.0273584 -3.27782 63.546000 Cu 0.598949 0.597979 0.5 30 63.546 0.0142246 -3.28036 63.546000 Cu 0.648056 0.583028 6.45459e-18 93 63.546 0.0451853 -3.27905 63.546000 Cu 0.697336 0.56754 0.5 94 63.546 0.0775655 -3.27446 63.546000 Cu 0.757875 0.578643 2.07981e-16 95 63.546 0.0125887 -3.27659 63.546000 Cu 0.769941 0.606237 5.73741e-18 96 63.546 0.00359556 -3.28093 63.546000 Cu 0.709177 0.594674 0.5 98 63.546 0.0193211 -3.27956 63.546000 Cu 0.988671 0.600162 0 70 63.546 0.00158862 -3.2819 63.546000 Cu 0.866268 0.574386 0 66 63.546 0.0690507 -3.28025 63.546000 Cu 0.975992 0.572557 0 69 63.546 0.00363521 -3.28021 63.546000 Cu 0.927342 0.587303 0.5 72 63.546 0.013086 -3.28066 63.546000 Cu 0.818236 0.5902 0.5 97 63.546 0.0318666 -3.28138 63.546000 Cu 0.878904 0.602447 1.28614e-16 99 63.546 0.0269405 -3.283 63.546000 Cu 0.111196 0.625207 7.60207e-17 74 63.546 0.00640803 -3.28162 63.546000 Cu 0.160217 0.610109 0.5 75 63.546 0.0155669 -3.28071 63.546000 Cu 0.0499961 0.612818 0.5 76 63.546 0.003173 -3.28185 63.546000 Cu 0.172412 0.637342 0.5 80 63.546 0.00608842 -3.28188 63.546000 Cu 0.00108313 0.627702 0 103 63.546 0.00100304 -3.28247 63.546000 Cu 0.0623259 0.640197 0.5 105 63.546 0.0014113 -3.28233 63.546000 Cu 0.330601 0.618059 5.57007e-17 48 63.546 0.0102286 -3.28309 63.546000 Cu 0.221205 0.621953 1.58735e-16 77 63.546 0.00575159 -3.2814 63.546000 Cu 0.233444 0.649312 1.02317e-16 78 63.546 0.00201119 -3.28222 63.546000 Cu 0.282112 0.633757 0.5 79 63.546 0.0012063 -3.28234 63.546000 Cu 0.342912 0.64575 0 81 63.546 0.00380217 -3.28333 63.546000 Cu 0.391411 0.630275 0.5 54 63.546 0.00972131 -3.28359 63.546000 Cu 0.549996 0.612818 5.47444e-17 29 63.546 0.003173 -3.28185 63.546000 Cu 0.439958 0.615067 0 51 63.546 0.006793 -3.28256 63.546000 Cu 0.452392 0.642742 1 52 63.546 0.00276791 -3.28314 63.546000 Cu 0.501083 0.627702 0.5 53 63.546 0.00100304 -3.28247 63.546000 Cu 0.562326 0.640197 2.12762e-17 55 63.546 0.0014113 -3.28233 63.546000 Cu 0.660217 0.610109 6.07209e-17 124 63.546 0.0155669 -3.28071 63.546000 Cu 0.672412 0.637342 1.29809e-16 125 63.546 0.00608842 -3.28188 63.546000 Cu 0.721205 0.621953 0.5 126 63.546 0.00575159 -3.2814 63.546000 Cu 0.611196 0.625207 0.5 127 63.546 0.00640803 -3.28162 63.546000 Cu 0.733444 0.649312 0.5 131 63.546 0.00201119 -3.28222 63.546000 Cu 0.782112 0.633757 0 128 63.546 0.0012063 -3.28234 63.546000 Cu 0.891411 0.630275 5.3071e-17 100 63.546 0.00972131 -3.28359 63.546000 Cu 0.939958 0.615067 0.5 101 63.546 0.006793 -3.28256 63.546000 Cu 0.830601 0.618059 0.5 102 63.546 0.0102286 -3.28309 63.546000 Cu 0.952392 0.642742 0.5 106 63.546 0.00276791 -3.28314 63.546000 Cu 0.842912 0.64575 0.5 130 63.546 0.00380217 -3.28333 63.546000 Cu 0.0135316 0.655213 1 104 63.546 0.000413887 -3.28292 63.546000 Cu 0.123529 0.652518 1 107 63.546 0.00297103 -3.2823 63.546000 Cu 0.135621 0.679898 1 108 63.546 0.00138851 -3.28264 63.546000 Cu 0.0746306 0.667614 0.5 110 63.546 0.000770963 -3.28277 63.546000 Cu 0.0256747 0.68273 1.07576e-17 136 63.546 0.00018257 -3.28315 63.546000 Cu 0.0865626 0.695067 0.5 138 63.546 0.000394885 -3.28298 63.546000 Cu 0.18457 0.664672 0.5 109 63.546 0.00234534 -3.28234 63.546000 Cu 0.196477 0.692067 0.5 114 63.546 0.000889119 -3.28264 63.546000 Cu 0.35507 0.673355 2.89261e-17 82 63.546 0.00166063 -3.28329 63.546000 Cu 0.294284 0.66128 0.5 84 63.546 0.000484822 -3.28276 63.546000 Cu 0.24547 0.67673 1 111 63.546 0.000735157 -3.28259 63.546000 Cu 0.306223 0.688795 0.5 113 63.546 0.000220058 -3.2829 63.546000 Cu 0.574631 0.667614 1 56 63.546 0.000770963 -3.28277 63.546000 Cu 0.513532 0.655213 0.5 57 63.546 0.000413887 -3.28292 63.546000 Cu 0.403769 0.657982 0.5 83 63.546 0.00319915 -3.28351 63.546000 Cu 0.464713 0.670336 0 85 63.546 0.00119922 -3.28331 63.546000 Cu 0.525675 0.68273 0.5 87 63.546 0.00018257 -3.28315 63.546000 Cu 0.415861 0.685582 0.5 88 63.546 0.00148355 -3.28344 63.546000 Cu 0.586563 0.695067 1 89 63.546 0.000394885 -3.28298 63.546000 Cu 0.623529 0.652518 0.5 157 63.546 0.00297103 -3.2823 63.546000 Cu 0.68457 0.664672 1.2957e-16 158 63.546 0.00234534 -3.28234 63.546000 Cu 0.696477 0.692067 0 159 63.546 0.000889119 -3.28264 63.546000 Cu 0.74547 0.67673 0.5 160 63.546 0.000735157 -3.28259 63.546000 Cu 0.635621 0.679898 0.5 161 63.546 0.00138851 -3.28264 63.546000 Cu 0.794284 0.66128 9.65797e-17 129 63.546 0.000484822 -3.28276 63.546000 Cu 0.903769 0.657982 3.05995e-17 132 63.546 0.00319915 -3.28351 63.546000 Cu 0.915861 0.685582 1.88139e-16 133 63.546 0.00148355 -3.28344 63.546000 Cu 0.964713 0.670336 0.5 134 63.546 0.00119922 -3.28331 63.546000 Cu 0.85507 0.673355 0.5 135 63.546 0.00166063 -3.28329 63.546000 Cu 0.806223 0.688795 9.13204e-17 162 63.546 0.000220058 -3.2829 63.546000 Cu 0.0374811 0.710238 0 137 63.546 7.57964e-05 -3.28317 63.546000 Cu 0.147386 0.707331 8.19971e-17 140 63.546 0.000681997 -3.28286 63.546000 Cu 0.158982 0.734795 0 141 63.546 0.00034883 -3.28291 63.546000 Cu 0.0982634 0.722548 0.5 143 63.546 0.00025013 -3.28307 63.546000 Cu 0.0491386 0.73777 1.77382e-16 170 63.546 6.40738e-05 -3.28319 63.546000 Cu 0.257215 0.704181 1 112 63.546 0.000167509 -3.28275 63.546000 Cu 0.366914 0.700927 1.96984e-16 115 63.546 0.000630509 -3.28327 63.546000 Cu 0.378649 0.728467 2.36668e-17 116 63.546 0.000339501 -3.28315 63.546000 Cu 0.317954 0.716298 0.5 118 63.546 0.000147819 -3.283 63.546000 Cu 0.208134 0.719516 0.5 142 63.546 0.000423998 -3.28279 63.546000 Cu 0.268843 0.731651 5.25929e-18 144 63.546 5.26737e-05 -3.28283 63.546000 Cu 0.476649 0.697893 2.67746e-17 86 63.546 0.000605665 -3.28329 63.546000 Cu 0.537481 0.710238 0.5 91 63.546 7.57964e-05 -3.28317 63.546000 Cu 0.427713 0.713155 0.5 117 63.546 0.000615832 -3.28332 63.546000 Cu 0.488426 0.725447 1 119 63.546 0.000200129 -3.28319 63.546000 Cu 0.549139 0.73777 0.5 121 63.546 6.40738e-05 -3.28319 63.546000 Cu 0.598263 0.722548 1 90 63.546 0.00025013 -3.28307 63.546000 Cu 0.757215 0.704181 0.5 165 63.546 0.000167509 -3.28275 63.546000 Cu 0.647386 0.707331 0.5 190 63.546 0.000681997 -3.28286 63.546000 Cu 0.708134 0.719516 1.17139e-17 191 63.546 0.000423998 -3.28279 63.546000 Cu 0.768843 0.731651 0.5 193 63.546 5.26737e-05 -3.28283 63.546000 Cu 0.658982 0.734795 0.5 194 63.546 0.00034883 -3.28291 63.546000 Cu 0.988426 0.725447 0.5 168 63.546 0.000200129 -3.28319 63.546000 Cu 0.976649 0.697893 0.5 139 63.546 0.000605665 -3.28329 63.546000 Cu 0.817954 0.716298 1 163 63.546 0.000147819 -3.283 63.546000 Cu 0.866914 0.700927 0.5 164 63.546 0.000630509 -3.28327 63.546000 Cu 0.927713 0.713155 4.4943e-17 166 63.546 0.000615832 -3.28332 63.546000 Cu 0.878649 0.728467 0.5 169 63.546 0.000339501 -3.28315 63.546000 Cu 0.060602 0.765306 0 171 63.546 0.000160693 -3.28328 63.546000 Cu 0.109818 0.750059 0.5 172 63.546 0.000299961 -3.28311 63.546000 Cu 1.28416e-05 0.752991 0.5 173 63.546 7.17061e-05 -3.28325 63.546000 Cu 0.170432 0.762282 0 174 63.546 0.000308345 -3.28298 63.546000 Cu 0.121307 0.777581 0.5 177 63.546 0.000518818 -3.28318 63.546000 Cu 0.0114882 0.780547 0.5 201 63.546 0.000148579 -3.28331 63.546000 Cu 0.280317 0.759115 0 145 63.546 2.44854e-05 -3.28282 63.546000 Cu 0.329522 0.743792 0.5 146 63.546 0.000125289 -3.28297 63.546000 Cu 0.219662 0.746972 0.5 147 63.546 0.000105649 -3.28282 63.546000 Cu 0.340974 0.771277 0.5 151 63.546 0.000182536 -3.28288 63.546000 Cu 0.231133 0.774432 0.5 176 63.546 3.30286e-05 -3.28277 63.546000 Cu 0.390152 0.755985 1.32678e-16 148 63.546 0.000212888 -3.28313 63.546000 Cu 0.500013 0.752991 0 120 63.546 7.17061e-05 -3.28325 63.546000 Cu 0.439335 0.740697 0.5 122 63.546 0.000369209 -3.28324 63.546000 Cu 0.560602 0.765306 0.5 123 63.546 0.000160693 -3.28328 63.546000 Cu 0.450802 0.76823 0.5 150 63.546 0.000268314 -3.28325 63.546000 Cu 0.511488 0.780547 4.68555e-17 152 63.546 0.000148579 -3.28331 63.546000 Cu 0.719662 0.746972 1 192 63.546 0.000105649 -3.28282 63.546000 Cu 0.609818 0.750059 1 222 63.546 0.000299961 -3.28311 63.546000 Cu 0.621307 0.777581 0 223 63.546 0.000518818 -3.28318 63.546000 Cu 0.670432 0.762282 0.5 224 63.546 0.000308345 -3.28298 63.546000 Cu 0.731133 0.774432 1 225 63.546 3.30286e-05 -3.28277 63.546000 Cu 0.780317 0.759115 0.5 198 63.546 2.44854e-05 -3.28282 63.546000 Cu 0.939335 0.740697 1 167 63.546 0.000369209 -3.28324 63.546000 Cu 0.829522 0.743792 1.19051e-16 195 63.546 0.000125289 -3.28297 63.546000 Cu 0.840974 0.771277 1 196 63.546 0.000182536 -3.28288 63.546000 Cu 0.890152 0.755985 0.5 197 63.546 0.000212888 -3.28313 63.546000 Cu 0.950802 0.76823 3.49026e-17 199 63.546 0.000268314 -3.28325 63.546000 Cu 0.0722603 0.792849 7.86503e-17 203 63.546 0.000430728 -3.28331 63.546000 Cu 0.0843107 0.820425 0 204 63.546 0.00115763 -3.28343 63.546000 Cu 0.133048 0.80511 0.5 205 63.546 0.000945484 -3.28321 63.546000 Cu 0.0233982 0.808099 0.5 206 63.546 0.000283005 -3.28334 63.546000 Cu 0.182013 0.789758 0 175 63.546 0.000242812 -3.28298 63.546000 Cu 0.193917 0.81725 1 207 63.546 0.00026994 -3.28291 63.546000 Cu 0.291827 0.786565 1.3196e-16 178 63.546 0.000244956 -3.28274 63.546000 Cu 0.303669 0.813991 8.91689e-17 179 63.546 0.000645575 -3.2826 63.546000 Cu 0.35266 0.798726 0.5 180 63.546 0.000520389 -3.28281 63.546000 Cu 0.242805 0.801884 0.5 181 63.546 0.000189989 -3.28281 63.546000 Cu 0.401703 0.783485 1.1427e-16 149 63.546 0.00034232 -3.28301 63.546000 Cu 0.523398 0.808099 0 153 63.546 0.000283005 -3.28334 63.546000 Cu 0.57226 0.792849 0.5 154 63.546 0.000430728 -3.28331 63.546000 Cu 0.462493 0.795765 0.5 155 63.546 0.000174415 -3.28319 63.546000 Cu 0.413564 0.810962 6.5024e-17 182 63.546 0.000451608 -3.28292 63.546000 Cu 0.474557 0.823287 0.5 184 63.546 0.000183799 -3.28316 63.546000 Cu 0.584311 0.820425 0.5 156 63.546 0.00115763 -3.28343 63.546000 Cu 0.742805 0.801884 6.57411e-17 226 63.546 0.000189989 -3.28281 63.546000 Cu 0.682013 0.789758 0.5 228 63.546 0.000242812 -3.28298 63.546000 Cu 0.633048 0.80511 1.93638e-17 256 63.546 0.000945484 -3.28321 63.546000 Cu 0.693917 0.81725 0.5 258 63.546 0.00026994 -3.28291 63.546000 Cu 0.791827 0.786565 0.5 227 63.546 0.000244956 -3.28274 63.546000 Cu 0.962493 0.795765 1 200 63.546 0.000174415 -3.28319 63.546000 Cu 0.901703 0.783485 0.5 202 63.546 0.00034232 -3.28301 63.546000 Cu 0.85266 0.798726 0 229 63.546 0.000520389 -3.28281 63.546000 Cu 0.913564 0.810962 0.5 231 63.546 0.000451608 -3.28292 63.546000 Cu 0.803669 0.813991 0.5 232 63.546 0.000645575 -3.2826 63.546000 Cu 0.974557 0.823287 0 233 63.546 0.000183799 -3.28316 63.546000 Cu 0.145227 0.832654 0.5 210 63.546 0.00130944 -3.28323 63.546000 Cu 0.0356203 0.835674 0.5 235 63.546 0.00110736 -3.28341 63.546000 Cu 0.0965877 0.848045 1 237 63.546 0.00365997 -3.28356 63.546000 Cu 0.157439 0.86026 0.5 239 63.546 0.00344709 -3.28326 63.546000 Cu 0.0479512 0.863293 0.5 240 63.546 0.00328483 -3.28318 63.546000 Cu 0.364678 0.826136 0.5 185 63.546 0.00131012 -3.28262 63.546000 Cu 0.206029 0.84474 1.19529e-17 208 63.546 0.000572218 -3.28268 63.546000 Cu 0.254832 0.829311 0.5 209 63.546 0.000501549 -3.2825 63.546000 Cu 0.315765 0.841371 7.26738e-17 211 63.546 0.0018535 -3.28227 63.546000 Cu 0.32799 0.868685 0 212 63.546 0.0054806 -3.2818 63.546000 Cu 0.376873 0.853507 0.5 213 63.546 0.00265092 -3.28221 63.546000 Cu 0.266975 0.856702 0.5 214 63.546 0.00201323 -3.28221 63.546000 Cu 0.425712 0.838412 1.32678e-16 183 63.546 0.00065745 -3.2827 63.546000 Cu 0.53562 0.835674 1.02078e-16 186 63.546 0.00110736 -3.28341 63.546000 Cu 0.547951 0.863293 9.3472e-17 187 63.546 0.00328483 -3.28318 63.546000 Cu 0.486854 0.850787 0.5 189 63.546 0.000469249 -3.28285 63.546000 Cu 0.438059 0.865819 7.91284e-17 215 63.546 0.00189223 -3.2824 63.546000 Cu 0.596588 0.848045 0.5 188 63.546 0.00365997 -3.28356 63.546000 Cu 0.645227 0.832654 0 257 63.546 0.00130944 -3.28323 63.546000 Cu 0.754832 0.829311 1 259 63.546 0.000501549 -3.2825 63.546000 Cu 0.766975 0.856702 2.74918e-17 260 63.546 0.00201323 -3.28221 63.546000 Cu 0.706029 0.84474 0.5 262 63.546 0.000572218 -3.28268 63.546000 Cu 0.657439 0.86026 1 286 63.546 0.00344709 -3.28326 63.546000 Cu 0.986854 0.850787 1 234 63.546 0.000469249 -3.28285 63.546000 Cu 0.864678 0.826136 1 230 63.546 0.00131012 -3.28262 63.546000 Cu 0.925712 0.838412 0.5 236 63.546 0.00065745 -3.2827 63.546000 Cu 0.815765 0.841371 0.5 261 63.546 0.0018535 -3.28227 63.546000 Cu 0.876873 0.853507 1 263 63.546 0.00265092 -3.28221 63.546000 Cu 0.938059 0.865819 0.5 265 63.546 0.00189223 -3.2824 63.546000 Cu 0.82799 0.868685 0.5 266 63.546 0.0054806 -3.2818 63.546000 Cu 0.108882 0.875748 4.51821e-17 238 63.546 0.0100781 -3.28364 63.546000 Cu 0.169526 0.887958 0.5 244 63.546 0.00968568 -3.28293 63.546000 Cu 0.0112341 0.905894 1.69493e-16 268 63.546 0.00177434 -3.28202 63.546000 Cu 0.0601455 0.890981 0.5 269 63.546 0.00756487 -3.28282 63.546000 Cu 0.121015 0.903598 1.71166e-16 271 63.546 0.0276591 -3.28307 63.546000 Cu 0.218214 0.872241 1 241 63.546 0.00120755 -3.2823 63.546000 Cu 0.230041 0.899774 9.17985e-17 242 63.546 0.00336855 -3.28071 63.546000 Cu 0.278935 0.884062 0.5 243 63.546 0.00607658 -3.28137 63.546000 Cu 0.339789 0.89593 0 245 63.546 0.014646 -3.28075 63.546000 Cu 0.290628 0.911358 0.5 248 63.546 0.0195758 -3.27969 63.546000 Cu 0.388969 0.880825 0.5 218 63.546 0.00616155 -3.2817 63.546000 Cu 0.450034 0.893222 3.17948e-16 216 63.546 0.00332792 -3.28213 63.546000 Cu 0.499123 0.878328 0.5 217 63.546 0.000949117 -3.28269 63.546000 Cu 0.560146 0.890981 0 219 63.546 0.00756487 -3.28282 63.546000 Cu 0.511234 0.905894 0.5 221 63.546 0.00177434 -3.28202 63.546000 Cu 0.400881 0.90807 0.5 247 63.546 0.013998 -3.2805 63.546000 Cu 0.669526 0.887958 1.78099e-16 287 63.546 0.00968568 -3.28293 63.546000 Cu 0.718214 0.872241 0.5 288 63.546 0.00120755 -3.2823 63.546000 Cu 0.608882 0.875748 0.5 289 63.546 0.0100781 -3.28364 63.546000 Cu 0.730041 0.899774 0.5 293 63.546 0.00336855 -3.28071 63.546000 Cu 0.621015 0.903598 0.5 309 63.546 0.0276591 -3.28307 63.546000 Cu 0.778935 0.884062 1.07337e-16 290 63.546 0.00607658 -3.28137 63.546000 Cu 0.790628 0.911358 3.77713e-17 291 63.546 0.0195758 -3.27969 63.546000 Cu 0.999123 0.878328 1 267 63.546 0.000949117 -3.28269 63.546000 Cu 0.888969 0.880825 1 264 63.546 0.00616155 -3.2817 63.546000 Cu 0.950034 0.893222 0.5 270 63.546 0.00332792 -3.28213 63.546000 Cu 0.839789 0.89593 0.5 292 63.546 0.014646 -3.28075 63.546000 Cu 0.900881 0.90807 3.80103e-17 294 63.546 0.013998 -3.2805 63.546000 Cu 0.133423 0.931651 2.24715e-16 272 63.546 0.0679834 -3.28043 63.546000 Cu 0.0723995 0.918769 0.5 274 63.546 0.0148645 -3.2808 63.546000 Cu 0.0236478 0.933508 1.23593e-16 298 63.546 0.00326201 -3.28009 63.546000 Cu 0.0850155 0.946708 0.5 300 63.546 0.0225582 -3.27685 63.546000 Cu 0.181542 0.915818 0.5 273 63.546 0.0293525 -3.28124 63.546000 Cu 0.194002 0.944012 0.5 278 63.546 0.102333 -3.27673 63.546000 Cu 0.351707 0.923035 1 246 63.546 0.0421533 -3.27924 63.546000 Cu 0.24185 0.927381 2.96433e-16 275 63.546 0.0121632 -3.27672 63.546000 Cu 0.253738 0.95521 1.17378e-16 276 63.546 0.0462907 -3.2607 63.546000 Cu 0.302342 0.938516 0.5 277 63.546 0.0753212 -3.27475 63.546000 Cu 0.363768 0.949916 1.5228e-16 279 63.546 0.131677 -3.27693 63.546000 Cu 0.572399 0.918769 0 220 63.546 0.0148645 -3.2808 63.546000 Cu 0.46221 0.920611 1 249 63.546 0.00545091 -3.28114 63.546000 Cu 0.474679 0.948031 6.69364e-18 250 63.546 0.00720254 -3.28079 63.546000 Cu 0.523648 0.933508 0.5 251 63.546 0.00326201 -3.28009 63.546000 Cu 0.413118 0.93523 0.5 252 63.546 0.0278065 -3.27817 63.546000 Cu 0.585015 0.946708 1 253 63.546 0.0225582 -3.27685 63.546000 Cu 0.681542 0.915818 1.12119e-16 310 63.546 0.0293525 -3.28124 63.546000 Cu 0.694002 0.944012 0 311 63.546 0.102333 -3.27673 63.546000 Cu 0.74185 0.927381 0.5 312 63.546 0.0121632 -3.27672 63.546000 Cu 0.633423 0.931651 0.5 313 63.546 0.0679834 -3.28043 63.546000 Cu 0.753738 0.95521 0.5 317 63.546 0.0462907 -3.2607 63.546000 Cu 0.913118 0.93523 4.51821e-17 295 63.546 0.0278065 -3.27817 63.546000 Cu 0.96221 0.920611 0.5 296 63.546 0.00545091 -3.28114 63.546000 Cu 0.851707 0.923035 0.5 297 63.546 0.0421533 -3.27924 63.546000 Cu 0.974679 0.948031 0.5 301 63.546 0.00720254 -3.28079 63.546000 Cu 0.802342 0.938516 7.81722e-17 314 63.546 0.0753212 -3.27475 63.546000 Cu 0.863768 0.949916 0.5 316 63.546 0.131677 -3.27693 63.546000 Cu 0.0365961 0.961265 5.6896e-17 299 63.546 0.00554419 -3.27788 63.546000 Cu 0.146264 0.960018 1.86466e-17 302 63.546 0.144383 -3.2718 63.546000 Cu 0.160059 0.988751 0 303 63.546 0.400225 -3.25077 63.546000 Cu 0.0983089 0.97485 0.5 305 63.546 0.0323669 -3.27214 63.546000 Cu 0.0494259 0.98913 1.40806e-16 322 63.546 0.114689 -3.27605 63.546000 Cu 0.376733 0.97653 7.17176e-18 280 63.546 0.36382 -3.27306 63.546000 Cu 0.3138 0.965304 0.5 282 63.546 0.379648 -3.25239 63.546000 Cu 0.207395 0.972742 0.5 304 63.546 0.394594 -3.24824 63.546000 Cu 0.266294 0.983435 5.88084e-17 306 63.546 5.79869 -3.09942 63.546000 Cu 0.327724 0.99079 0.5 307 63.546 7.20671 -2.99749 63.546000 Cu 0.536596 0.961265 0.5 255 63.546 0.00554419 -3.27788 63.546000 Cu 0.425414 0.962394 0.5 281 63.546 0.0368371 -3.27683 63.546000 Cu 0.487906 0.9755 1.57062e-16 283 63.546 0.0217079 -3.27647 63.546000 Cu 0.549426 0.98913 0.5 284 63.546 0.114689 -3.27605 63.546000 Cu 0.438387 0.989476 0.5 285 63.546 0.133521 -3.27894 63.546000 Cu 0.598309 0.97485 9.25157e-17 254 63.546 0.0323669 -3.27214 63.546000 Cu 0.646264 0.960018 0.5 324 63.546 0.144383 -3.2718 63.546000 Cu 0.707395 0.972742 1.06142e-16 325 63.546 0.394594 -3.24824 63.546000 Cu 0.766294 0.983435 0.5 327 63.546 5.79869 -3.09942 63.546000 Cu 0.660059 0.988751 0.5 328 63.546 0.400225 -3.25077 63.546000 Cu 0.987906 0.9755 0.5 320 63.546 0.0217079 -3.27647 63.546000 Cu 0.8138 0.965304 3.16514e-16 315 63.546 0.379648 -3.25239 63.546000 Cu 0.925414 0.962394 2.67746e-17 318 63.546 0.0368371 -3.27683 63.546000 Cu 0.938387 0.989476 1.32917e-16 319 63.546 0.133521 -3.27894 63.546000 Cu 0.876733 0.97653 0.5 321 63.546 0.36382 -3.27306 63.546000 Cu 0.827724 0.99079 0 329 63.546 7.20671 -2.99749