Number of particles = 592 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.165 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 88.8893 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.67034 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 0.0903162 0.00397506 0.5 304 63.546 0.50127 -3.15944 63.546000 Cu 0.00742784 0.0441981 1 314 63.546 0.36063 -3.26268 63.546000 Cu 0.00283724 0.0236556 0.5 315 63.546 0.329897 -3.25995 63.546000 Cu 0.0850394 0.0236564 1 317 63.546 0.728429 -3.17717 63.546000 Cu 0.181986 0.0402749 1 318 63.546 4.29491 -3.10576 63.546000 Cu 0.164853 0.0236451 0.5 319 63.546 6.77128 -2.57767 63.546000 Cu 0.0902618 0.0433491 0.5 320 63.546 0.499173 -3.16159 63.546000 Cu 0.182137 0.0070385 1 321 63.546 4.32063 -3.10591 63.546000 Cu 0.0074768 0.00311275 1 302 63.546 0.36779 -3.26187 63.546000 Cu 0.331753 0.0236331 1 322 63.546 8.4776 -3.62673 63.546000 Cu 0.263197 0.0105936 0.5 323 63.546 9.36467 -2.80359 63.546000 Cu 0.263094 0.0366732 0.5 324 63.546 9.34774 -2.8049 63.546000 Cu 0.357468 0.0493749 0.5 347 63.546 0.906541 -3.07838 63.546000 Cu 0.590316 0.00397506 3.40296e-17 297 63.546 0.50127 -3.15944 63.546000 Cu 0.585039 0.0236564 0.5 299 63.546 0.728429 -3.17717 63.546000 Cu 0.590262 0.0433491 1.1674e-16 305 63.546 0.499173 -3.16159 63.546000 Cu 0.428523 0.00202712 1.33283e-16 325 63.546 0.530776 -3.20768 63.546000 Cu 0.502837 0.0236556 2.50496e-17 326 63.546 0.329897 -3.25995 63.546000 Cu 0.507477 0.00311275 0.5 327 63.546 0.36779 -3.26187 63.546000 Cu 0.416219 0.023643 0.5 328 63.546 2.06278 -3.3924 63.546000 Cu 0.428429 0.0452543 1.04452e-16 349 63.546 0.531454 -3.20775 63.546000 Cu 0.507428 0.0441981 0.5 351 63.546 0.36063 -3.26268 63.546000 Cu 0.664853 0.0236451 4.73106e-16 298 63.546 6.77128 -2.57767 63.546000 Cu 0.682137 0.0070385 0.5 301 63.546 4.32063 -3.10591 63.546000 Cu 0.681986 0.0402749 0.5 307 63.546 4.29491 -3.10576 63.546000 Cu 0.763094 0.0366732 1 309 63.546 9.34774 -2.8049 63.546000 Cu 0.763197 0.0105936 3.40296e-17 300 63.546 9.36467 -2.80359 63.546000 Cu 0.928523 0.00202712 0.5 303 63.546 0.530776 -3.20768 63.546000 Cu 0.831753 0.0236331 0.5 311 63.546 8.4776 -3.62673 63.546000 Cu 0.916219 0.023643 1 313 63.546 2.06278 -3.3924 63.546000 Cu 0.928429 0.0452543 0.5 316 63.546 0.531454 -3.20775 63.546000 Cu 0.857468 0.0493749 3.40296e-17 310 63.546 0.906541 -3.07838 63.546000 Cu 0.0383248 0.0851185 1 338 63.546 0.0213939 -3.26329 63.546000 Cu 0.0209604 0.0649114 0.5 339 63.546 0.232412 -3.24854 63.546000 Cu 0.104661 0.0619108 1 341 63.546 0.123247 -3.28827 63.546000 Cu 0.189599 0.0589932 0.5 343 63.546 0.0857386 -3.22356 63.546000 Cu 0.119256 0.0814885 0.5 344 63.546 0.0392973 -3.28898 63.546000 Cu 0.203614 0.0778447 1 342 63.546 0.051843 -3.29481 63.546000 Cu 0.27844 0.0548674 1 345 63.546 0.988318 -3.10575 63.546000 Cu 0.369048 0.07104 1 346 63.546 0.179941 -3.20555 63.546000 Cu 0.287535 0.0742737 0.5 348 63.546 0.0940149 -3.28534 63.546000 Cu 0.216596 0.097704 0.5 369 63.546 0.0302439 -3.3034 63.546000 Cu 0.298275 0.0944833 1 371 63.546 0.0168306 -3.29338 63.546000 Cu 0.379014 0.0916781 0.5 373 63.546 0.0164744 -3.25338 63.546000 Cu 0.52096 0.0649114 2.3868e-16 350 63.546 0.232412 -3.24854 63.546000 Cu 0.444716 0.0678358 0.5 352 63.546 0.0833851 -3.1829 63.546000 Cu 0.458858 0.0887921 1.19576e-16 375 63.546 0.0711697 -3.22151 63.546000 Cu 0.538325 0.0851185 0.5 377 63.546 0.0213939 -3.26329 63.546000 Cu 0.689599 0.0589932 3.40296e-17 306 63.546 0.0857386 -3.22356 63.546000 Cu 0.604661 0.0619108 0.5 308 63.546 0.123247 -3.28827 63.546000 Cu 0.77844 0.0548674 0.5 312 63.546 0.988318 -3.10575 63.546000 Cu 0.619256 0.0814885 1.18158e-16 329 63.546 0.0392973 -3.28898 63.546000 Cu 0.716596 0.097704 9.87804e-17 330 63.546 0.0302439 -3.3034 63.546000 Cu 0.703614 0.0778447 0.5 331 63.546 0.051843 -3.29481 63.546000 Cu 0.787535 0.0742737 1.1674e-16 333 63.546 0.0940149 -3.28534 63.546000 Cu 0.798275 0.0944833 0.5 336 63.546 0.0168306 -3.29338 63.546000 Cu 0.879014 0.0916781 4.34823e-17 334 63.546 0.0164744 -3.25338 63.546000 Cu 0.869048 0.07104 0.5 335 63.546 0.179941 -3.20555 63.546000 Cu 0.944716 0.0678358 1 337 63.546 0.0833851 -3.1829 63.546000 Cu 0.958858 0.0887921 0.5 340 63.546 0.0711697 -3.22151 63.546000 Cu 0.0679609 0.125192 3.40296e-17 364 63.546 0.00363024 -3.27527 63.546000 Cu 0.0538217 0.105205 0.5 365 63.546 0.00565794 -3.26358 63.546000 Cu 0.135065 0.101344 1 367 63.546 0.0122383 -3.28758 63.546000 Cu 0.149173 0.121575 0.5 370 63.546 0.006261 -3.2807 63.546000 Cu 0.0813255 0.145335 0.5 391 63.546 0.00170928 -3.27857 63.546000 Cu 0.162405 0.141917 3.40296e-17 393 63.546 0.00149604 -3.27564 63.546000 Cu 0.229825 0.118117 3.40296e-17 368 63.546 0.00443787 -3.2846 63.546000 Cu 0.391058 0.111986 3.40296e-17 372 63.546 0.0113368 -3.26464 63.546000 Cu 0.310295 0.114951 0.5 374 63.546 0.00460018 -3.2784 63.546000 Cu 0.24301 0.13859 0.5 395 63.546 0.00047799 -3.27224 63.546000 Cu 0.323558 0.135363 5.57708e-17 397 63.546 0.00286193 -3.2709 63.546000 Cu 0.581325 0.145335 3.40296e-17 353 63.546 0.00170928 -3.27857 63.546000 Cu 0.567961 0.125192 0.5 354 63.546 0.00363024 -3.27527 63.546000 Cu 0.553822 0.105205 3.40296e-17 376 63.546 0.00565794 -3.26358 63.546000 Cu 0.4725 0.108805 0.5 378 63.546 0.0122832 -3.25764 63.546000 Cu 0.404622 0.132119 0.5 399 63.546 0.003351 -3.27254 63.546000 Cu 0.486225 0.128751 1.18631e-16 401 63.546 0.00105193 -3.27373 63.546000 Cu 0.499895 0.148796 0.5 402 63.546 0.000687606 -3.2783 63.546000 Cu 0.635065 0.101344 0.5 332 63.546 0.0122383 -3.28758 63.546000 Cu 0.649173 0.121575 1.19104e-16 355 63.546 0.006261 -3.2807 63.546000 Cu 0.74301 0.13859 1.19576e-16 356 63.546 0.00047799 -3.27224 63.546000 Cu 0.729825 0.118117 0.5 357 63.546 0.00443787 -3.2846 63.546000 Cu 0.662405 0.141917 0.5 358 63.546 0.00149604 -3.27564 63.546000 Cu 0.999895 0.148796 1 389 63.546 0.000687606 -3.2783 63.546000 Cu 0.810295 0.114951 4.06465e-17 359 63.546 0.00460018 -3.2784 63.546000 Cu 0.904622 0.132119 1 360 63.546 0.003351 -3.27254 63.546000 Cu 0.891058 0.111986 0.5 361 63.546 0.0113368 -3.26464 63.546000 Cu 0.823558 0.135363 0.5 362 63.546 0.00286193 -3.2709 63.546000 Cu 0.9725 0.108805 1 363 63.546 0.0122832 -3.25764 63.546000 Cu 0.986225 0.128751 0.5 366 63.546 0.00105193 -3.27373 63.546000 Cu 0.0945352 0.165584 3.40296e-17 390 63.546 0.000436182 -3.27674 63.546000 Cu 0.013376 0.168981 0.5 392 63.546 0.00047375 -3.27777 63.546000 Cu 0.175531 0.162249 0.5 396 63.546 0.000161043 -3.27329 63.546000 Cu 0.0268623 0.189237 1.46516e-16 413 63.546 0.000152159 -3.27621 63.546000 Cu 0.107844 0.185875 0.5 415 63.546 8.0044e-05 -3.2751 63.546000 Cu 0.188834 0.182545 1 417 63.546 0.000157974 -3.27304 63.546000 Cu 0.256372 0.158956 1 394 63.546 0.00066987 -3.26997 63.546000 Cu 0.337254 0.15563 0.5 400 63.546 0.000958997 -3.27072 63.546000 Cu 0.283443 0.199435 3.40296e-17 418 63.546 5.29739e-05 -3.27348 63.546000 Cu 0.269857 0.179214 0.5 419 63.546 0.00031726 -3.27161 63.546000 Cu 0.350979 0.175841 1 421 63.546 0.000148875 -3.27249 63.546000 Cu 0.364614 0.196038 0.5 424 63.546 3.66992e-05 -3.27417 63.546000 Cu 0.594535 0.165584 0.5 380 63.546 0.000436182 -3.27674 63.546000 Cu 0.418425 0.152246 1.19104e-16 398 63.546 0.000502074 -3.27478 63.546000 Cu 0.445775 0.192637 1 422 63.546 0.000134682 -3.27559 63.546000 Cu 0.432145 0.172412 0.5 423 63.546 0.000122199 -3.27561 63.546000 Cu 0.513376 0.168981 3.40296e-17 425 63.546 0.00047375 -3.27777 63.546000 Cu 0.526862 0.189237 0.5 426 63.546 0.000152159 -3.27621 63.546000 Cu 0.607844 0.185875 3.40296e-17 379 63.546 8.0044e-05 -3.2751 63.546000 Cu 0.675531 0.162249 3.40296e-17 381 63.546 0.000161043 -3.27329 63.546000 Cu 0.769857 0.179214 1.17686e-16 382 63.546 0.00031726 -3.27161 63.546000 Cu 0.756372 0.158956 0.5 383 63.546 0.00066987 -3.26997 63.546000 Cu 0.688834 0.182545 0.5 384 63.546 0.000157974 -3.27304 63.546000 Cu 0.783443 0.199435 0.5 407 63.546 5.29739e-05 -3.27348 63.546000 Cu 0.837254 0.15563 1.67312e-16 385 63.546 0.000958997 -3.27072 63.546000 Cu 0.932145 0.172412 3.40296e-17 386 63.546 0.000122199 -3.27561 63.546000 Cu 0.918425 0.152246 0.5 387 63.546 0.000502074 -3.27478 63.546000 Cu 0.850979 0.175841 0.5 388 63.546 0.000148875 -3.27249 63.546000 Cu 0.864614 0.196038 3.40296e-17 409 63.546 3.66992e-05 -3.27417 63.546000 Cu 0.945775 0.192637 0.5 411 63.546 0.000134682 -3.27559 63.546000 Cu 0.12134 0.20616 3.40296e-17 414 63.546 4.12064e-05 -3.27414 63.546000 Cu 0.0403132 0.209521 0.5 416 63.546 1.09421e-05 -3.275 63.546000 Cu 0.0537778 0.229785 1 439 63.546 1.85237e-05 -3.27369 63.546000 Cu 0.148364 0.246649 0 440 63.546 7.83358e-06 -3.27419 63.546000 Cu 0.134858 0.226416 0.5 441 63.546 2.85892e-05 -3.27337 63.546000 Cu 0.20235 0.202806 0.5 420 63.546 0.000102294 -3.27327 63.546000 Cu 0.215961 0.223043 1.08706e-16 443 63.546 2.16311e-05 -3.27362 63.546000 Cu 0.31062 0.239902 1 444 63.546 3.1777e-05 -3.27462 63.546000 Cu 0.29707 0.21966 0.5 445 63.546 2.03665e-05 -3.27472 63.546000 Cu 0.229485 0.243274 0.5 446 63.546 5.78638e-06 -3.27442 63.546000 Cu 0.378173 0.21627 1 447 63.546 4.95151e-05 -3.27547 63.546000 Cu 0.391683 0.23653 0.5 450 63.546 1.87445e-05 -3.27467 63.546000 Cu 0.472742 0.233155 3.40296e-17 448 63.546 7.10133e-06 -3.27442 63.546000 Cu 0.459259 0.212889 0.5 449 63.546 3.3496e-05 -3.27544 63.546000 Cu 0.540313 0.209521 1.11542e-16 451 63.546 1.09421e-05 -3.275 63.546000 Cu 0.553778 0.229785 0.5 452 63.546 1.85237e-05 -3.27369 63.546000 Cu 0.634858 0.226416 3.40296e-17 403 63.546 2.85892e-05 -3.27337 63.546000 Cu 0.62134 0.20616 0.5 404 63.546 4.12064e-05 -3.27414 63.546000 Cu 0.70235 0.202806 3.40296e-17 405 63.546 0.000102294 -3.27327 63.546000 Cu 0.79707 0.21966 9.73625e-17 406 63.546 2.03665e-05 -3.27472 63.546000 Cu 0.715961 0.223043 0.5 408 63.546 2.16311e-05 -3.27362 63.546000 Cu 0.648364 0.246649 0.5 429 63.546 7.83358e-06 -3.27419 63.546000 Cu 0.729485 0.243274 3.40296e-17 431 63.546 5.78638e-06 -3.27442 63.546000 Cu 0.959259 0.212889 0 410 63.546 3.3496e-05 -3.27544 63.546000 Cu 0.878173 0.21627 0.5 412 63.546 4.95151e-05 -3.27547 63.546000 Cu 0.81062 0.239902 0.5 433 63.546 3.1777e-05 -3.27462 63.546000 Cu 0.891683 0.23653 1 435 63.546 1.87445e-05 -3.27467 63.546000 Cu 0.972742 0.233155 0.5 437 63.546 7.10133e-06 -3.27442 63.546000 Cu 0.067265 0.25003 0.5 442 63.546 1.68969e-05 -3.27407 63.546000 Cu 0.0132002 0.293867 1 462 63.546 5.52423e-06 -3.27384 63.546000 Cu 0.0808099 0.270272 3.40296e-17 465 63.546 1.57954e-05 -3.27442 63.546000 Cu 0.175418 0.287133 1 466 63.546 2.52925e-05 -3.27398 63.546000 Cu 0.161919 0.26689 0.5 467 63.546 1.23804e-05 -3.27473 63.546000 Cu 0.0943287 0.290493 0.5 468 63.546 2.75914e-05 -3.27376 63.546000 Cu 0.242977 0.263516 1 469 63.546 6.49885e-06 -3.27462 63.546000 Cu 0.337538 0.28038 3.40296e-17 470 63.546 3.16174e-06 -3.27365 63.546000 Cu 0.324066 0.260141 0.5 471 63.546 4.3921e-06 -3.27413 63.546000 Cu 0.256489 0.283756 0.5 472 63.546 6.83109e-06 -3.27398 63.546000 Cu 0.567265 0.25003 6.00245e-17 427 63.546 1.68969e-05 -3.27407 63.546000 Cu 0.58081 0.270272 0.5 430 63.546 1.57954e-05 -3.27442 63.546000 Cu 0.594329 0.290493 1 453 63.546 2.75914e-05 -3.27376 63.546000 Cu 0.405152 0.256773 1.19576e-16 473 63.546 2.91585e-06 -3.27366 63.546000 Cu 0.499695 0.273646 1.19576e-16 474 63.546 1.75492e-05 -3.27395 63.546000 Cu 0.486218 0.25341 0.5 475 63.546 2.00048e-05 -3.27371 63.546000 Cu 0.418594 0.277013 0.5 476 63.546 1.19247e-05 -3.27381 63.546000 Cu 0.432082 0.297244 1.60695e-16 497 63.546 8.64078e-06 -3.27355 63.546000 Cu 0.5132 0.293867 0.5 499 63.546 5.52423e-06 -3.27384 63.546000 Cu 0.661919 0.26689 6.85319e-17 428 63.546 1.23804e-05 -3.27473 63.546000 Cu 0.742977 0.263516 0.5 434 63.546 6.49885e-06 -3.27462 63.546000 Cu 0.675418 0.287133 0.5 455 63.546 2.52925e-05 -3.27398 63.546000 Cu 0.756489 0.283756 9.0273e-17 457 63.546 6.83109e-06 -3.27398 63.546000 Cu 0.999695 0.273646 0.5 463 63.546 1.75492e-05 -3.27395 63.546000 Cu 0.824066 0.260141 2.07959e-16 432 63.546 4.3921e-06 -3.27413 63.546000 Cu 0.986218 0.25341 1.45571e-16 436 63.546 2.00048e-05 -3.27371 63.546000 Cu 0.905152 0.256773 0.5 438 63.546 2.91585e-06 -3.27366 63.546000 Cu 0.837538 0.28038 0.5 459 63.546 3.16174e-06 -3.27365 63.546000 Cu 0.918594 0.277013 1 461 63.546 1.19247e-05 -3.27381 63.546000 Cu 0.932082 0.297244 0.5 464 63.546 8.64078e-06 -3.27355 63.546000 Cu 0.0400463 0.334335 1 486 63.546 2.50705e-05 -3.27469 63.546000 Cu 0.0266527 0.31409 0.5 487 63.546 2.65692e-05 -3.27402 63.546000 Cu 0.107751 0.310726 4.72633e-19 489 63.546 4.32185e-06 -3.27426 63.546000 Cu 0.188856 0.30736 0.5 491 63.546 8.23287e-06 -3.27414 63.546000 Cu 0.121139 0.330956 0.5 492 63.546 3.97197e-05 -3.27482 63.546000 Cu 0.202311 0.327581 0 490 63.546 1.06563e-05 -3.27421 63.546000 Cu 0.269965 0.303989 1.19576e-16 493 63.546 1.13791e-05 -3.27361 63.546000 Cu 0.36451 0.320848 3.40296e-17 494 63.546 9.77569e-06 -3.27301 63.546000 Cu 0.351017 0.300612 0.5 495 63.546 1.9739e-06 -3.27321 63.546000 Cu 0.283425 0.32421 0.5 496 63.546 1.22675e-05 -3.27332 63.546000 Cu 0.215762 0.347786 0.5 517 63.546 4.4222e-05 -3.27343 63.546000 Cu 0.296914 0.344432 1 519 63.546 5.33072e-05 -3.27296 63.546000 Cu 0.377989 0.341079 0.5 521 63.546 5.95058e-05 -3.27317 63.546000 Cu 0.526653 0.31409 1 498 63.546 2.65692e-05 -3.27402 63.546000 Cu 0.44557 0.317469 0.5 500 63.546 1.22848e-05 -3.27336 63.546000 Cu 0.459013 0.337712 2.55222e-16 523 63.546 2.30695e-05 -3.27409 63.546000 Cu 0.540046 0.334335 0.5 525 63.546 2.50705e-05 -3.27469 63.546000 Cu 0.688856 0.30736 3.40296e-17 454 63.546 8.23287e-06 -3.27414 63.546000 Cu 0.607751 0.310726 0.5 456 63.546 4.32185e-06 -3.27426 63.546000 Cu 0.769965 0.303989 0.5 460 63.546 1.13791e-05 -3.27361 63.546000 Cu 0.621139 0.330956 3.30843e-18 477 63.546 3.97197e-05 -3.27482 63.546000 Cu 0.715762 0.347786 1 478 63.546 4.4222e-05 -3.27343 63.546000 Cu 0.702311 0.327581 0.5 479 63.546 1.06563e-05 -3.27421 63.546000 Cu 0.783425 0.32421 3.40296e-17 481 63.546 1.22675e-05 -3.27332 63.546000 Cu 0.796914 0.344432 0.5 484 63.546 5.33072e-05 -3.27296 63.546000 Cu 0.851017 0.300612 1 458 63.546 1.9739e-06 -3.27321 63.546000 Cu 0.877989 0.341079 3.54475e-17 482 63.546 5.95058e-05 -3.27317 63.546000 Cu 0.86451 0.320848 0.5 483 63.546 9.77569e-06 -3.27301 63.546000 Cu 0.94557 0.317469 1.20994e-16 485 63.546 1.22848e-05 -3.27336 63.546000 Cu 0.959013 0.337712 0.5 488 63.546 2.30695e-05 -3.27409 63.546000 Cu 0.0669635 0.374811 1.20049e-16 512 63.546 0.000157483 -3.27556 63.546000 Cu 0.0534466 0.354583 0.5 513 63.546 0.000119266 -3.27548 63.546000 Cu 0.134593 0.351175 1 515 63.546 4.83571e-05 -3.27441 63.546000 Cu 0.148137 0.371375 0.5 518 63.546 0.000155818 -3.27266 63.546000 Cu 0.0807006 0.394989 0.5 539 63.546 0.000425277 -3.27522 63.546000 Cu 0.161847 0.391584 3.40296e-17 541 63.546 0.000954546 -3.27057 63.546000 Cu 0.229268 0.367996 1.20049e-16 516 63.546 0.000294255 -3.27166 63.546000 Cu 0.391375 0.361343 1 520 63.546 6.74278e-05 -3.27498 63.546000 Cu 0.310358 0.364666 0.5 522 63.546 0.000200083 -3.2731 63.546000 Cu 0.242711 0.388244 0.5 543 63.546 0.000861304 -3.26977 63.546000 Cu 0.3236 0.384949 1 545 63.546 0.000177145 -3.27377 63.546000 Cu 0.580701 0.394989 1 501 63.546 0.000425277 -3.27522 63.546000 Cu 0.566963 0.374811 0.5 502 63.546 0.000157483 -3.27556 63.546000 Cu 0.553447 0.354583 6.47508e-17 524 63.546 0.000119266 -3.27548 63.546000 Cu 0.472386 0.357984 0.5 526 63.546 0.000101758 -3.27598 63.546000 Cu 0.404619 0.381633 0.5 547 63.546 0.000453923 -3.27735 63.546000 Cu 0.485775 0.378245 9.45267e-19 549 63.546 0.00051812 -3.27793 63.546000 Cu 0.499283 0.398434 0.5 550 63.546 0.000710848 -3.27861 63.546000 Cu 0.634593 0.351175 0.5 480 63.546 4.83571e-05 -3.27441 63.546000 Cu 0.648137 0.371375 1 503 63.546 0.000155818 -3.27266 63.546000 Cu 0.742711 0.388244 1.4179e-18 504 63.546 0.000861304 -3.26977 63.546000 Cu 0.729268 0.367996 0.5 505 63.546 0.000294255 -3.27166 63.546000 Cu 0.661847 0.391584 0.5 506 63.546 0.000954546 -3.27057 63.546000 Cu 0.999283 0.398434 0 537 63.546 0.000710848 -3.27861 63.546000 Cu 0.810358 0.364666 0 507 63.546 0.000200083 -3.2731 63.546000 Cu 0.904619 0.381633 1 508 63.546 0.000453923 -3.27735 63.546000 Cu 0.891375 0.361343 0.5 509 63.546 6.74278e-05 -3.27498 63.546000 Cu 0.8236 0.384949 0.5 510 63.546 0.000177145 -3.27377 63.546000 Cu 0.972386 0.357984 1.65422e-17 511 63.546 0.000101758 -3.27598 63.546000 Cu 0.985775 0.378245 0.5 514 63.546 0.00051812 -3.27793 63.546000 Cu 0.0945622 0.415129 1 538 63.546 0.00335155 -3.27305 63.546000 Cu 0.0128969 0.418488 0.5 540 63.546 0.0008733 -3.27367 63.546000 Cu 0.175624 0.411856 0.5 544 63.546 0.00333203 -3.27105 63.546000 Cu 0.0266116 0.438439 1 561 63.546 0.0120739 -3.25791 63.546000 Cu 0.108074 0.435252 0.5 563 63.546 0.0106315 -3.26533 63.546000 Cu 0.188935 0.432287 1 565 63.546 0.00521281 -3.27884 63.546000 Cu 0.256092 0.408614 1.21467e-16 542 63.546 0.000515914 -3.27177 63.546000 Cu 0.336669 0.405285 0.5 548 63.546 0.00171709 -3.27523 63.546000 Cu 0.282718 0.449539 3.26117e-17 566 63.546 0.0304771 -3.30348 63.546000 Cu 0.269342 0.429106 0.5 567 63.546 0.00460838 -3.28429 63.546000 Cu 0.349957 0.425627 1 569 63.546 0.00595011 -3.28045 63.546000 Cu 0.364176 0.445886 0.5 572 63.546 0.0111513 -3.28814 63.546000 Cu 0.594562 0.415129 0.5 528 63.546 0.00335155 -3.27305 63.546000 Cu 0.417773 0.401877 1 546 63.546 0.00175439 -3.27841 63.546000 Cu 0.445329 0.442031 1 570 63.546 0.00605815 -3.26431 63.546000 Cu 0.431132 0.422017 0.5 571 63.546 0.00400405 -3.27505 63.546000 Cu 0.512897 0.418488 0 573 63.546 0.0008733 -3.27367 63.546000 Cu 0.526612 0.438439 0.5 574 63.546 0.0120739 -3.25791 63.546000 Cu 0.608074 0.435252 1.20994e-16 527 63.546 0.0106315 -3.26533 63.546000 Cu 0.675624 0.411856 1 529 63.546 0.00333203 -3.27105 63.546000 Cu 0.769342 0.429106 1 530 63.546 0.00460838 -3.28429 63.546000 Cu 0.756092 0.408614 0.5 531 63.546 0.000515914 -3.27177 63.546000 Cu 0.688935 0.432287 0.5 532 63.546 0.00521281 -3.27884 63.546000 Cu 0.782718 0.449539 0.5 555 63.546 0.0304771 -3.30348 63.546000 Cu 0.836669 0.405285 1 533 63.546 0.00171709 -3.27523 63.546000 Cu 0.931132 0.422017 1 534 63.546 0.00400405 -3.27505 63.546000 Cu 0.917773 0.401877 0.5 535 63.546 0.00175439 -3.27841 63.546000 Cu 0.849957 0.425627 0.5 536 63.546 0.00595011 -3.28045 63.546000 Cu 0.864176 0.445886 1 557 63.546 0.0111513 -3.28814 63.546000 Cu 0.945329 0.442031 0.5 559 63.546 0.00605815 -3.26431 63.546000 Cu 0.120185 0.455562 1 562 63.546 0.0164883 -3.25441 63.546000 Cu 0.0403294 0.458467 0.5 564 63.546 0.06939 -3.22247 63.546000 Cu 0.0546559 0.479423 2.4057e-16 581 63.546 0.0830983 -3.18372 63.546000 Cu 0.142111 0.497864 4.72633e-19 582 63.546 0.901509 -3.07884 63.546000 Cu 0.130391 0.476204 0.5 583 63.546 0.177717 -3.20725 63.546000 Cu 0.201005 0.452753 0.5 568 63.546 0.0158028 -3.29368 63.546000 Cu 0.211902 0.472959 4.72633e-19 585 63.546 0.0901265 -3.28543 63.546000 Cu 0.309856 0.488287 1 586 63.546 0.0856116 -3.22441 63.546000 Cu 0.295794 0.46942 0.5 587 63.546 0.0516101 -3.29465 63.546000 Cu 0.221133 0.492386 0.5 588 63.546 0.985777 -3.10732 63.546000 Cu 0.38005 0.465784 1.4179e-18 589 63.546 0.0399935 -3.28896 63.546000 Cu 0.394724 0.485395 0.5 592 63.546 0.124309 -3.28868 63.546000 Cu 0.554656 0.479423 0.5 4 63.546 0.0830983 -3.18372 63.546000 Cu 0.540329 0.458467 3.40296e-17 11 63.546 0.06939 -3.22247 63.546000 Cu 0.478406 0.482368 1 590 63.546 0.229235 -3.24738 63.546000 Cu 0.460868 0.462151 0.5 591 63.546 0.0198801 -3.26362 63.546000 Cu 0.630391 0.476204 4.72633e-19 551 63.546 0.177717 -3.20725 63.546000 Cu 0.620185 0.455562 0.5 552 63.546 0.0164883 -3.25441 63.546000 Cu 0.701005 0.452753 1.46516e-17 553 63.546 0.0158028 -3.29368 63.546000 Cu 0.795794 0.46942 1 554 63.546 0.0516101 -3.29465 63.546000 Cu 0.711902 0.472959 0.5 556 63.546 0.0901265 -3.28543 63.546000 Cu 0.642111 0.497864 0.5 576 63.546 0.901509 -3.07884 63.546000 Cu 0.721133 0.492386 1 577 63.546 0.985777 -3.10732 63.546000 Cu 0.960868 0.462151 1 558 63.546 0.0198801 -3.26362 63.546000 Cu 0.88005 0.465784 0.5 560 63.546 0.0399935 -3.28896 63.546000 Cu 0.809856 0.488287 0.5 578 63.546 0.0856116 -3.22441 63.546000 Cu 0.894724 0.485395 1 579 63.546 0.124309 -3.28868 63.546000 Cu 0.978406 0.482368 0.5 580 63.546 0.229235 -3.24738 63.546000 Cu 0.0834205 0.523618 1.34228e-16 23 63.546 2.0504 -3.39206 63.546000 Cu 0.167927 0.523647 0.5 25 63.546 8.46725 -3.62712 63.546000 Cu 0.0712658 0.545234 0.5 26 63.546 0.527513 -3.2078 63.546000 Cu 0.0711325 0.502005 0.5 584 63.546 0.53097 -3.20791 63.546000 Cu 0.142276 0.549341 1 24 63.546 0.906846 -3.08092 63.546000 Cu 0.23644 0.510609 1 3 63.546 9.37271 -2.80489 63.546000 Cu 0.334829 0.523639 1.4179e-18 5 63.546 6.76206 -2.57676 63.546000 Cu 0.317511 0.507034 0.5 6 63.546 4.32888 -3.10687 63.546000 Cu 0.236769 0.536683 1.51243e-17 27 63.546 9.34463 -2.80229 63.546000 Cu 0.317828 0.540272 0.5 29 63.546 4.27799 -3.10464 63.546000 Cu 0.414672 0.523648 0.5 7 63.546 0.730229 -3.17724 63.546000 Cu 0.409336 0.503952 1 8 63.546 0.504091 -3.1597 63.546000 Cu 0.496812 0.523639 1 9 63.546 0.32741 -3.25971 63.546000 Cu 0.49216 0.503092 0.5 10 63.546 0.366295 -3.26152 63.546000 Cu 0.583421 0.523618 0.5 14 63.546 2.0504 -3.39206 63.546000 Cu 0.409469 0.543343 4.72633e-19 31 63.546 0.496595 -3.16284 63.546000 Cu 0.492276 0.544189 0.5 34 63.546 0.357355 -3.26236 63.546000 Cu 0.571266 0.545234 1 35 63.546 0.527513 -3.2078 63.546000 Cu 0.571132 0.502005 1 575 63.546 0.53097 -3.20791 63.546000 Cu 0.667927 0.523647 1 12 63.546 8.46725 -3.62712 63.546000 Cu 0.73644 0.510609 0.5 13 63.546 9.37271 -2.80489 63.546000 Cu 0.736769 0.536683 0.5 18 63.546 9.34463 -2.80229 63.546000 Cu 0.642276 0.549341 0.5 37 63.546 0.906846 -3.08092 63.546000 Cu 0.99216 0.503092 1 1 63.546 0.366295 -3.26152 63.546000 Cu 0.817511 0.507034 1 15 63.546 4.32888 -3.10687 63.546000 Cu 0.909336 0.503952 0.5 2 63.546 0.504091 -3.1597 63.546000 Cu 0.817828 0.540272 1 16 63.546 4.27799 -3.10464 63.546000 Cu 0.834829 0.523639 0.5 17 63.546 6.76206 -2.57676 63.546000 Cu 0.914672 0.523648 1 19 63.546 0.730229 -3.17724 63.546000 Cu 0.992276 0.544189 1 20 63.546 0.357355 -3.26236 63.546000 Cu 0.996812 0.523639 0.5 21 63.546 0.32741 -3.25971 63.546000 Cu 0.909469 0.543343 0.5 22 63.546 0.496595 -3.16284 63.546000 Cu 0.0550737 0.567815 1 47 63.546 0.082349 -3.18285 63.546000 Cu 0.120836 0.591664 1 48 63.546 0.0166089 -3.25378 63.546000 Cu 0.130742 0.571012 0.5 49 63.546 0.180303 -3.20585 63.546000 Cu 0.041023 0.588783 0.5 50 63.546 0.0717637 -3.22195 63.546000 Cu 0.310214 0.558994 3.40296e-17 28 63.546 0.0850642 -3.22289 63.546000 Cu 0.221379 0.554863 0.5 30 63.546 0.982935 -3.10502 63.546000 Cu 0.395154 0.561918 0.5 32 63.546 0.122442 -3.28839 63.546000 Cu 0.212254 0.574253 1 51 63.546 0.0961372 -3.28484 63.546000 Cu 0.283279 0.597678 1 52 63.546 0.0317248 -3.30328 63.546000 Cu 0.296217 0.577833 0.5 53 63.546 0.0516763 -3.29395 63.546000 Cu 0.201584 0.594456 0.5 54 63.546 0.0177599 -3.29367 63.546000 Cu 0.380607 0.581484 1 55 63.546 0.039734 -3.28882 63.546000 Cu 0.478844 0.564907 0 33 63.546 0.233469 -3.24867 63.546000 Cu 0.555074 0.567815 0.5 38 63.546 0.082349 -3.18285 63.546000 Cu 0.461555 0.585116 0.5 58 63.546 0.0220609 -3.26363 63.546000 Cu 0.541023 0.588783 1 59 63.546 0.0717637 -3.22195 63.546000 Cu 0.630742 0.571012 1 36 63.546 0.180303 -3.20585 63.546000 Cu 0.721379 0.554863 1 39 63.546 0.982935 -3.10502 63.546000 Cu 0.796217 0.577833 1 40 63.546 0.0516763 -3.29395 63.546000 Cu 0.712254 0.574253 0.5 42 63.546 0.0961372 -3.28484 63.546000 Cu 0.620836 0.591664 0.5 61 63.546 0.0166089 -3.25378 63.546000 Cu 0.701584 0.594456 1 63 63.546 0.0177599 -3.29367 63.546000 Cu 0.783279 0.597678 0.5 65 63.546 0.0317248 -3.30328 63.546000 Cu 0.810214 0.558994 0.5 41 63.546 0.0850642 -3.22289 63.546000 Cu 0.895154 0.561918 1 43 63.546 0.122442 -3.28839 63.546000 Cu 0.961555 0.585116 1 44 63.546 0.0220609 -3.26363 63.546000 Cu 0.978844 0.564907 0.5 45 63.546 0.233469 -3.24867 63.546000 Cu 0.880607 0.581484 0.5 46 63.546 0.039734 -3.28882 63.546000 Cu 0.0274386 0.6088 1 71 63.546 0.0128716 -3.25688 63.546000 Cu 0.0953555 0.632107 2.74127e-17 72 63.546 0.00364123 -3.27226 63.546000 Cu 0.108889 0.611978 0.5 73 63.546 0.0121651 -3.26435 63.546000 Cu 0.0137478 0.628733 0.5 74 63.546 0.00106053 -3.27352 63.546000 Cu 0.189647 0.614935 1 75 63.546 0.00496795 -3.27865 63.546000 Cu 0.176399 0.635355 0.5 78 63.546 0.00312818 -3.27047 63.546000 Cu 3.1065e-05 0.648781 1 95 63.546 0.000704891 -3.27917 63.546000 Cu 0.364826 0.601333 0.5 56 63.546 0.0119585 -3.28719 63.546000 Cu 0.256914 0.638571 3.40296e-17 76 63.546 0.000524048 -3.27197 63.546000 Cu 0.27009 0.618093 0.5 77 63.546 0.00486703 -3.2846 63.546000 Cu 0.350726 0.62155 1 79 63.546 0.00672582 -3.28046 63.546000 Cu 0.337502 0.641896 0.5 81 63.546 0.00156809 -3.27619 63.546000 Cu 0.446093 0.605202 0 57 63.546 0.00586915 -3.26306 63.546000 Cu 0.527439 0.6088 0.5 62 63.546 0.0128716 -3.25688 63.546000 Cu 0.418593 0.645315 1.19576e-16 80 63.546 0.00181523 -3.27956 63.546000 Cu 0.431965 0.625168 0.5 82 63.546 0.00375423 -3.27515 63.546000 Cu 0.513748 0.628733 1 83 63.546 0.00106053 -3.27352 63.546000 Cu 0.595356 0.632107 0.5 85 63.546 0.00364123 -3.27226 63.546000 Cu 0.500031 0.648781 0.5 86 63.546 0.000704891 -3.27917 63.546000 Cu 0.608889 0.611978 1 60 63.546 0.0121651 -3.26435 63.546000 Cu 0.77009 0.618093 1 64 63.546 0.00486703 -3.2846 63.546000 Cu 0.689647 0.614935 0.5 66 63.546 0.00496795 -3.27865 63.546000 Cu 0.676399 0.635355 1 87 63.546 0.00312818 -3.27047 63.546000 Cu 0.756914 0.638571 0.5 89 63.546 0.000524048 -3.27197 63.546000 Cu 0.864826 0.601333 1 67 63.546 0.0119585 -3.28719 63.546000 Cu 0.931965 0.625168 1 68 63.546 0.00375423 -3.27515 63.546000 Cu 0.946093 0.605202 0.5 69 63.546 0.00586915 -3.26306 63.546000 Cu 0.850726 0.62155 0.5 70 63.546 0.00672582 -3.28046 63.546000 Cu 0.837502 0.641896 1 91 63.546 0.00156809 -3.27619 63.546000 Cu 0.918593 0.645315 0.5 93 63.546 0.00181523 -3.27956 63.546000 Cu 0.0677816 0.672404 4.72633e-19 96 63.546 0.000117858 -3.27613 63.546000 Cu 0.0815032 0.652237 0.5 97 63.546 0.000489758 -3.27539 63.546000 Cu 0.162696 0.655619 1 99 63.546 0.00102655 -3.27052 63.546000 Cu 0.148982 0.675833 0.5 102 63.546 0.000177418 -3.27274 63.546000 Cu 0.0541846 0.692627 0.5 121 63.546 0.000126407 -3.27587 63.546000 Cu 0.135361 0.696036 1.20049e-16 123 63.546 2.43394e-05 -3.27448 63.546000 Cu 0.230078 0.679201 1.20994e-16 100 63.546 0.000274505 -3.27114 63.546000 Cu 0.24357 0.65894 0.5 101 63.546 0.000666184 -3.26959 63.546000 Cu 0.324405 0.662233 0 103 63.546 0.00017645 -3.2732 63.546000 Cu 0.392047 0.68586 1 104 63.546 5.86735e-05 -3.27494 63.546000 Cu 0.311069 0.682534 0.5 106 63.546 0.000121431 -3.27227 63.546000 Cu 0.216515 0.699432 0.5 125 63.546 7.33337e-05 -3.27307 63.546000 Cu 0.581503 0.652237 3.3557e-17 84 63.546 0.000489758 -3.27539 63.546000 Cu 0.405363 0.665572 0.5 105 63.546 0.000424881 -3.27671 63.546000 Cu 0.486515 0.668967 1.31392e-16 107 63.546 0.000507785 -3.27804 63.546000 Cu 0.554185 0.692627 3.40296e-17 108 63.546 0.000126407 -3.27587 63.546000 Cu 0.567782 0.672404 0.5 109 63.546 0.000117858 -3.27613 63.546000 Cu 0.473084 0.689226 0.5 110 63.546 0.000133929 -3.27635 63.546000 Cu 0.74357 0.65894 1.19576e-16 88 63.546 0.000666184 -3.26959 63.546000 Cu 0.662696 0.655619 0.5 90 63.546 0.00102655 -3.27052 63.546000 Cu 0.648982 0.675833 3.40296e-17 111 63.546 0.000177418 -3.27274 63.546000 Cu 0.716515 0.699432 1.01616e-16 112 63.546 7.33337e-05 -3.27307 63.546000 Cu 0.730078 0.679201 0.5 113 63.546 0.000274505 -3.27114 63.546000 Cu 0.635361 0.696036 0.5 114 63.546 2.43394e-05 -3.27448 63.546000 Cu 0.905363 0.665572 2.39625e-16 92 63.546 0.000424881 -3.27671 63.546000 Cu 0.824405 0.662233 0.5 94 63.546 0.00017645 -3.2732 63.546000 Cu 0.986515 0.668967 0.5 98 63.546 0.000507785 -3.27804 63.546000 Cu 0.811069 0.682534 1.21939e-16 115 63.546 0.000121431 -3.27227 63.546000 Cu 0.892047 0.68586 0.5 117 63.546 5.86735e-05 -3.27494 63.546000 Cu 0.973084 0.689226 1 119 63.546 0.000133929 -3.27635 63.546000 Cu 0.0406896 0.71288 1 120 63.546 3.31219e-05 -3.27509 63.546000 Cu 0.121801 0.71627 0.5 126 63.546 2.60483e-05 -3.27518 63.546000 Cu 0.0272191 0.733141 0.5 145 63.546 3.84886e-06 -3.27444 63.546000 Cu 0.108284 0.736522 1.37064e-17 147 63.546 4.39181e-06 -3.27486 63.546000 Cu 0.189367 0.739907 0.5 149 63.546 1.05916e-05 -3.27495 63.546000 Cu 0.202913 0.719658 1 124 63.546 1.24255e-05 -3.27462 63.546000 Cu 0.297589 0.702789 1 127 63.546 6.67714e-05 -3.27284 63.546000 Cu 0.365087 0.726402 2.88306e-17 128 63.546 8.22026e-06 -3.27347 63.546000 Cu 0.378611 0.706145 0.5 129 63.546 3.32369e-05 -3.2738 63.546000 Cu 0.284024 0.723041 0.5 130 63.546 2.18664e-05 -3.27399 63.546000 Cu 0.270473 0.743283 1 151 63.546 8.10974e-06 -3.27444 63.546000 Cu 0.351581 0.746654 0.5 153 63.546 4.62652e-06 -3.27415 63.546000 Cu 0.459646 0.709506 1.7771e-16 131 63.546 1.76967e-05 -3.27454 63.546000 Cu 0.527219 0.733141 2.17411e-17 132 63.546 3.84886e-06 -3.27444 63.546000 Cu 0.54069 0.71288 0.5 133 63.546 3.31219e-05 -3.27509 63.546000 Cu 0.446137 0.729766 0.5 134 63.546 7.17528e-06 -3.27383 63.546000 Cu 0.797589 0.702789 0.5 118 63.546 6.67714e-05 -3.27284 63.546000 Cu 0.621801 0.71627 1 135 63.546 2.60483e-05 -3.27518 63.546000 Cu 0.689367 0.739907 1 136 63.546 1.05916e-05 -3.27495 63.546000 Cu 0.702913 0.719658 0.5 137 63.546 1.24255e-05 -3.27462 63.546000 Cu 0.608284 0.736522 0.5 138 63.546 4.39181e-06 -3.27486 63.546000 Cu 0.784024 0.723041 1.20049e-16 139 63.546 2.18664e-05 -3.27399 63.546000 Cu 0.770473 0.743283 0.5 142 63.546 8.10974e-06 -3.27444 63.546000 Cu 0.878611 0.706145 0 116 63.546 3.32369e-05 -3.2738 63.546000 Cu 0.959646 0.709506 0.5 122 63.546 1.76967e-05 -3.27454 63.546000 Cu 0.851581 0.746654 1 140 63.546 4.62652e-06 -3.27415 63.546000 Cu 0.865087 0.726402 0.5 141 63.546 8.22026e-06 -3.27347 63.546000 Cu 0.946137 0.729766 0 143 63.546 7.17528e-06 -3.27383 63.546000 Cu 0.0137144 0.753398 1 144 63.546 4.262e-06 -3.27406 63.546000 Cu 0.175883 0.760155 3.40296e-17 148 63.546 4.69239e-06 -3.27456 63.546000 Cu 0.0947799 0.756775 0.5 150 63.546 9.38591e-06 -3.27428 63.546000 Cu 0.0813133 0.77702 3.40296e-17 171 63.546 4.52875e-06 -3.27376 63.546000 Cu 0.162405 0.780393 0.5 173 63.546 1.88134e-06 -3.27393 63.546000 Cu 0.0678524 0.797255 0.5 174 63.546 8.01783e-06 -3.27333 63.546000 Cu 0.000247938 0.773647 0.5 169 63.546 9.10725e-06 -3.27382 63.546000 Cu 0.338089 0.766898 3.40296e-17 152 63.546 3.76528e-06 -3.27441 63.546000 Cu 0.256988 0.763529 0.5 154 63.546 1.78587e-06 -3.2746 63.546000 Cu 0.243504 0.783771 1 175 63.546 4.57021e-06 -3.27436 63.546000 Cu 0.324583 0.787148 0.5 177 63.546 1.18417e-05 -3.27411 63.546000 Cu 0.432669 0.750023 2.12685e-17 156 63.546 4.56175e-06 -3.27422 63.546000 Cu 0.419173 0.770274 0.5 155 63.546 7.80515e-06 -3.27403 63.546000 Cu 0.500248 0.773647 3.40296e-17 157 63.546 9.10725e-06 -3.27382 63.546000 Cu 0.513714 0.753398 0.5 158 63.546 4.262e-06 -3.27406 63.546000 Cu 0.59478 0.756775 9.97257e-17 159 63.546 9.38591e-06 -3.27428 63.546000 Cu 0.581313 0.77702 0.5 162 63.546 4.52875e-06 -3.27376 63.546000 Cu 0.405644 0.79051 3.40296e-17 179 63.546 1.95933e-05 -3.27365 63.546000 Cu 0.486747 0.793884 0.5 182 63.546 2.89082e-06 -3.27339 63.546000 Cu 0.567852 0.797255 3.40296e-17 183 63.546 8.01783e-06 -3.27333 63.546000 Cu 0.662405 0.780393 3.40296e-17 160 63.546 1.88134e-06 -3.27393 63.546000 Cu 0.675883 0.760155 0.5 161 63.546 4.69239e-06 -3.27456 63.546000 Cu 0.756988 0.763529 1 163 63.546 1.78587e-06 -3.2746 63.546000 Cu 0.743504 0.783771 0.5 166 63.546 4.57021e-06 -3.27436 63.546000 Cu 0.932669 0.750023 0.5 146 63.546 4.56175e-06 -3.27422 63.546000 Cu 0.824583 0.787148 1 164 63.546 1.18417e-05 -3.27411 63.546000 Cu 0.838089 0.766898 0.5 165 63.546 3.76528e-06 -3.27441 63.546000 Cu 0.919173 0.770274 0 167 63.546 7.80515e-06 -3.27403 63.546000 Cu 0.986747 0.793884 1 168 63.546 2.89082e-06 -3.27339 63.546000 Cu 0.905644 0.79051 0.5 170 63.546 1.95933e-05 -3.27365 63.546000 Cu 0.148932 0.800627 1.62586e-16 172 63.546 8.77287e-06 -3.27355 63.546000 Cu 0.054321 0.817488 3.40296e-17 195 63.546 2.22608e-05 -3.27357 63.546000 Cu 0.121895 0.841102 3.40296e-17 196 63.546 4.51542e-05 -3.2737 63.546000 Cu 0.135395 0.820864 0.5 197 63.546 1.20472e-05 -3.27348 63.546000 Cu 0.0408384 0.83774 0.5 198 63.546 3.28316e-05 -3.27426 63.546000 Cu 0.31111 0.807384 3.40296e-17 176 63.546 1.88488e-05 -3.2741 63.546000 Cu 0.230006 0.804007 0.5 178 63.546 7.94291e-06 -3.27396 63.546000 Cu 0.392202 0.81075 0.5 180 63.546 4.36649e-06 -3.27414 63.546000 Cu 0.216484 0.824228 1.19104e-16 199 63.546 2.28653e-05 -3.27367 63.546000 Cu 0.284109 0.847813 1.19576e-16 200 63.546 5.5533e-05 -3.27346 63.546000 Cu 0.297658 0.827606 0.5 201 63.546 2.90247e-05 -3.27425 63.546000 Cu 0.202973 0.844452 0.5 202 63.546 6.31881e-05 -3.27314 63.546000 Cu 0.378778 0.830991 3.40296e-17 203 63.546 6.25113e-05 -3.27468 63.546000 Cu 0.473282 0.814112 1 181 63.546 3.37928e-05 -3.27377 63.546000 Cu 0.554321 0.817488 0.5 186 63.546 2.22608e-05 -3.27357 63.546000 Cu 0.459843 0.83437 0.5 206 63.546 2.89936e-05 -3.27465 63.546000 Cu 0.540838 0.83774 4.72633e-19 207 63.546 3.28316e-05 -3.27426 63.546000 Cu 0.635395 0.820864 1 184 63.546 1.20472e-05 -3.27348 63.546000 Cu 0.648932 0.800627 0.5 185 63.546 8.77287e-06 -3.27355 63.546000 Cu 0.730006 0.804007 1 187 63.546 7.94291e-06 -3.27396 63.546000 Cu 0.797658 0.827606 0 188 63.546 2.90247e-05 -3.27425 63.546000 Cu 0.716484 0.824228 0.5 190 63.546 2.28653e-05 -3.27367 63.546000 Cu 0.621895 0.841102 0.5 209 63.546 4.51542e-05 -3.2737 63.546000 Cu 0.702973 0.844452 3.11938e-17 211 63.546 6.31881e-05 -3.27314 63.546000 Cu 0.784109 0.847813 0.5 213 63.546 5.5533e-05 -3.27346 63.546000 Cu 0.81111 0.807384 0.5 189 63.546 1.88488e-05 -3.2741 63.546000 Cu 0.892202 0.81075 1 191 63.546 4.36649e-06 -3.27414 63.546000 Cu 0.959843 0.83437 0 192 63.546 2.89936e-05 -3.27465 63.546000 Cu 0.973282 0.814112 0.5 193 63.546 3.37928e-05 -3.27377 63.546000 Cu 0.878778 0.830991 0.5 194 63.546 6.25113e-05 -3.27468 63.546000 Cu 0.0274562 0.858013 0 219 63.546 0.000103559 -3.2756 63.546000 Cu 0.095141 0.881653 0 220 63.546 0.000360335 -3.27728 63.546000 Cu 0.10847 0.861364 0.5 221 63.546 3.3223e-05 -3.27496 63.546000 Cu 0.0140244 0.878274 0.5 222 63.546 0.000559472 -3.27787 63.546000 Cu 0.189488 0.864692 1 223 63.546 0.000140835 -3.27304 63.546000 Cu 0.176145 0.884973 0.5 226 63.546 0.000156994 -3.27386 63.546000 Cu 0.000421249 0.898465 1.19576e-16 243 63.546 0.000699133 -3.27878 63.546000 Cu 0.365267 0.851212 0.5 204 63.546 4.68995e-05 -3.27417 63.546000 Cu 0.257038 0.888276 1 224 63.546 0.000714492 -3.27004 63.546000 Cu 0.270537 0.868026 0.5 225 63.546 0.000285647 -3.27171 63.546000 Cu 0.351653 0.871409 1.19576e-16 227 63.546 0.000138031 -3.27248 63.546000 Cu 0.337924 0.891615 0.5 229 63.546 0.000871463 -3.2703 63.546000 Cu 0.446406 0.854623 1 205 63.546 0.000179533 -3.27515 63.546000 Cu 0.527456 0.858013 0.5 210 63.546 0.000103559 -3.2756 63.546000 Cu 0.419015 0.89502 1 228 63.546 0.000439466 -3.27505 63.546000 Cu 0.432823 0.874844 0.5 230 63.546 0.000148972 -3.27544 63.546000 Cu 0.514024 0.878274 1 231 63.546 0.000559472 -3.27787 63.546000 Cu 0.595141 0.881653 0.5 233 63.546 0.000360335 -3.27728 63.546000 Cu 0.500421 0.898465 0.5 234 63.546 0.000699133 -3.27878 63.546000 Cu 0.60847 0.861364 1 208 63.546 3.3223e-05 -3.27496 63.546000 Cu 0.770537 0.868026 1.18631e-16 212 63.546 0.000285647 -3.27171 63.546000 Cu 0.689488 0.864692 0.5 214 63.546 0.000140835 -3.27304 63.546000 Cu 0.676145 0.884973 3.40296e-17 235 63.546 0.000156994 -3.27386 63.546000 Cu 0.757038 0.888276 0.5 237 63.546 0.000714492 -3.27004 63.546000 Cu 0.865267 0.851212 1 215 63.546 4.68995e-05 -3.27417 63.546000 Cu 0.932823 0.874844 1 216 63.546 0.000148972 -3.27544 63.546000 Cu 0.946406 0.854623 0.5 217 63.546 0.000179533 -3.27515 63.546000 Cu 0.851653 0.871409 0.5 218 63.546 0.000138031 -3.27248 63.546000 Cu 0.837924 0.891615 1.55496e-16 239 63.546 0.000871463 -3.2703 63.546000 Cu 0.919015 0.89502 0.5 241 63.546 0.000439466 -3.27505 63.546000 Cu 0.0685004 0.922042 1 244 63.546 0.00377694 -3.27464 63.546000 Cu 0.0818911 0.901903 0.5 245 63.546 0.00160559 -3.2784 63.546000 Cu 0.163005 0.905306 3.40296e-17 247 63.546 0.00156863 -3.27539 63.546000 Cu 0.149675 0.925645 0.5 250 63.546 0.00573645 -3.28046 63.546000 Cu 0.0543314 0.942051 0.5 269 63.546 0.00658976 -3.26364 63.546000 Cu 0.135427 0.94591 0 271 63.546 0.0113238 -3.28816 63.546000 Cu 0.23028 0.929123 1 248 63.546 0.00436433 -3.28468 63.546000 Cu 0.243595 0.908635 0.5 249 63.546 0.000527613 -3.27203 63.546000 Cu 0.324094 0.911886 0 251 63.546 0.00295902 -3.27087 63.546000 Cu 0.391575 0.935284 1 252 63.546 0.0103729 -3.2648 63.546000 Cu 0.310701 0.932307 0.5 254 63.546 0.00536296 -3.27899 63.546000 Cu 0.216885 0.949558 0.5 273 63.546 0.0303716 -3.30425 63.546000 Cu 0.581891 0.901903 1 232 63.546 0.00160559 -3.2784 63.546000 Cu 0.405111 0.915161 0.5 253 63.546 0.00335159 -3.27304 63.546000 Cu 0.486766 0.91852 1 255 63.546 0.000798364 -3.27393 63.546000 Cu 0.554331 0.942051 3.30843e-18 256 63.546 0.00658976 -3.26364 63.546000 Cu 0.5685 0.922042 0.5 257 63.546 0.00377694 -3.27464 63.546000 Cu 0.473045 0.938472 0.5 258 63.546 0.0114888 -3.25725 63.546000 Cu 0.743595 0.908635 3.40296e-17 236 63.546 0.000527613 -3.27203 63.546000 Cu 0.663005 0.905306 0.5 238 63.546 0.00156863 -3.27539 63.546000 Cu 0.649675 0.925645 2.88306e-17 259 63.546 0.00573645 -3.28046 63.546000 Cu 0.716885 0.949558 0 260 63.546 0.0303716 -3.30425 63.546000 Cu 0.73028 0.929123 0.5 261 63.546 0.00436433 -3.28468 63.546000 Cu 0.635427 0.94591 0.5 262 63.546 0.0113238 -3.28816 63.546000 Cu 0.905111 0.915161 1.92362e-16 240 63.546 0.00335159 -3.27304 63.546000 Cu 0.824094 0.911886 0.5 242 63.546 0.00295902 -3.27087 63.546000 Cu 0.986766 0.91852 0.5 246 63.546 0.000798364 -3.27393 63.546000 Cu 0.810701 0.932307 3.40296e-17 263 63.546 0.00536296 -3.27899 63.546000 Cu 0.891575 0.935284 0.5 265 63.546 0.0103729 -3.2648 63.546000 Cu 0.973045 0.938472 3.40296e-17 267 63.546 0.0114888 -3.25725 63.546000 Cu 0.0387501 0.962175 1 268 63.546 0.0196832 -3.26329 63.546000 Cu 0.119552 0.965808 0.5 274 63.546 0.0409109 -3.28892 63.546000 Cu 0.0211973 0.982391 0.5 292 63.546 0.231322 -3.24799 63.546000 Cu 0.104883 0.985414 1 293 63.546 0.124998 -3.28901 63.546000 Cu 0.189771 0.988304 0.5 294 63.546 0.0860864 -3.2234 63.546000 Cu 0.203837 0.969441 1 272 63.546 0.0521592 -3.29526 63.546000 Cu 0.298603 0.952773 2.36317e-18 275 63.546 0.0157659 -3.2945 63.546000 Cu 0.369258 0.97622 1 276 63.546 0.179203 -3.20756 63.546000 Cu 0.379438 0.955582 0.5 277 63.546 0.0168623 -3.2544 63.546000 Cu 0.28774 0.972988 0.5 278 63.546 0.0914615 -3.28579 63.546000 Cu 0.278539 0.992398 1 295 63.546 0.986845 -3.10562 63.546000 Cu 0.35757 0.997882 0.5 296 63.546 0.903295 -3.07883 63.546000 Cu 0.459301 0.958477 4.39549e-17 279 63.546 0.0719717 -3.22201 63.546000 Cu 0.521197 0.982391 1 280 63.546 0.231322 -3.24799 63.546000 Cu 0.53875 0.962175 0.5 281 63.546 0.0196832 -3.26329 63.546000 Cu 0.444977 0.979442 0.5 282 63.546 0.082968 -3.18373 63.546000 Cu 0.798603 0.952773 0.5 266 63.546 0.0157659 -3.2945 63.546000 Cu 0.619552 0.965808 3.30843e-18 283 63.546 0.0409109 -3.28892 63.546000 Cu 0.689771 0.988304 1.44153e-16 284 63.546 0.0860864 -3.2234 63.546000 Cu 0.703837 0.969441 0.5 285 63.546 0.0521592 -3.29526 63.546000 Cu 0.604883 0.985414 0.5 286 63.546 0.124998 -3.28901 63.546000 Cu 0.78774 0.972988 2.26864e-17 287 63.546 0.0914615 -3.28579 63.546000 Cu 0.778539 0.992398 0.5 290 63.546 0.986845 -3.10562 63.546000 Cu 0.879438 0.955582 1.45571e-16 264 63.546 0.0168623 -3.2544 63.546000 Cu 0.959301 0.958477 0.5 270 63.546 0.0719717 -3.22201 63.546000 Cu 0.85757 0.997882 6.56961e-17 288 63.546 0.903295 -3.07883 63.546000 Cu 0.869258 0.97622 0.5 289 63.546 0.179203 -3.20756 63.546000 Cu 0.944977 0.979442 1 291 63.546 0.082968 -3.18373