Number of particles = 592 A = 1 Angstrom (basic length-scale) H0(1,1) = 21.9651 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 88.2519 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62451 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 0.0857398 0.0134785 1.28746e-16 300 63.546 0.622328 -3.50084 63.546000 Cu 0.166092 0.0134853 0.5 303 63.546 6.4042 -3.2165 63.546000 Cu 0.0909057 0.0333902 0.5 311 63.546 0.452248 -3.48603 63.546000 Cu 0.18079 0.0307102 2.34279e-16 313 63.546 4.17919 -3.42543 63.546000 Cu 0.190592 0.0493252 0.5 316 63.546 0.0494234 -3.50747 63.546000 Cu 0.00369914 0.0134578 0.5 301 63.546 0.351039 -3.51424 63.546000 Cu 0.00847349 0.0342652 5.02539e-17 309 63.546 0.349018 -3.51308 63.546000 Cu 0.263907 0.000155479 0.5 304 63.546 9.19184 -3.2792 63.546000 Cu 0.278003 0.045224 0 314 63.546 0.878483 -3.43835 63.546000 Cu 0.264011 0.0267145 0.5 315 63.546 9.24892 -3.27954 63.546000 Cu 0.334918 0.0132391 6.00654e-17 317 63.546 7.94449 -3.4514 63.546000 Cu 0.358454 0.0397553 0.5 320 63.546 0.94779 -3.40074 63.546000 Cu 0.418073 0.0134546 0.5 319 63.546 1.9712 -3.50312 63.546000 Cu 0.430083 0.0353323 1.22045e-16 318 63.546 0.494027 -3.45876 63.546000 Cu 0.503699 0.0134578 7.17913e-19 321 63.546 0.351039 -3.51424 63.546000 Cu 0.590906 0.0333902 1.67513e-18 322 63.546 0.452248 -3.48603 63.546000 Cu 0.58574 0.0134785 0.5 323 63.546 0.622328 -3.50084 63.546000 Cu 0.508473 0.0342652 0.5 324 63.546 0.349018 -3.51308 63.546000 Cu 0.763907 0.000155479 1 297 63.546 9.19184 -3.2792 63.546000 Cu 0.666092 0.0134853 1 325 63.546 6.4042 -3.2165 63.546000 Cu 0.764011 0.0267145 1 326 63.546 9.24892 -3.27954 63.546000 Cu 0.68079 0.0307102 0.5 328 63.546 4.17919 -3.42543 63.546000 Cu 0.690592 0.0493252 1 349 63.546 0.0494234 -3.50747 63.546000 Cu 0.778003 0.045224 0.5 351 63.546 0.878483 -3.43835 63.546000 Cu 0.918073 0.0134546 0 298 63.546 1.9712 -3.50312 63.546000 Cu 0.834918 0.0132391 0.5 299 63.546 7.94449 -3.4514 63.546000 Cu 0.858454 0.0397553 8.37565e-18 305 63.546 0.94779 -3.40074 63.546000 Cu 0.930083 0.0353323 0.5 307 63.546 0.494027 -3.45876 63.546000 Cu 0.105461 0.0523949 1.22284e-16 310 63.546 0.105507 -3.52196 63.546000 Cu 0.0391852 0.0755701 0 333 63.546 0.0239441 -3.51935 63.546000 Cu 0.135724 0.0918836 1.15823e-16 334 63.546 0.00603548 -3.52668 63.546000 Cu 0.120384 0.0720048 0.5 335 63.546 0.0274398 -3.52671 63.546000 Cu 0.0543617 0.0956552 0.5 336 63.546 0.00435171 -3.52134 63.546000 Cu 0.0224539 0.0552104 0.5 312 63.546 0.187394 -3.5073 63.546000 Cu 0.204339 0.0683819 5.02539e-17 337 63.546 0.0325182 -3.52752 63.546000 Cu 0.217533 0.0882136 0.5 340 63.546 0.0213515 -3.53077 63.546000 Cu 0.299268 0.0848759 7.17913e-17 338 63.546 0.0166389 -3.52933 63.546000 Cu 0.288199 0.0646748 0.5 339 63.546 0.0773945 -3.52607 63.546000 Cu 0.369533 0.0612194 1.17738e-16 341 63.546 0.145289 -3.49823 63.546000 Cu 0.379882 0.0819502 0.5 344 63.546 0.0123477 -3.5192 63.546000 Cu 0.45957 0.0790277 1.22045e-16 342 63.546 0.0493411 -3.50974 63.546000 Cu 0.445865 0.0580506 0.5 343 63.546 0.0802719 -3.48482 63.546000 Cu 0.522454 0.0552104 0 345 63.546 0.187394 -3.5073 63.546000 Cu 0.539185 0.0755701 0.5 348 63.546 0.0239441 -3.51935 63.546000 Cu 0.473113 0.0991835 0.5 369 63.546 0.011931 -3.52033 63.546000 Cu 0.554362 0.0956552 5.02539e-17 371 63.546 0.00435171 -3.52134 63.546000 Cu 0.620384 0.0720048 6.0544e-17 346 63.546 0.0274398 -3.52671 63.546000 Cu 0.605461 0.0523949 0.5 347 63.546 0.105507 -3.52196 63.546000 Cu 0.788199 0.0646748 5.02539e-17 350 63.546 0.0773945 -3.52607 63.546000 Cu 0.704339 0.0683819 0.5 352 63.546 0.0325182 -3.52752 63.546000 Cu 0.635724 0.0918836 0.5 373 63.546 0.00603548 -3.52668 63.546000 Cu 0.717533 0.0882136 4.78609e-19 375 63.546 0.0213515 -3.53077 63.546000 Cu 0.799268 0.0848759 0.5 377 63.546 0.0166389 -3.52933 63.546000 Cu 0.945865 0.0580506 2.46483e-17 306 63.546 0.0802719 -3.48482 63.546000 Cu 0.869533 0.0612194 0.5 308 63.546 0.145289 -3.49823 63.546000 Cu 0.879882 0.0819502 4.78609e-19 329 63.546 0.0123477 -3.5192 63.546000 Cu 0.973113 0.0991835 6.34156e-17 330 63.546 0.011931 -3.52033 63.546000 Cu 0.95957 0.0790277 0.5 331 63.546 0.0493411 -3.50974 63.546000 Cu 0.0684812 0.115621 7.72953e-17 359 63.546 0.00167417 -3.52411 63.546000 Cu 0.163185 0.132245 1.22524e-16 360 63.546 0.0019915 -3.52498 63.546000 Cu 0.149798 0.112 0.5 361 63.546 0.00455047 -3.52557 63.546000 Cu 0.0820591 0.13569 0.5 362 63.546 0.00156382 -3.5255 63.546000 Cu 0.000555814 0.139165 2.65628e-17 356 63.546 0.00029372 -3.52535 63.546000 Cu 0.230694 0.108501 1.22763e-16 363 63.546 0.00606984 -3.52666 63.546000 Cu 0.324384 0.125713 9.5961e-17 364 63.546 0.00225549 -3.52343 63.546000 Cu 0.311304 0.105319 0.5 365 63.546 0.0028361 -3.52506 63.546000 Cu 0.243883 0.128911 0.5 366 63.546 0.000592744 -3.52405 63.546000 Cu 0.392008 0.102336 3.90066e-17 367 63.546 0.00792519 -3.52198 63.546000 Cu 0.257132 0.149247 0 389 63.546 0.000534747 -3.52329 63.546000 Cu 0.337966 0.145972 0.5 391 63.546 0.00164441 -3.52351 63.546000 Cu 0.405332 0.122509 0.5 370 63.546 0.0040185 -3.52374 63.546000 Cu 0.419119 0.142613 5.02539e-17 393 63.546 0.000787282 -3.52445 63.546000 Cu 0.486809 0.119159 1.14866e-16 368 63.546 0.0014018 -3.52398 63.546000 Cu 0.568481 0.115621 0.5 374 63.546 0.00167417 -3.52411 63.546000 Cu 0.500556 0.139165 0.5 395 63.546 0.00029372 -3.52535 63.546000 Cu 0.582059 0.13569 8.256e-17 397 63.546 0.00156382 -3.5255 63.546000 Cu 0.649798 0.112 2.271e-16 372 63.546 0.00455047 -3.52557 63.546000 Cu 0.730694 0.108501 0.5 378 63.546 0.00606984 -3.52666 63.546000 Cu 0.663185 0.132245 0.5 399 63.546 0.0019915 -3.52498 63.546000 Cu 0.743883 0.128911 2.37151e-16 401 63.546 0.000592744 -3.52405 63.546000 Cu 0.757132 0.149247 0.5 402 63.546 0.000534747 -3.52329 63.546000 Cu 0.824384 0.125713 0.5 354 63.546 0.00225549 -3.52343 63.546000 Cu 0.811304 0.105319 1.22284e-16 376 63.546 0.0028361 -3.52506 63.546000 Cu 0.892008 0.102336 0.5 332 63.546 0.00792519 -3.52198 63.546000 Cu 0.837966 0.145972 2.39304e-19 353 63.546 0.00164441 -3.52351 63.546000 Cu 0.905332 0.122509 2.96737e-17 355 63.546 0.0040185 -3.52374 63.546000 Cu 0.986809 0.119159 0.5 357 63.546 0.0014018 -3.52398 63.546000 Cu 0.919119 0.142613 0.5 358 63.546 0.000787282 -3.52445 63.546000 Cu 0.0953998 0.155858 1.22045e-16 385 63.546 0.000718408 -3.52536 63.546000 Cu 0.189701 0.172774 4.78609e-19 386 63.546 7.40847e-05 -3.52418 63.546000 Cu 0.176376 0.152518 0.5 387 63.546 0.0003067 -3.52433 63.546000 Cu 0.108786 0.176082 0.5 388 63.546 0.000149441 -3.52481 63.546000 Cu 0.0411742 0.199632 0.5 407 63.546 8.25108e-05 -3.52472 63.546000 Cu 0.122146 0.196298 5.02539e-17 409 63.546 3.28241e-05 -3.52437 63.546000 Cu 0.0277118 0.179433 7.17913e-19 382 63.546 0.000287098 -3.52509 63.546000 Cu 0.0142169 0.159268 0.5 383 63.546 0.000446382 -3.52543 63.546000 Cu 0.203149 0.192993 0.5 411 63.546 0.00017759 -3.52405 63.546000 Cu 0.351673 0.166125 4.78609e-19 390 63.546 0.000377893 -3.52413 63.546000 Cu 0.270613 0.16948 0.5 392 63.546 0.000512726 -3.52375 63.546000 Cu 0.284191 0.189655 5.02539e-17 413 63.546 0.000281718 -3.52426 63.546000 Cu 0.365335 0.186261 0.5 415 63.546 3.6869e-05 -3.52472 63.546000 Cu 0.514217 0.159268 1.22284e-16 394 63.546 0.000446382 -3.52543 63.546000 Cu 0.43293 0.162703 0.5 396 63.546 0.000100115 -3.52484 63.546000 Cu 0.5954 0.155858 0.5 400 63.546 0.000718408 -3.52536 63.546000 Cu 0.446523 0.182838 1.22284e-16 417 63.546 9.56478e-05 -3.52501 63.546000 Cu 0.541174 0.199632 0 418 63.546 8.25108e-05 -3.52472 63.546000 Cu 0.527712 0.179433 0.5 419 63.546 0.000287098 -3.52509 63.546000 Cu 0.608786 0.176082 1.22045e-16 421 63.546 0.000149441 -3.52481 63.546000 Cu 0.622146 0.196298 0.5 424 63.546 3.28241e-05 -3.52437 63.546000 Cu 0.676376 0.152518 5.02539e-17 398 63.546 0.0003067 -3.52433 63.546000 Cu 0.703149 0.192993 1.22763e-16 422 63.546 0.00017759 -3.52405 63.546000 Cu 0.689701 0.172774 0.5 423 63.546 7.40847e-05 -3.52418 63.546000 Cu 0.770613 0.16948 5.02539e-17 425 63.546 0.000512726 -3.52375 63.546000 Cu 0.784191 0.189655 0.5 426 63.546 0.000281718 -3.52426 63.546000 Cu 0.865335 0.186261 5.02539e-17 379 63.546 3.6869e-05 -3.52472 63.546000 Cu 0.851673 0.166125 0.5 380 63.546 0.000377893 -3.52413 63.546000 Cu 0.93293 0.162703 7.17913e-19 381 63.546 0.000100115 -3.52484 63.546000 Cu 0.946523 0.182838 0.5 384 63.546 9.56478e-05 -3.52501 63.546000 Cu 0.054618 0.219831 1.43583e-18 406 63.546 1.61355e-05 -3.52432 63.546000 Cu 0.135615 0.216498 0.5 412 63.546 2.74315e-05 -3.52433 63.546000 Cu 0.0680301 0.240011 0.5 433 63.546 3.29369e-06 -3.52426 63.546000 Cu 0.149076 0.23668 0 435 63.546 5.70031e-05 -3.5244 63.546000 Cu 0.21665 0.213161 2.39304e-19 410 63.546 0.000104535 -3.52427 63.546000 Cu 0.230184 0.233325 0.5 437 63.546 9.19345e-05 -3.52472 63.546000 Cu 0.378972 0.206393 1.22284e-16 414 63.546 4.846e-05 -3.52476 63.546000 Cu 0.297752 0.209798 0.5 416 63.546 8.92014e-05 -3.5245 63.546000 Cu 0.311358 0.229932 3.97245e-17 439 63.546 2.07691e-05 -3.52477 63.546000 Cu 0.3925 0.226538 0.5 441 63.546 9.06958e-05 -3.52464 63.546000 Cu 0.405978 0.246697 5.02539e-17 440 63.546 8.21143e-05 -3.5245 63.546000 Cu 0.46012 0.202996 0.5 420 63.546 0.000167638 -3.5248 63.546000 Cu 0.473601 0.223173 0 443 63.546 7.06679e-05 -3.52446 63.546000 Cu 0.56803 0.240011 1.22284e-16 444 63.546 3.29369e-06 -3.52426 63.546000 Cu 0.554618 0.219831 0.5 445 63.546 1.61355e-05 -3.52432 63.546000 Cu 0.487003 0.243349 0.5 446 63.546 1.50268e-05 -3.52429 63.546000 Cu 0.635615 0.216498 1.22284e-16 447 63.546 2.74315e-05 -3.52433 63.546000 Cu 0.730184 0.233325 0 448 63.546 9.19345e-05 -3.52472 63.546000 Cu 0.71665 0.213161 0.5 449 63.546 0.000104535 -3.52427 63.546000 Cu 0.649076 0.23668 0.5 450 63.546 5.70031e-05 -3.5244 63.546000 Cu 0.797752 0.209798 0 451 63.546 8.92014e-05 -3.5245 63.546000 Cu 0.811358 0.229932 0.5 452 63.546 2.07691e-05 -3.52477 63.546000 Cu 0.8925 0.226538 0 403 63.546 9.06958e-05 -3.52464 63.546000 Cu 0.878972 0.206393 0.5 404 63.546 4.846e-05 -3.52476 63.546000 Cu 0.96012 0.202996 5.02539e-17 405 63.546 0.000167638 -3.5248 63.546000 Cu 0.973601 0.223173 0.5 408 63.546 7.06679e-05 -3.52446 63.546000 Cu 0.905978 0.246697 0.5 429 63.546 8.21143e-05 -3.5245 63.546000 Cu 0.987003 0.243349 4.78609e-19 431 63.546 1.50268e-05 -3.52429 63.546000 Cu 0.0814263 0.260195 0 432 63.546 3.10123e-05 -3.52447 63.546000 Cu 0.162483 0.256845 0.5 438 63.546 8.95593e-05 -3.52459 63.546000 Cu 0.0948936 0.280369 0.5 459 63.546 6.04191e-05 -3.52446 63.546000 Cu 0.175972 0.277006 0 461 63.546 6.92191e-05 -3.52467 63.546000 Cu 0.189447 0.297144 0.5 464 63.546 3.79003e-05 -3.52458 63.546000 Cu 0.000426753 0.263532 0.5 434 63.546 4.79314e-06 -3.52451 63.546000 Cu 0.013821 0.283715 1.22045e-16 457 63.546 2.79677e-05 -3.52443 63.546000 Cu 0.24367 0.253473 1.22284e-16 436 63.546 2.75183e-05 -3.5248 63.546000 Cu 0.324857 0.250076 0.5 442 63.546 3.77124e-05 -3.52477 63.546000 Cu 0.270626 0.293751 1.21806e-16 462 63.546 7.93319e-05 -3.52461 63.546000 Cu 0.257124 0.273611 0.5 463 63.546 7.19453e-06 -3.52476 63.546000 Cu 0.338299 0.270225 1.22284e-16 465 63.546 7.76526e-05 -3.52456 63.546000 Cu 0.351708 0.290381 0.5 468 63.546 8.72519e-05 -3.52434 63.546000 Cu 0.419413 0.26687 0.5 467 63.546 6.24698e-05 -3.52447 63.546000 Cu 0.432742 0.287047 0 466 63.546 7.73243e-06 -3.5243 63.546000 Cu 0.500427 0.263532 0 469 63.546 4.79314e-06 -3.52451 63.546000 Cu 0.594894 0.280369 4.78609e-19 470 63.546 6.04191e-05 -3.52446 63.546000 Cu 0.581426 0.260195 0.5 471 63.546 3.10123e-05 -3.52447 63.546000 Cu 0.513821 0.283715 0.5 472 63.546 2.79677e-05 -3.52443 63.546000 Cu 0.662483 0.256845 0 473 63.546 8.95593e-05 -3.52459 63.546000 Cu 0.757124 0.273611 7.17913e-19 474 63.546 7.19453e-06 -3.52476 63.546000 Cu 0.74367 0.253473 0.5 475 63.546 2.75183e-05 -3.5248 63.546000 Cu 0.675972 0.277006 0.5 476 63.546 6.92191e-05 -3.52467 63.546000 Cu 0.689447 0.297144 4.78609e-19 497 63.546 3.79003e-05 -3.52458 63.546000 Cu 0.770626 0.293751 0.5 499 63.546 7.93319e-05 -3.52461 63.546000 Cu 0.824857 0.250076 4.78609e-19 427 63.546 3.77124e-05 -3.52477 63.546000 Cu 0.919413 0.26687 4.78609e-19 428 63.546 6.24698e-05 -3.52447 63.546000 Cu 0.838299 0.270225 0.5 430 63.546 7.76526e-05 -3.52456 63.546000 Cu 0.851708 0.290381 5.02539e-17 453 63.546 8.72519e-05 -3.52434 63.546000 Cu 0.932742 0.287047 0.5 455 63.546 7.73243e-06 -3.5243 63.546000 Cu 0.108279 0.300527 0 458 63.546 7.82004e-05 -3.52451 63.546000 Cu 0.0404301 0.324064 4.49892e-17 481 63.546 0.000134801 -3.52488 63.546000 Cu 0.134982 0.340806 5.02539e-17 482 63.546 2.09822e-05 -3.52461 63.546000 Cu 0.121576 0.320668 0.5 483 63.546 6.23966e-05 -3.52479 63.546000 Cu 0.053765 0.34423 0.5 484 63.546 0.000233324 -3.52487 63.546000 Cu 0.0271395 0.303882 0.5 460 63.546 4.64175e-05 -3.5245 63.546000 Cu 0.202822 0.317269 5.02539e-17 485 63.546 3.95547e-05 -3.52466 63.546000 Cu 0.216161 0.337406 0.5 488 63.546 0.000195653 -3.52423 63.546000 Cu 0.297292 0.334057 5.02539e-17 486 63.546 0.000186637 -3.52416 63.546000 Cu 0.284037 0.313898 0.5 487 63.546 0.000187756 -3.52448 63.546000 Cu 0.365104 0.310558 2.77593e-17 489 63.546 8.45586e-05 -3.52433 63.546000 Cu 0.378378 0.330749 0.5 492 63.546 9.8276e-05 -3.52431 63.546000 Cu 0.459382 0.327426 5.98261e-17 490 63.546 9.81594e-05 -3.52463 63.546000 Cu 0.446119 0.307226 0.5 491 63.546 2.803e-05 -3.52438 63.546000 Cu 0.527139 0.303882 2.94344e-17 493 63.546 4.64175e-05 -3.5245 63.546000 Cu 0.54043 0.324064 0.5 496 63.546 0.000134801 -3.52488 63.546000 Cu 0.47256 0.347611 0.5 517 63.546 0.000327454 -3.52495 63.546000 Cu 0.553765 0.34423 3.73315e-17 519 63.546 0.000233324 -3.52487 63.546000 Cu 0.621576 0.320668 5.504e-17 494 63.546 6.23966e-05 -3.52479 63.546000 Cu 0.608279 0.300527 0.5 495 63.546 7.82004e-05 -3.52451 63.546000 Cu 0.784037 0.313898 7.65774e-18 498 63.546 0.000187756 -3.52448 63.546000 Cu 0.702822 0.317269 0.5 500 63.546 3.95547e-05 -3.52466 63.546000 Cu 0.634982 0.340806 0.5 521 63.546 2.09822e-05 -3.52461 63.546000 Cu 0.716161 0.337406 1.67513e-17 523 63.546 0.000195653 -3.52423 63.546000 Cu 0.797292 0.334057 0.5 525 63.546 0.000186637 -3.52416 63.546000 Cu 0.946119 0.307226 0 454 63.546 2.803e-05 -3.52438 63.546000 Cu 0.865104 0.310558 0.5 456 63.546 8.45586e-05 -3.52433 63.546000 Cu 0.878378 0.330749 1.24438e-17 477 63.546 9.8276e-05 -3.52431 63.546000 Cu 0.97256 0.347611 5.02539e-17 478 63.546 0.000327454 -3.52495 63.546000 Cu 0.959382 0.327426 0.5 479 63.546 9.81594e-05 -3.52463 63.546000 Cu 0.067175 0.364338 5.02539e-17 507 63.546 7.41492e-05 -3.52466 63.546000 Cu 0.161837 0.381076 5.02539e-18 508 63.546 0.00124846 -3.52344 63.546000 Cu 0.148457 0.360931 0.5 509 63.546 0.000412735 -3.52396 63.546000 Cu 0.0806632 0.384416 0.5 510 63.546 0.000736093 -3.52443 63.546000 Cu 0.229487 0.357562 5.02539e-17 511 63.546 0.000546932 -3.5237 63.546000 Cu 0.32346 0.374497 0 512 63.546 0.000315945 -3.52443 63.546000 Cu 0.310428 0.354247 0.5 513 63.546 0.000164799 -3.52415 63.546000 Cu 0.242692 0.377792 0.5 514 63.546 0.000341147 -3.52349 63.546000 Cu 0.391426 0.350946 5.02539e-17 515 63.546 0.000118336 -3.52475 63.546000 Cu 0.255741 0.3981 5.02539e-17 537 63.546 0.000574869 -3.52388 63.546000 Cu 0.336468 0.394756 0.5 539 63.546 0.00198157 -3.52479 63.546000 Cu 0.404467 0.371146 0.5 518 63.546 0.00077618 -3.52533 63.546000 Cu 0.417631 0.391297 0 541 63.546 0.00143212 -3.52534 63.546000 Cu 0.485794 0.367756 5.02539e-17 516 63.546 0.000414139 -3.52531 63.546000 Cu 0.567175 0.364338 0.5 522 63.546 7.41492e-05 -3.52466 63.546000 Cu 0.499129 0.387829 0.5 543 63.546 0.000275841 -3.5253 63.546000 Cu 0.580663 0.384416 0 545 63.546 0.000736093 -3.52443 63.546000 Cu 0.648457 0.360931 0 520 63.546 0.000412735 -3.52396 63.546000 Cu 0.729487 0.357562 0.5 526 63.546 0.000546932 -3.5237 63.546000 Cu 0.661837 0.381076 0.5 547 63.546 0.00124846 -3.52344 63.546000 Cu 0.742692 0.377792 5.02539e-17 549 63.546 0.000341147 -3.52349 63.546000 Cu 0.755741 0.3981 0.5 550 63.546 0.000574869 -3.52388 63.546000 Cu 0.82346 0.374497 0.5 502 63.546 0.000315945 -3.52443 63.546000 Cu 0.810428 0.354247 5.02539e-17 524 63.546 0.000164799 -3.52415 63.546000 Cu 0.891426 0.350946 0.5 480 63.546 0.000118336 -3.52475 63.546000 Cu 0.836468 0.394756 5.02539e-17 501 63.546 0.00198157 -3.52479 63.546000 Cu 0.904467 0.371146 5.02539e-17 503 63.546 0.00077618 -3.52533 63.546000 Cu 0.999129 0.387829 5.02539e-17 504 63.546 0.000275841 -3.5253 63.546000 Cu 0.985794 0.367756 0.5 505 63.546 0.000414139 -3.52531 63.546000 Cu 0.917631 0.391297 0.5 506 63.546 0.00143212 -3.52534 63.546000 Cu 0.0941928 0.404496 5.02539e-17 533 63.546 0.00340401 -3.52364 63.546000 Cu 0.188136 0.42166 5.02539e-17 534 63.546 0.00222035 -3.52511 63.546000 Cu 0.175159 0.401307 0.5 535 63.546 0.00166548 -3.52323 63.546000 Cu 0.107423 0.424653 0.5 536 63.546 0.00687359 -3.52204 63.546000 Cu 0.0399512 0.447957 0.5 555 63.546 0.0478627 -3.50953 63.546000 Cu 0.119606 0.445022 0 557 63.546 0.0123553 -3.51935 63.546000 Cu 0.026352 0.427807 5.02539e-17 530 63.546 0.0112679 -3.52012 63.546000 Cu 0.0127084 0.407831 0.5 531 63.546 0.00142678 -3.524 63.546000 Cu 0.200252 0.442076 0.5 559 63.546 0.0159548 -3.52966 63.546000 Cu 0.349742 0.414968 1.17738e-16 538 63.546 0.0042605 -3.52556 63.546000 Cu 0.268774 0.418463 0.5 540 63.546 0.0053633 -3.52666 63.546000 Cu 0.28199 0.438732 5.02539e-17 561 63.546 0.020513 -3.53088 63.546000 Cu 0.36378 0.435065 0.5 563 63.546 0.00583386 -3.52678 63.546000 Cu 0.512708 0.407831 1.31617e-17 542 63.546 0.00142678 -3.524 63.546000 Cu 0.431075 0.411355 0.5 544 63.546 0.0016839 -3.52407 63.546000 Cu 0.594193 0.404496 0.5 548 63.546 0.00340401 -3.52364 63.546000 Cu 0.445173 0.43132 5.02539e-17 565 63.546 0.00442735 -3.52126 63.546000 Cu 0.539951 0.447957 5.02539e-17 566 63.546 0.0478627 -3.50953 63.546000 Cu 0.526352 0.427807 0.5 567 63.546 0.0112679 -3.52012 63.546000 Cu 0.607423 0.424653 5.02539e-17 569 63.546 0.00687359 -3.52204 63.546000 Cu 0.619606 0.445022 0.5 572 63.546 0.0123553 -3.51935 63.546000 Cu 0.675159 0.401307 5.02539e-17 546 63.546 0.00166548 -3.52323 63.546000 Cu 0.700252 0.442076 1.21567e-16 570 63.546 0.0159548 -3.52966 63.546000 Cu 0.688136 0.42166 0.5 571 63.546 0.00222035 -3.52511 63.546000 Cu 0.768774 0.418463 0 573 63.546 0.0053633 -3.52666 63.546000 Cu 0.78199 0.438732 0.5 574 63.546 0.020513 -3.53088 63.546000 Cu 0.86378 0.435065 0 527 63.546 0.00583386 -3.52678 63.546000 Cu 0.849742 0.414968 0.5 528 63.546 0.0042605 -3.52556 63.546000 Cu 0.931075 0.411355 5.02539e-17 529 63.546 0.0016839 -3.52407 63.546000 Cu 0.945173 0.43132 0.5 532 63.546 0.00442735 -3.52126 63.546000 Cu 0.0537975 0.468937 5.02539e-17 554 63.546 0.0756509 -3.48578 63.546000 Cu 0.130121 0.465732 0.5 560 63.546 0.145472 -3.4994 63.546000 Cu 0.0697661 0.49158 0.5 578 63.546 0.463304 -3.4616 63.546000 Cu 0.141488 0.487218 5.02539e-17 579 63.546 0.867824 -3.4078 63.546000 Cu 0.211447 0.462268 2.39304e-19 558 63.546 0.0784884 -3.52686 63.546000 Cu 0.221828 0.481696 0.5 580 63.546 0.821215 -3.44163 63.546000 Cu 0.379231 0.454936 0 562 63.546 0.0268628 -3.52641 63.546000 Cu 0.295294 0.458542 0.5 564 63.546 0.031309 -3.52763 63.546000 Cu 0.309253 0.477597 1.91443e-18 581 63.546 0.0510348 -3.50796 63.546000 Cu 0.394267 0.474564 0.5 583 63.546 0.103034 -3.52211 63.546000 Cu 0.319187 0.496255 0.5 584 63.546 4.17281 -3.42803 63.546000 Cu 0.408924 0.49358 5.02539e-17 582 63.546 0.437804 -3.48523 63.546000 Cu 0.460366 0.4514 0.5 568 63.546 0.0236963 -3.51914 63.546000 Cu 0.477206 0.471752 3.61349e-17 585 63.546 0.181143 -3.50684 63.546000 Cu 0.569766 0.49158 5.02539e-17 586 63.546 0.463304 -3.4616 63.546000 Cu 0.553797 0.468937 0.5 587 63.546 0.0756509 -3.48578 63.546000 Cu 0.491331 0.492693 0.5 588 63.546 0.340703 -3.5126 63.546000 Cu 0.795294 0.458542 1.21088e-16 10 63.546 0.031309 -3.52763 63.546000 Cu 0.630121 0.465732 5.02539e-17 589 63.546 0.145472 -3.4994 63.546000 Cu 0.721828 0.481696 5.02539e-17 590 63.546 0.821215 -3.44163 63.546000 Cu 0.711447 0.462268 0.5 591 63.546 0.0784884 -3.52686 63.546000 Cu 0.641488 0.487218 0.5 592 63.546 0.867824 -3.4078 63.546000 Cu 0.809253 0.477597 0.5 1 63.546 0.0510348 -3.50796 63.546000 Cu 0.894267 0.474564 3.37419e-17 551 63.546 0.103034 -3.52211 63.546000 Cu 0.879231 0.454936 0.5 552 63.546 0.0268628 -3.52641 63.546000 Cu 0.960366 0.4514 5.02539e-17 553 63.546 0.0236963 -3.51914 63.546000 Cu 0.977206 0.471752 0.5 556 63.546 0.181143 -3.50684 63.546000 Cu 0.908924 0.49358 0.5 576 63.546 0.437804 -3.48523 63.546000 Cu 0.991331 0.492693 5.02539e-17 577 63.546 0.340703 -3.5126 63.546000 Cu 0.819187 0.496255 8.45941e-16 575 63.546 4.17281 -3.42803 63.546000 Cu 0.0819869 0.513465 0 5 63.546 1.97065 -3.50315 63.546000 Cu 0.165158 0.513204 0.5 7 63.546 7.96125 -3.45147 63.546000 Cu 0.0699211 0.535341 0.5 29 63.546 0.493688 -3.45858 63.546000 Cu 0.141592 0.539759 5.02539e-17 31 63.546 0.950195 -3.3999 63.546000 Cu 0.236225 0.500137 5.02539e-17 8 63.546 9.18043 -3.27922 63.546000 Cu 0.23595 0.526727 1.43583e-18 9 63.546 9.25811 -3.28021 63.546000 Cu 0.33401 0.513489 1 11 63.546 6.40808 -3.21684 63.546000 Cu 0.319228 0.530716 0.5 14 63.546 4.18399 -3.42564 63.546000 Cu 0.221998 0.545223 0.5 34 63.546 0.882491 -3.43784 63.546000 Cu 0.309395 0.549331 5.02539e-17 35 63.546 0.0495196 -3.50754 63.546000 Cu 0.409094 0.533398 1 12 63.546 0.449487 -3.48584 63.546000 Cu 0.414308 0.51349 0.5 13 63.546 0.620593 -3.50053 63.546000 Cu 0.496375 0.513471 5.02539e-17 15 63.546 0.353176 -3.51424 63.546000 Cu 0.569921 0.535341 0 16 63.546 0.493688 -3.45858 63.546000 Cu 0.491543 0.534276 0.5 18 63.546 0.348717 -3.51282 63.546000 Cu 0.581987 0.513465 0.5 17 63.546 1.97065 -3.50315 63.546000 Cu 0.736225 0.500137 0.5 2 63.546 9.18043 -3.27922 63.546000 Cu 0.665158 0.513204 0 19 63.546 7.96125 -3.45147 63.546000 Cu 0.721998 0.545223 1.20849e-16 20 63.546 0.882491 -3.43784 63.546000 Cu 0.73595 0.526727 0.5 21 63.546 9.25811 -3.28021 63.546000 Cu 0.641592 0.539759 0.5 22 63.546 0.950195 -3.3999 63.546000 Cu 0.996375 0.513471 0.5 6 63.546 0.353176 -3.51424 63.546000 Cu 0.991543 0.534276 5.02539e-17 27 63.546 0.348717 -3.51282 63.546000 Cu 0.914308 0.51349 4.84113e-16 3 63.546 0.620593 -3.50053 63.546000 Cu 0.83401 0.513489 0.5 4 63.546 6.40808 -3.21684 63.546000 Cu 0.819228 0.530716 1.08931e-15 23 63.546 4.18399 -3.42564 63.546000 Cu 0.909094 0.533398 0.5 25 63.546 0.449487 -3.48584 63.546000 Cu 0.809395 0.549331 0.5 26 63.546 0.0495196 -3.50754 63.546000 Cu 0.0540949 0.558055 5.02539e-17 28 63.546 0.079417 -3.48485 63.546000 Cu 0.130444 0.561223 0.5 32 63.546 0.144208 -3.49846 63.546000 Cu 0.0268087 0.599196 0 52 63.546 0.0123042 -3.52036 63.546000 Cu 0.0403735 0.579036 0.5 53 63.546 0.0494609 -3.50969 63.546000 Cu 0.12005 0.581956 1 55 63.546 0.0122031 -3.51918 63.546000 Cu 0.211744 0.564679 2.39304e-19 33 63.546 0.0777918 -3.52627 63.546000 Cu 0.295616 0.568389 0.5 38 63.546 0.0323458 -3.52758 63.546000 Cu 0.200646 0.58488 0.5 58 63.546 0.0168278 -3.52929 63.546000 Cu 0.28238 0.588219 0 59 63.546 0.0216326 -3.53076 63.546000 Cu 0.364185 0.59189 0.5 61 63.546 0.00607781 -3.5267 63.546000 Cu 0.379571 0.572018 5.02539e-17 36 63.546 0.0272493 -3.52668 63.546000 Cu 0.394518 0.552409 0.5 37 63.546 0.105216 -3.52208 63.546000 Cu 0.47753 0.555222 5.02539e-17 39 63.546 0.187659 -3.50711 63.546000 Cu 0.540374 0.579036 0 40 63.546 0.0494609 -3.50969 63.546000 Cu 0.554095 0.558055 0.5 41 63.546 0.079417 -3.48485 63.546000 Cu 0.460791 0.575582 0.5 42 63.546 0.0245287 -3.51929 63.546000 Cu 0.445556 0.595665 0 63 63.546 0.00446139 -3.52141 63.546000 Cu 0.526809 0.599196 0.5 65 63.546 0.0123042 -3.52036 63.546000 Cu 0.630444 0.561223 0 43 63.546 0.144208 -3.49846 63.546000 Cu 0.700646 0.58488 0 44 63.546 0.0168278 -3.52929 63.546000 Cu 0.711744 0.564679 0.5 45 63.546 0.0777918 -3.52627 63.546000 Cu 0.62005 0.581956 0.5 46 63.546 0.0122031 -3.51918 63.546000 Cu 0.795616 0.568389 2.01734e-16 47 63.546 0.0323458 -3.52758 63.546000 Cu 0.78238 0.588219 0.5 50 63.546 0.0216326 -3.53076 63.546000 Cu 0.97753 0.555222 0.5 30 63.546 0.187659 -3.50711 63.546000 Cu 0.894518 0.552409 1.20131e-16 24 63.546 0.105216 -3.52208 63.546000 Cu 0.864185 0.59189 1.21567e-16 48 63.546 0.00607781 -3.5267 63.546000 Cu 0.879571 0.572018 0.5 49 63.546 0.0272493 -3.52668 63.546000 Cu 0.960791 0.575582 5.02539e-17 51 63.546 0.0245287 -3.51929 63.546000 Cu 0.945556 0.595665 0.5 54 63.546 0.00446139 -3.52141 63.546000 Cu 0.107912 0.602343 0.5 56 63.546 0.00803496 -3.52197 63.546000 Cu 0.0130806 0.619169 0.5 77 63.546 0.0014757 -3.524 63.546000 Cu 0.0945547 0.622522 5.02539e-17 79 63.546 0.00421214 -3.52372 63.546000 Cu 0.161891 0.645982 5.02539e-17 80 63.546 0.00171124 -3.52345 63.546000 Cu 0.0807468 0.642622 0.5 81 63.546 0.000836996 -3.52442 63.546000 Cu 0.188588 0.605324 5.02539e-17 57 63.546 0.00286233 -3.52504 63.546000 Cu 0.175479 0.625721 0.5 82 63.546 0.00219631 -3.52343 63.546000 Cu 0.35006 0.612003 5.02539e-17 60 63.546 0.00483862 -3.52559 63.546000 Cu 0.269179 0.608506 0.5 62 63.546 0.00610882 -3.52666 63.546000 Cu 0.255974 0.628916 9.81148e-18 83 63.546 0.000593805 -3.52405 63.546000 Cu 0.336664 0.632244 0.5 85 63.546 0.00211745 -3.52496 63.546000 Cu 0.242731 0.64925 0.5 86 63.546 0.000524395 -3.52327 63.546000 Cu 0.513081 0.619169 0 64 63.546 0.0014757 -3.524 63.546000 Cu 0.431395 0.615629 0.5 66 63.546 0.00170358 -3.52413 63.546000 Cu 0.4178 0.635688 5.02539e-17 87 63.546 0.00167804 -3.52551 63.546000 Cu 0.499305 0.639172 0.5 89 63.546 0.000284275 -3.52534 63.546000 Cu 0.594555 0.622522 0.5 70 63.546 0.00421214 -3.52372 63.546000 Cu 0.580747 0.642622 0 91 63.546 0.000836996 -3.52442 63.546000 Cu 0.607912 0.602343 5.02539e-17 67 63.546 0.00803496 -3.52197 63.546000 Cu 0.675479 0.625721 5.02539e-17 68 63.546 0.00219631 -3.52343 63.546000 Cu 0.688588 0.605324 0.5 69 63.546 0.00286233 -3.52504 63.546000 Cu 0.755974 0.628916 0.5 74 63.546 0.000593805 -3.52405 63.546000 Cu 0.661891 0.645982 0.5 93 63.546 0.00171124 -3.52345 63.546000 Cu 0.742731 0.64925 0 95 63.546 0.000524395 -3.52327 63.546000 Cu 0.769179 0.608506 5.02539e-17 71 63.546 0.00610882 -3.52666 63.546000 Cu 0.999305 0.639172 0 76 63.546 0.000284275 -3.52534 63.546000 Cu 0.836664 0.632244 5.02539e-17 72 63.546 0.00211745 -3.52496 63.546000 Cu 0.85006 0.612003 0.5 73 63.546 0.00483862 -3.52559 63.546000 Cu 0.931395 0.615629 1.21567e-16 75 63.546 0.00170358 -3.52413 63.546000 Cu 0.9178 0.635688 0.5 78 63.546 0.00167804 -3.52551 63.546000 Cu 0.0669338 0.662708 3.82887e-17 103 63.546 0.000109203 -3.52483 63.546000 Cu 0.13457 0.68626 2.4409e-17 104 63.546 3.93478e-05 -3.52476 63.546000 Cu 0.148219 0.666128 0.5 105 63.546 0.000412621 -3.52409 63.546000 Cu 0.0533689 0.682833 0.5 106 63.546 0.000128511 -3.525 63.546000 Cu 0.323477 0.652517 8.27993e-17 84 63.546 0.000311344 -3.52434 63.546000 Cu 0.229276 0.669481 0 107 63.546 0.000535523 -3.52373 63.546000 Cu 0.296773 0.692992 7.41843e-18 108 63.546 0.000187052 -3.52407 63.546000 Cu 0.310183 0.672776 0.5 109 63.546 8.59967e-05 -3.52415 63.546000 Cu 0.215728 0.689656 0.5 110 63.546 0.000311237 -3.52429 63.546000 Cu 0.391085 0.676081 2.39304e-19 111 63.546 0.000172938 -3.52476 63.546000 Cu 0.377798 0.696296 0.5 114 63.546 4.28099e-05 -3.52435 63.546000 Cu 0.485625 0.659267 0 88 63.546 0.00053553 -3.52545 63.546000 Cu 0.404442 0.655857 0.5 90 63.546 0.000782907 -3.5254 63.546000 Cu 0.566934 0.662708 0.5 94 63.546 0.000109203 -3.52483 63.546000 Cu 0.458769 0.699626 5.02539e-17 112 63.546 9.11125e-05 -3.52468 63.546000 Cu 0.472164 0.67943 0.5 113 63.546 0.000327214 -3.52506 63.546000 Cu 0.553369 0.682833 5.02539e-17 115 63.546 0.000128511 -3.525 63.546000 Cu 0.648219 0.666128 0 92 63.546 0.000412621 -3.52409 63.546000 Cu 0.729276 0.669481 0.5 98 63.546 0.000535523 -3.52373 63.546000 Cu 0.63457 0.68626 0.5 117 63.546 3.93478e-05 -3.52476 63.546000 Cu 0.715728 0.689656 5.02539e-17 119 63.546 0.000311237 -3.52429 63.546000 Cu 0.796773 0.692992 0.5 121 63.546 0.000187052 -3.52407 63.546000 Cu 0.972164 0.67943 0 100 63.546 0.000327214 -3.52506 63.546000 Cu 0.985625 0.659267 0.5 101 63.546 0.00053553 -3.52545 63.546000 Cu 0.810183 0.672776 5.02539e-17 96 63.546 8.59967e-05 -3.52415 63.546000 Cu 0.823477 0.652517 0.5 97 63.546 0.000311344 -3.52434 63.546000 Cu 0.904442 0.655857 0 99 63.546 0.000782907 -3.5254 63.546000 Cu 0.891085 0.676081 0.5 102 63.546 0.000172938 -3.52476 63.546000 Cu 0.877798 0.696296 0 123 63.546 4.28099e-05 -3.52435 63.546000 Cu 0.958769 0.699626 0.5 125 63.546 9.11125e-05 -3.52468 63.546000 Cu 0.039813 0.702991 0 127 63.546 0.000187724 -3.52479 63.546000 Cu 0.107498 0.72653 0 128 63.546 0.000102963 -3.52461 63.546000 Cu 0.12096 0.706389 0.5 129 63.546 7.46734e-05 -3.52472 63.546000 Cu 0.0263876 0.723167 0.5 130 63.546 7.40594e-05 -3.52444 63.546000 Cu 0.0130339 0.743345 0 151 63.546 1.52501e-05 -3.52437 63.546000 Cu 0.0940662 0.746692 0.5 153 63.546 8.14376e-05 -3.52457 63.546000 Cu 0.188648 0.729923 0.5 134 63.546 1.92326e-05 -3.52473 63.546000 Cu 0.2022 0.709795 6.93982e-18 131 63.546 8.36179e-05 -3.52447 63.546000 Cu 0.269825 0.733317 0 132 63.546 7.04611e-05 -3.52467 63.546000 Cu 0.283335 0.71316 0.5 133 63.546 0.000133041 -3.52427 63.546000 Cu 0.364374 0.716495 5.02539e-17 135 63.546 3.83778e-05 -3.52435 63.546000 Cu 0.350948 0.736677 0.5 138 63.546 6.98519e-05 -3.5244 63.546000 Cu 0.539813 0.702991 0.5 118 63.546 0.000187724 -3.52479 63.546000 Cu 0.432008 0.74001 5.02539e-17 136 63.546 6.49356e-06 -3.52429 63.546000 Cu 0.445364 0.719827 0.5 137 63.546 1.80187e-05 -3.52433 63.546000 Cu 0.526388 0.723167 5.02539e-17 139 63.546 7.40594e-05 -3.52444 63.546000 Cu 0.513034 0.743345 0.5 142 63.546 1.52501e-05 -3.52437 63.546000 Cu 0.594066 0.746692 2.39304e-19 140 63.546 8.14376e-05 -3.52457 63.546000 Cu 0.62096 0.706389 9.57217e-19 116 63.546 7.46734e-05 -3.52472 63.546000 Cu 0.7022 0.709795 0.5 122 63.546 8.36179e-05 -3.52447 63.546000 Cu 0.607498 0.72653 0.5 141 63.546 0.000102963 -3.52461 63.546000 Cu 0.688648 0.729923 5.02539e-17 143 63.546 1.92326e-05 -3.52473 63.546000 Cu 0.783335 0.71316 0 120 63.546 0.000133041 -3.52427 63.546000 Cu 0.769825 0.733317 0.5 145 63.546 7.04611e-05 -3.52467 63.546000 Cu 0.945364 0.719827 0 124 63.546 1.80187e-05 -3.52433 63.546000 Cu 0.864374 0.716495 0.5 126 63.546 3.83778e-05 -3.52435 63.546000 Cu 0.850948 0.736677 0 147 63.546 6.98519e-05 -3.5244 63.546000 Cu 0.932008 0.74001 0.5 149 63.546 6.49356e-06 -3.52429 63.546000 Cu 0.175182 0.750069 2.39304e-19 156 63.546 4.4977e-05 -3.5248 63.546000 Cu 0.0806777 0.76687 5.02539e-17 152 63.546 4.31482e-05 -3.5245 63.546000 Cu 0.161782 0.770222 0.5 155 63.546 7.46926e-05 -3.52456 63.546000 Cu 0.0673816 0.787048 0.5 177 63.546 1.18657e-05 -3.52428 63.546000 Cu 0.14842 0.790383 0 179 63.546 5.84514e-05 -3.52432 63.546000 Cu 0.242953 0.773605 1.67513e-18 157 63.546 8.05376e-06 -3.52473 63.546000 Cu 0.256366 0.753464 0.5 158 63.546 1.81227e-05 -3.52479 63.546000 Cu 0.337557 0.756837 5.02539e-17 159 63.546 6.53157e-05 -3.52457 63.546000 Cu 0.324094 0.776996 0.5 162 63.546 4.28409e-05 -3.52464 63.546000 Cu 0.229496 0.793749 0.5 182 63.546 7.1109e-05 -3.52461 63.546000 Cu 0.310672 0.797138 7.68167e-17 183 63.546 3.0424e-05 -3.52459 63.546000 Cu 0.405184 0.78036 0 160 63.546 4.81863e-05 -3.52446 63.546000 Cu 0.418639 0.760192 0.5 161 63.546 4.32512e-05 -3.52447 63.546000 Cu 0.499659 0.763533 0 163 63.546 8.96567e-06 -3.52453 63.546000 Cu 0.567382 0.787048 5.02539e-17 164 63.546 1.18657e-05 -3.52428 63.546000 Cu 0.486276 0.783711 0.5 166 63.546 2.67004e-05 -3.5244 63.546000 Cu 0.580678 0.76687 0.5 165 63.546 4.31482e-05 -3.5245 63.546000 Cu 0.675182 0.750069 0.5 146 63.546 4.4977e-05 -3.5248 63.546000 Cu 0.756366 0.753464 5.02539e-17 144 63.546 1.81227e-05 -3.52479 63.546000 Cu 0.661782 0.770222 0 167 63.546 7.46926e-05 -3.52456 63.546000 Cu 0.729496 0.793749 4.54678e-17 168 63.546 7.1109e-05 -3.52461 63.546000 Cu 0.742953 0.773605 0.5 169 63.546 8.05376e-06 -3.52473 63.546000 Cu 0.64842 0.790383 0.5 170 63.546 5.84514e-05 -3.52432 63.546000 Cu 0.999659 0.763533 0.5 154 63.546 8.96567e-06 -3.52453 63.546000 Cu 0.986276 0.783711 0 175 63.546 2.67004e-05 -3.5244 63.546000 Cu 0.918639 0.760192 5.02539e-17 148 63.546 4.32512e-05 -3.52447 63.546000 Cu 0.837557 0.756837 0.5 150 63.546 6.53157e-05 -3.52457 63.546000 Cu 0.824094 0.776996 4.25962e-17 171 63.546 4.28409e-05 -3.52464 63.546000 Cu 0.905184 0.78036 0.5 173 63.546 4.81863e-05 -3.52446 63.546000 Cu 0.810672 0.797138 0.5 174 63.546 3.0424e-05 -3.52459 63.546000 Cu 0.0540089 0.807223 3.37419e-17 176 63.546 4.37031e-05 -3.52436 63.546000 Cu 0.135048 0.810558 0.5 180 63.546 7.11819e-05 -3.5243 63.546000 Cu 0.0276366 0.847611 0 200 63.546 0.000345558 -3.52498 63.546000 Cu 0.0407858 0.827423 0.5 201 63.546 8.35147e-05 -3.52466 63.546000 Cu 0.121789 0.830746 2.39304e-19 203 63.546 0.000111701 -3.52433 63.546000 Cu 0.216126 0.8139 0 181 63.546 0.000140952 -3.52446 63.546000 Cu 0.297336 0.817268 0.5 186 63.546 3.25015e-05 -3.52467 63.546000 Cu 0.202882 0.834058 0.5 206 63.546 0.000191721 -3.52416 63.546000 Cu 0.284022 0.837409 3.03916e-17 207 63.546 0.000168512 -3.52421 63.546000 Cu 0.365205 0.840805 0.5 209 63.546 2.57034e-05 -3.52459 63.546000 Cu 0.378578 0.820666 1.22763e-16 184 63.546 6.0235e-05 -3.52482 63.546000 Cu 0.391836 0.800519 0.5 185 63.546 6.26068e-05 -3.52456 63.546000 Cu 0.472979 0.803876 4.78609e-19 187 63.546 4.10237e-05 -3.52453 63.546000 Cu 0.540786 0.827423 1.22284e-16 188 63.546 8.35147e-05 -3.52466 63.546000 Cu 0.554009 0.807223 0.5 189 63.546 4.37031e-05 -3.52436 63.546000 Cu 0.459732 0.824061 0.5 190 63.546 0.000134715 -3.52492 63.546000 Cu 0.446428 0.844228 0 211 63.546 0.000239196 -3.52488 63.546000 Cu 0.527637 0.847611 0.5 213 63.546 0.000345558 -3.52498 63.546000 Cu 0.635048 0.810558 0 191 63.546 7.11819e-05 -3.5243 63.546000 Cu 0.702882 0.834058 0 192 63.546 0.000191721 -3.52416 63.546000 Cu 0.716126 0.8139 0.5 193 63.546 0.000140952 -3.52446 63.546000 Cu 0.621789 0.830746 0.5 194 63.546 0.000111701 -3.52433 63.546000 Cu 0.797336 0.817268 7.29878e-17 195 63.546 3.25015e-05 -3.52467 63.546000 Cu 0.784022 0.837409 0.5 198 63.546 0.000168512 -3.52421 63.546000 Cu 0.972979 0.803876 0.5 178 63.546 4.10237e-05 -3.52453 63.546000 Cu 0.891836 0.800519 3.82887e-17 172 63.546 6.26068e-05 -3.52456 63.546000 Cu 0.865205 0.840805 9.57217e-19 196 63.546 2.57034e-05 -3.52459 63.546000 Cu 0.878578 0.820666 0.5 197 63.546 6.0235e-05 -3.52482 63.546000 Cu 0.959732 0.824061 5.02539e-17 199 63.546 0.000134715 -3.52492 63.546000 Cu 0.946428 0.844228 0.5 202 63.546 0.000239196 -3.52488 63.546000 Cu 0.108775 0.850946 0.5 204 63.546 0.000120732 -3.52478 63.546000 Cu 0.0010856 0.887826 1 224 63.546 0.000262932 -3.5253 63.546000 Cu 0.0144259 0.867755 0.5 225 63.546 0.000432133 -3.52525 63.546000 Cu 0.0957436 0.871148 4.78609e-19 227 63.546 0.000800367 -3.52528 63.546000 Cu 0.163749 0.894753 8.44744e-17 228 63.546 0.00198161 -3.52478 63.546000 Cu 0.0825798 0.891294 0.5 229 63.546 0.00138791 -3.52531 63.546000 Cu 0.189767 0.85425 1.00747e-16 205 63.546 0.00015382 -3.52419 63.546000 Cu 0.176763 0.874498 0.5 230 63.546 0.00032879 -3.5244 63.546000 Cu 0.351748 0.860931 0 208 63.546 0.000412227 -3.52392 63.546000 Cu 0.270715 0.857564 0.5 210 63.546 0.000546108 -3.52372 63.546000 Cu 0.257529 0.877794 5.02539e-17 231 63.546 0.000312227 -3.52349 63.546000 Cu 0.338397 0.881074 0.5 233 63.546 0.00120755 -3.52341 63.546000 Cu 0.24449 0.898096 0.5 234 63.546 0.000570995 -3.52389 63.546000 Cu 0.514426 0.867755 0 212 63.546 0.000432133 -3.52525 63.546000 Cu 0.433035 0.864335 0.5 214 63.546 7.21401e-05 -3.52463 63.546000 Cu 0.419558 0.884413 0 235 63.546 0.000753654 -3.52441 63.546000 Cu 0.501086 0.887826 0.5 237 63.546 0.000262932 -3.5253 63.546000 Cu 0.595744 0.871148 0.5 218 63.546 0.000800367 -3.52528 63.546000 Cu 0.58258 0.891294 0 239 63.546 0.00138791 -3.52531 63.546000 Cu 0.608775 0.850946 5.02539e-17 215 63.546 0.000120732 -3.52478 63.546000 Cu 0.676763 0.874498 0 216 63.546 0.00032879 -3.5244 63.546000 Cu 0.689767 0.85425 0.5 217 63.546 0.00015382 -3.52419 63.546000 Cu 0.757529 0.877794 0.5 222 63.546 0.000312227 -3.52349 63.546000 Cu 0.663749 0.894753 0.5 241 63.546 0.00198161 -3.52478 63.546000 Cu 0.74449 0.898096 1.22284e-16 243 63.546 0.000570995 -3.52389 63.546000 Cu 0.770715 0.857564 0 219 63.546 0.000546108 -3.52372 63.546000 Cu 0.838397 0.881074 0 220 63.546 0.00120755 -3.52341 63.546000 Cu 0.851748 0.860931 0.5 221 63.546 0.000412227 -3.52392 63.546000 Cu 0.933035 0.864335 5.02539e-17 223 63.546 7.21401e-05 -3.52463 63.546000 Cu 0.919558 0.884413 0.5 226 63.546 0.000753654 -3.52441 63.546000 Cu 0.0691261 0.91135 0 251 63.546 0.00164905 -3.52411 63.546000 Cu 0.136418 0.935062 5.02539e-17 252 63.546 0.00580759 -3.52687 63.546000 Cu 0.150471 0.914963 0.5 253 63.546 0.00426493 -3.52558 63.546000 Cu 0.0550347 0.931315 0.5 254 63.546 0.00455055 -3.52128 63.546000 Cu 0.325073 0.901306 0 232 63.546 0.00154329 -3.52322 63.546000 Cu 0.231424 0.918458 1.19652e-17 255 63.546 0.00516792 -3.52666 63.546000 Cu 0.299891 0.942072 0 256 63.546 0.0157294 -3.52967 63.546000 Cu 0.312061 0.921659 0.5 257 63.546 0.0022378 -3.52506 63.546000 Cu 0.218181 0.938729 0.5 258 63.546 0.020193 -3.53095 63.546000 Cu 0.392751 0.924653 0 259 63.546 0.00685194 -3.52201 63.546000 Cu 0.380551 0.945015 0.5 262 63.546 0.0122941 -3.51943 63.546000 Cu 0.487502 0.907831 4.78609e-19 236 63.546 0.00136958 -3.52406 63.546000 Cu 0.406026 0.904495 0.5 238 63.546 0.00336716 -3.52367 63.546000 Cu 0.569126 0.91135 0.5 242 63.546 0.00164905 -3.52411 63.546000 Cu 0.460234 0.947948 5.02539e-17 260 63.546 0.0480249 -3.50955 63.546000 Cu 0.473845 0.927803 0.5 261 63.546 0.0111694 -3.52011 63.546000 Cu 0.555035 0.931315 2.39304e-19 263 63.546 0.00455055 -3.52128 63.546000 Cu 0.650471 0.914963 1.22284e-16 240 63.546 0.00426493 -3.52558 63.546000 Cu 0.731424 0.918458 0.5 246 63.546 0.00516792 -3.52666 63.546000 Cu 0.636418 0.935062 0.5 265 63.546 0.00580759 -3.52687 63.546000 Cu 0.718181 0.938729 4.45106e-17 267 63.546 0.020193 -3.53095 63.546000 Cu 0.799891 0.942072 0.5 269 63.546 0.0157294 -3.52967 63.546000 Cu 0.973845 0.927803 5.02539e-17 248 63.546 0.0111694 -3.52011 63.546000 Cu 0.987502 0.907831 0.5 249 63.546 0.00136958 -3.52406 63.546000 Cu 0.812061 0.921659 0 244 63.546 0.0022378 -3.52506 63.546000 Cu 0.825073 0.901306 0.5 245 63.546 0.00154329 -3.52322 63.546000 Cu 0.906026 0.904495 5.02539e-17 247 63.546 0.00336716 -3.52367 63.546000 Cu 0.892751 0.924653 0.5 250 63.546 0.00685194 -3.52201 63.546000 Cu 0.880551 0.945015 3.15882e-17 271 63.546 0.0122941 -3.51943 63.546000 Cu 0.960234 0.947948 0.5 273 63.546 0.0480249 -3.50955 63.546000 Cu 0.180951 0.996254 2.42655e-16 302 63.546 4.17784 -3.42829 63.546000 Cu 0.0398052 0.951394 0 275 63.546 0.0236279 -3.51915 63.546000 Cu 0.105895 0.974558 1.22284e-16 276 63.546 0.102731 -3.52196 63.546000 Cu 0.120964 0.954934 0.5 277 63.546 0.02646 -3.52643 63.546000 Cu 0.0229489 0.971743 0.5 278 63.546 0.180983 -3.50659 63.546000 Cu 0.00876091 0.992676 0 295 63.546 0.341939 -3.51245 63.546000 Cu 0.0911778 0.993567 0.5 296 63.546 0.44006 -3.48514 63.546000 Cu 0.1909 0.977597 0.5 282 63.546 0.0505266 -3.50788 63.546000 Cu 0.204868 0.958549 3.42205e-17 279 63.546 0.0321575 -3.52761 63.546000 Cu 0.27833 0.98169 7.56202e-17 280 63.546 0.829403 -3.44197 63.546000 Cu 0.288697 0.962264 0.5 281 63.546 0.07801 -3.52675 63.546000 Cu 0.370001 0.965721 0 283 63.546 0.145084 -3.49937 63.546000 Cu 0.358639 0.987198 0.5 286 63.546 0.874638 -3.40751 63.546000 Cu 0.539805 0.951394 0.5 266 63.546 0.0236279 -3.51915 63.546000 Cu 0.430319 0.991574 0 284 63.546 0.469121 -3.46117 63.546000 Cu 0.446344 0.968923 0.5 285 63.546 0.0765185 -3.48575 63.546000 Cu 0.522949 0.971743 5.02539e-17 287 63.546 0.180983 -3.50659 63.546000 Cu 0.508761 0.992676 0.5 290 63.546 0.341939 -3.51245 63.546000 Cu 0.591178 0.993567 1.74692e-17 288 63.546 0.44006 -3.48514 63.546000 Cu 0.680951 0.996254 0.5 327 63.546 4.17784 -3.42829 63.546000 Cu 0.620964 0.954934 2.39304e-19 264 63.546 0.02646 -3.52643 63.546000 Cu 0.704868 0.958549 0.5 270 63.546 0.0321575 -3.52761 63.546000 Cu 0.605895 0.974558 0.5 289 63.546 0.102731 -3.52196 63.546000 Cu 0.6909 0.977597 1 291 63.546 0.0505266 -3.50788 63.546000 Cu 0.788697 0.962264 4.78609e-19 268 63.546 0.07801 -3.52675 63.546000 Cu 0.77833 0.98169 0.5 292 63.546 0.829403 -3.44197 63.546000 Cu 0.946344 0.968923 5.02539e-17 272 63.546 0.0765185 -3.48575 63.546000 Cu 0.870001 0.965721 0.5 274 63.546 0.145084 -3.49937 63.546000 Cu 0.858639 0.987198 1.22763e-16 293 63.546 0.874638 -3.40751 63.546000 Cu 0.930319 0.991574 0.5 294 63.546 0.469121 -3.46117