Number of particles = 648 A = 1 Angstrom (basic length-scale) H0(1,1) = 23.0985 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.4013 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60738 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 0.0500516 0.00148332 9.60898e-17 332 63.546 0.118075 -8.26026 63.546000 Cu 0.0442716 0.0293983 3.58905e-17 337 63.546 0.0343984 -8.23347 63.546000 Cu 0.104124 0.0156254 0.5 339 63.546 0.103984 -8.2254 63.546000 Cu 0.162983 0.00159485 1.04578e-16 341 63.546 0.364036 -8.12027 63.546000 Cu 0.214647 0.0172774 0.5 343 63.546 0.33167 -8.06072 63.546000 Cu 0.154176 0.0305226 6.77279e-17 338 63.546 0.105945 -8.18707 63.546000 Cu 0.277634 0.00486358 5.59834e-17 342 63.546 7.49906 -6.4067 63.546000 Cu 0.321216 0.0236675 0.5 357 63.546 5.68455 -7.51327 63.546000 Cu 0.384142 0.0144772 1 359 63.546 7.94023 -7.13064 63.546000 Cu 0.493203 0.0153422 1.00248e-17 360 63.546 0.101566 -8.25459 63.546000 Cu 0.438971 0.00179808 0.5 361 63.546 4.14691 -7.70447 63.546000 Cu 0.433418 0.0285559 0.5 362 63.546 0.189849 -8.21958 63.546000 Cu 0.550052 0.00148332 0.5 363 63.546 0.118075 -8.26026 63.546000 Cu 0.544272 0.0293983 0.5 383 63.546 0.0343984 -8.23347 63.546000 Cu 0.604124 0.0156254 3.06514e-17 385 63.546 0.103984 -8.2254 63.546000 Cu 0.714647 0.0172774 1.75207e-17 386 63.546 0.33167 -8.06072 63.546000 Cu 0.662983 0.00159485 0.5 387 63.546 0.364036 -8.12027 63.546000 Cu 0.654176 0.0305226 0.5 388 63.546 0.105945 -8.18707 63.546000 Cu 0.777634 0.00486358 0.5 389 63.546 7.49906 -6.4067 63.546000 Cu 0.821216 0.0236675 5.33261e-17 419 63.546 5.68455 -7.51327 63.546000 Cu 0.938971 0.00179808 6.5893e-17 331 63.546 4.14691 -7.70447 63.546000 Cu 0.993203 0.0153422 0.5 333 63.546 0.101566 -8.25459 63.546000 Cu 0.933418 0.0285559 0 420 63.546 0.189849 -8.21958 63.546000 Cu 0.884142 0.0144772 0.5 421 63.546 7.94023 -7.13064 63.546000 Cu 0.0321672 0.0571442 1.27087e-17 334 63.546 0.00723152 -8.23722 63.546000 Cu 0.0934705 0.0439016 0.5 340 63.546 0.0315409 -8.22247 63.546000 Cu 0.141859 0.0591014 3.79094e-17 351 63.546 0.0363395 -8.22564 63.546000 Cu 0.202278 0.0465088 0.5 353 63.546 0.0575275 -8.17806 63.546000 Cu 0.262206 0.0345467 1.08107e-17 355 63.546 0.0892775 -8.07221 63.546000 Cu 0.371265 0.0407193 7.52006e-18 356 63.546 0.286893 -8.1404 63.546000 Cu 0.310646 0.0513187 0.5 358 63.546 0.0301115 -8.21022 63.546000 Cu 0.421229 0.0554856 0.5 379 63.546 0.0669859 -8.25351 63.546000 Cu 0.483232 0.0427516 7.52006e-18 381 63.546 0.0214758 -8.23063 63.546000 Cu 0.593471 0.0439016 0 382 63.546 0.0315409 -8.22247 63.546000 Cu 0.532167 0.0571442 0.5 384 63.546 0.00723152 -8.23722 63.546000 Cu 0.641859 0.0591014 0.5 413 63.546 0.0363395 -8.22564 63.546000 Cu 0.702278 0.0465088 1.1292e-16 415 63.546 0.0575275 -8.17806 63.546000 Cu 0.810646 0.0513187 0 416 63.546 0.0301115 -8.21022 63.546000 Cu 0.762206 0.0345467 0.5 417 63.546 0.0892775 -8.07221 63.546000 Cu 0.871265 0.0407193 0.5 422 63.546 0.286893 -8.1404 63.546000 Cu 0.983232 0.0427516 0.5 335 63.546 0.0214758 -8.23063 63.546000 Cu 0.921229 0.0554856 0 455 63.546 0.0669859 -8.25351 63.546000 Cu 0.019274 0.0848648 0 347 63.546 0.00243257 -8.25547 63.546000 Cu 0.0807266 0.0719891 0.5 349 63.546 0.0120686 -8.24256 63.546000 Cu 0.128838 0.0872502 0 348 63.546 0.0135225 -8.25062 63.546000 Cu 0.189729 0.0748282 0.5 354 63.546 0.0186712 -8.24053 63.546000 Cu 0.237837 0.0907342 3.89721e-17 373 63.546 0.00408352 -8.25468 63.546000 Cu 0.250236 0.0628209 7.52006e-18 352 63.546 0.0131134 -8.22375 63.546000 Cu 0.298565 0.0789525 0.5 375 63.546 0.00781286 -8.25494 63.546000 Cu 0.359717 0.0673912 0 377 63.546 0.0498794 -8.24503 63.546000 Cu 0.470465 0.0700914 9.77694e-18 378 63.546 0.0101508 -8.25539 63.546000 Cu 0.408836 0.0825685 0.5 380 63.546 0.0189949 -8.26741 63.546000 Cu 0.519274 0.0848648 0.5 409 63.546 0.00243257 -8.25547 63.546000 Cu 0.580727 0.0719891 9.10499e-17 411 63.546 0.0120686 -8.24256 63.546000 Cu 0.689729 0.0748282 0 412 63.546 0.0186712 -8.24053 63.546000 Cu 0.628838 0.0872502 0.5 414 63.546 0.0135225 -8.25062 63.546000 Cu 0.737837 0.0907342 0.5 449 63.546 0.00408352 -8.25468 63.546000 Cu 0.750236 0.0628209 0.5 418 63.546 0.0131134 -8.22375 63.546000 Cu 0.798565 0.0789525 0 451 63.546 0.00781286 -8.25494 63.546000 Cu 0.859717 0.0673912 0.5 453 63.546 0.0498794 -8.24503 63.546000 Cu 0.970465 0.0700914 0.5 336 63.546 0.0101508 -8.25539 63.546000 Cu 0.908836 0.0825685 9.11193e-17 452 63.546 0.0189949 -8.26741 63.546000 Cu 0.00655987 0.112504 5.77888e-17 344 63.546 0.00102643 -8.26557 63.546000 Cu 0.067767 0.0998753 0.5 350 63.546 0.00507863 -8.25874 63.546000 Cu 0.116192 0.11517 2.65853e-18 369 63.546 0.00496273 -8.26181 63.546000 Cu 0.225453 0.118502 1.67929e-18 370 63.546 0.00122606 -8.26449 63.546000 Cu 0.177008 0.102834 0.5 371 63.546 0.00598384 -8.25734 63.546000 Cu 0.347338 0.0946499 1.15327e-16 374 63.546 0.0144662 -8.26825 63.546000 Cu 0.286326 0.106512 0.5 376 63.546 0.00261831 -8.26657 63.546000 Cu 0.33515 0.122022 4.30724e-17 403 63.546 0.00378965 -8.27126 63.546000 Cu 0.396321 0.109897 0.5 405 63.546 0.00681178 -8.27149 63.546000 Cu 0.457763 0.0975223 7.52006e-18 407 63.546 0.00384732 -8.26626 63.546000 Cu 0.445305 0.124996 7.52006e-18 404 63.546 0.001606 -8.2704 63.546000 Cu 0.567767 0.0998753 0 408 63.546 0.00507863 -8.25874 63.546000 Cu 0.50656 0.112504 0.5 410 63.546 0.00102643 -8.26557 63.546000 Cu 0.616192 0.11517 0.5 445 63.546 0.00496273 -8.26181 63.546000 Cu 0.677008 0.102834 2.94865e-17 447 63.546 0.00598384 -8.25734 63.546000 Cu 0.725453 0.118502 0.5 450 63.546 0.00122606 -8.26449 63.546000 Cu 0.786326 0.106512 1.11973e-16 448 63.546 0.00261831 -8.26657 63.546000 Cu 0.847338 0.0946499 0.5 454 63.546 0.0144662 -8.26825 63.546000 Cu 0.83515 0.122022 0.5 485 63.546 0.00378965 -8.27126 63.546000 Cu 0.957763 0.0975223 0.5 345 63.546 0.00384732 -8.26626 63.546000 Cu 0.896321 0.109897 7.84662e-17 487 63.546 0.00681178 -8.27149 63.546000 Cu 0.945305 0.124996 0.5 346 63.546 0.001606 -8.2704 63.546000 Cu 0.103837 0.14294 0 366 63.546 0.0014994 -8.26733 63.546000 Cu 0.0552201 0.127638 0.5 367 63.546 0.00184507 -8.26589 63.546000 Cu 0.042888 0.155298 0.5 368 63.546 0.000596257 -8.26955 63.546000 Cu 0.164702 0.130644 0.5 372 63.546 0.00206586 -8.26563 63.546000 Cu 0.213308 0.146144 2.22359e-17 399 63.546 0.000480158 -8.2692 63.546000 Cu 0.323023 0.14947 7.52006e-18 400 63.546 0.00139622 -8.272 63.546000 Cu 0.274143 0.134066 0.5 401 63.546 0.000997302 -8.26971 63.546000 Cu 0.384122 0.137302 0.5 406 63.546 0.00218014 -8.27215 63.546000 Cu 0.433017 0.152471 7.52006e-18 439 63.546 0.000489471 -8.27167 63.546000 Cu 0.494144 0.1401 0.5 441 63.546 0.000407403 -8.26955 63.546000 Cu 0.542888 0.155298 7.52006e-18 440 63.546 0.000596257 -8.26955 63.546000 Cu 0.55522 0.127638 7.52006e-18 443 63.546 0.00184507 -8.26589 63.546000 Cu 0.603837 0.14294 0.5 446 63.546 0.0014994 -8.26733 63.546000 Cu 0.664702 0.130644 0 444 63.546 0.00206586 -8.26563 63.546000 Cu 0.713308 0.146144 0.5 481 63.546 0.000480158 -8.2692 63.546000 Cu 0.774143 0.134066 5.86251e-17 483 63.546 0.000997302 -8.26971 63.546000 Cu 0.823023 0.14947 0.5 486 63.546 0.00139622 -8.272 63.546000 Cu 0.994144 0.1401 0 365 63.546 0.000407403 -8.26955 63.546000 Cu 0.884122 0.137302 9.67975e-17 484 63.546 0.00218014 -8.27215 63.546000 Cu 0.933017 0.152471 0.5 520 63.546 0.000489471 -8.27167 63.546000 Cu 0.0305849 0.182863 0.5 393 63.546 0.000190903 -8.27129 63.546000 Cu 0.0915536 0.170577 1.02901e-16 395 63.546 0.000502453 -8.27036 63.546000 Cu 0.20115 0.173716 7.52006e-18 396 63.546 0.000168497 -8.27103 63.546000 Cu 0.152447 0.158324 0.5 397 63.546 0.000641473 -8.26934 63.546000 Cu 0.140246 0.1859 0.5 398 63.546 0.000196383 -8.27122 63.546000 Cu 0.262069 0.161577 0.5 402 63.546 0.000352474 -8.27149 63.546000 Cu 0.310891 0.176903 0 435 63.546 0.000325702 -8.2724 63.546000 Cu 0.371914 0.164728 0.5 437 63.546 0.000641687 -8.27247 63.546000 Cu 0.420784 0.179934 2.44277e-17 436 63.546 0.000181782 -8.27215 63.546000 Cu 0.481847 0.167646 0.5 442 63.546 0.000159534 -8.27118 63.546000 Cu 0.530585 0.182863 0 475 63.546 0.000190903 -8.27129 63.546000 Cu 0.591554 0.170577 0.5 477 63.546 0.000502453 -8.27036 63.546000 Cu 0.640246 0.1859 1.1103e-16 476 63.546 0.000196383 -8.27122 63.546000 Cu 0.652447 0.158324 6.15097e-17 479 63.546 0.000641473 -8.26934 63.546000 Cu 0.70115 0.173716 0.5 482 63.546 0.000168497 -8.27103 63.546000 Cu 0.762069 0.161577 7.52006e-18 480 63.546 0.000352474 -8.27149 63.546000 Cu 0.810891 0.176903 0.5 517 63.546 0.000325702 -8.2724 63.546000 Cu 0.871914 0.164728 4.39827e-17 519 63.546 0.000641687 -8.27247 63.546000 Cu 0.981847 0.167646 1.16004e-16 364 63.546 0.000159534 -8.27118 63.546000 Cu 0.920784 0.179934 0.5 521 63.546 0.000181782 -8.27215 63.546000 Cu 0.079307 0.198125 1.06814e-16 392 63.546 0.000131389 -8.27154 63.546000 Cu 0.0183374 0.210361 0.5 394 63.546 4.6273e-05 -8.27193 63.546000 Cu 0.128041 0.2134 0.5 429 63.546 5.86139e-05 -8.27198 63.546000 Cu 0.188983 0.201214 4.29732e-17 431 63.546 6.02906e-05 -8.27199 63.546000 Cu 0.237766 0.216496 0.5 434 63.546 2.98858e-05 -8.27229 63.546000 Cu 0.24992 0.189053 0.5 433 63.546 0.00010868 -8.27209 63.546000 Cu 0.298738 0.204333 0 432 63.546 9.46635e-05 -8.27236 63.546000 Cu 0.359742 0.192154 0.5 438 63.546 0.000182196 -8.27241 63.546000 Cu 0.408562 0.20737 1.15036e-18 471 63.546 4.52114e-05 -8.27232 63.546000 Cu 0.469579 0.195134 0.5 473 63.546 5.25039e-05 -8.27202 63.546000 Cu 0.518337 0.210361 0 472 63.546 4.6273e-05 -8.27193 63.546000 Cu 0.579307 0.198125 0.5 478 63.546 0.000131389 -8.27154 63.546000 Cu 0.628041 0.2134 2.76846e-17 511 63.546 5.86139e-05 -8.27198 63.546000 Cu 0.737766 0.216496 1.82616e-16 512 63.546 2.98858e-05 -8.27229 63.546000 Cu 0.688983 0.201214 0.5 513 63.546 6.02906e-05 -8.27199 63.546000 Cu 0.74992 0.189053 1.04812e-16 515 63.546 0.00010868 -8.27209 63.546000 Cu 0.859742 0.192154 1.61261e-16 516 63.546 0.000182196 -8.27241 63.546000 Cu 0.798738 0.204333 0.5 518 63.546 9.46635e-05 -8.27236 63.546000 Cu 0.969579 0.195134 1.35612e-16 391 63.546 5.25039e-05 -8.27202 63.546000 Cu 0.908562 0.20737 0.5 552 63.546 4.52114e-05 -8.27232 63.546000 Cu 0.00611127 0.237816 0.5 425 63.546 4.4808e-06 -8.27216 63.546000 Cu 0.0670841 0.225605 1.91216e-17 427 63.546 3.0871e-05 -8.27209 63.546000 Cu 0.115844 0.240849 0.5 430 63.546 1.92412e-05 -8.27223 63.546000 Cu 0.176807 0.228666 0 428 63.546 2.16026e-05 -8.27224 63.546000 Cu 0.225601 0.243914 0.5 465 63.546 2.85889e-06 -8.27234 63.546000 Cu 0.286572 0.231747 7.52006e-18 467 63.546 1.41216e-05 -8.27237 63.546000 Cu 0.347557 0.21957 0.5 469 63.546 4.00272e-05 -8.27238 63.546000 Cu 0.335375 0.246983 0.5 470 63.546 1.16501e-05 -8.27233 63.546000 Cu 0.396356 0.234796 0 468 63.546 1.57438e-05 -8.27228 63.546000 Cu 0.457348 0.222588 0.5 474 63.546 1.34715e-05 -8.27217 63.546000 Cu 0.506111 0.237816 9.7061e-17 507 63.546 4.4808e-06 -8.27216 63.546000 Cu 0.615844 0.240849 2.59836e-17 508 63.546 1.92412e-05 -8.27223 63.546000 Cu 0.567084 0.225605 0.5 509 63.546 3.0871e-05 -8.27209 63.546000 Cu 0.676807 0.228666 0.5 514 63.546 2.16026e-05 -8.27224 63.546000 Cu 0.725601 0.243914 9.34974e-17 547 63.546 2.85889e-06 -8.27234 63.546000 Cu 0.835375 0.246983 3.41518e-17 548 63.546 1.16501e-05 -8.27233 63.546000 Cu 0.786572 0.231747 0.5 549 63.546 1.41216e-05 -8.27237 63.546000 Cu 0.847557 0.21957 1.6947e-16 551 63.546 4.00272e-05 -8.27238 63.546000 Cu 0.957348 0.222588 1.33373e-16 390 63.546 1.34715e-05 -8.27217 63.546000 Cu 0.896356 0.234796 0.5 553 63.546 1.57438e-05 -8.27228 63.546000 Cu 0.0548708 0.253047 7.52006e-18 424 63.546 5.82974e-06 -8.27221 63.546000 Cu 0.0426558 0.28048 0 459 63.546 1.30982e-05 -8.27218 63.546000 Cu 0.103648 0.268273 0.5 461 63.546 1.57643e-05 -8.2723 63.546000 Cu 0.164629 0.256087 2.49684e-17 463 63.546 1.20943e-05 -8.27233 63.546000 Cu 0.213433 0.271322 0.5 466 63.546 1.50559e-05 -8.27236 63.546000 Cu 0.274405 0.259155 0 464 63.546 2.76913e-06 -8.27233 63.546000 Cu 0.323198 0.274404 0.5 501 63.546 1.95813e-05 -8.27223 63.546000 Cu 0.38416 0.262221 2.10762e-17 503 63.546 1.86968e-05 -8.27223 63.546000 Cu 0.493891 0.265255 7.52006e-18 504 63.546 4.39875e-06 -8.27216 63.546000 Cu 0.445132 0.250024 0.5 505 63.546 5.63042e-06 -8.2722 63.546000 Cu 0.432919 0.277465 0.5 506 63.546 3.06678e-05 -8.2721 63.546000 Cu 0.554871 0.253047 0.5 510 63.546 5.82974e-06 -8.27221 63.546000 Cu 0.542656 0.28048 0.5 541 63.546 1.30982e-05 -8.27218 63.546000 Cu 0.603648 0.268273 2.44176e-17 543 63.546 1.57643e-05 -8.2723 63.546000 Cu 0.713433 0.271322 3.35492e-17 544 63.546 1.50559e-05 -8.27236 63.546000 Cu 0.664629 0.256087 0.5 545 63.546 1.20943e-05 -8.27233 63.546000 Cu 0.774405 0.259155 0.5 550 63.546 2.76913e-06 -8.27233 63.546000 Cu 0.823198 0.274404 4.61591e-18 583 63.546 1.95813e-05 -8.27223 63.546000 Cu 0.945132 0.250024 1.79009e-17 423 63.546 5.63042e-06 -8.2722 63.546000 Cu 0.993891 0.265255 0.5 426 63.546 4.39875e-06 -8.27216 63.546000 Cu 0.932919 0.277465 7.52006e-18 584 63.546 3.06678e-05 -8.2721 63.546000 Cu 0.88416 0.262221 0.5 585 63.546 1.86968e-05 -8.27223 63.546000 Cu 0.0304258 0.307928 0 456 63.546 5.10438e-05 -8.27206 63.546000 Cu 0.0914428 0.295694 0.5 462 63.546 4.80985e-05 -8.27232 63.546000 Cu 0.152449 0.283496 1.11184e-16 460 63.546 4.47304e-05 -8.27238 63.546000 Cu 0.140267 0.310907 4.93922e-17 495 63.546 0.000184319 -8.27242 63.546000 Cu 0.201271 0.298732 0.5 497 63.546 9.21956e-05 -8.27238 63.546000 Cu 0.26224 0.286572 7.52417e-17 499 63.546 2.67498e-05 -8.27229 63.546000 Cu 0.371963 0.289668 7.52006e-18 500 63.546 5.67232e-05 -8.27201 63.546000 Cu 0.311021 0.301852 0.5 502 63.546 5.69862e-05 -8.27202 63.546000 Cu 0.420697 0.30494 0.5 537 63.546 0.000131866 -8.27161 63.546000 Cu 0.481666 0.292706 0 539 63.546 4.60032e-05 -8.27197 63.546000 Cu 0.591443 0.295694 7.52006e-18 540 63.546 4.80985e-05 -8.27232 63.546000 Cu 0.530426 0.307928 0.5 542 63.546 5.10438e-05 -8.27206 63.546000 Cu 0.652449 0.283496 0.5 546 63.546 4.47304e-05 -8.27238 63.546000 Cu 0.640267 0.310907 0.5 577 63.546 0.000184319 -8.27242 63.546000 Cu 0.701271 0.298732 5.33367e-18 579 63.546 9.21956e-05 -8.27238 63.546000 Cu 0.811021 0.301852 2.04224e-17 580 63.546 5.69862e-05 -8.27202 63.546000 Cu 0.76224 0.286572 0.5 581 63.546 2.67498e-05 -8.27229 63.546000 Cu 0.871963 0.289668 0.5 586 63.546 5.67232e-05 -8.27201 63.546000 Cu 0.981666 0.292706 0.5 457 63.546 4.60032e-05 -8.27197 63.546000 Cu 0.920697 0.30494 0 617 63.546 0.000131866 -8.27161 63.546000 Cu 0.0181628 0.335408 7.52006e-18 491 63.546 0.000155547 -8.27119 63.546000 Cu 0.0792255 0.323124 0.5 493 63.546 0.000183093 -8.27216 63.546000 Cu 0.128091 0.338327 4.21356e-17 492 63.546 0.000626727 -8.27251 63.546000 Cu 0.189116 0.326154 0.5 498 63.546 0.000339413 -8.27241 63.546000 Cu 0.23794 0.341476 3.07278e-17 531 63.546 0.000350066 -8.27146 63.546000 Cu 0.250085 0.314008 8.77146e-17 496 63.546 0.000106105 -8.27217 63.546000 Cu 0.298856 0.329343 0.5 533 63.546 0.000165552 -8.27119 63.546000 Cu 0.359758 0.317162 0 535 63.546 0.000198236 -8.27131 63.546000 Cu 0.469421 0.320197 2.92617e-17 536 63.546 0.000188479 -8.27142 63.546000 Cu 0.408453 0.332479 0.5 538 63.546 0.000500905 -8.27058 63.546000 Cu 0.518163 0.335408 0.5 573 63.546 0.000155547 -8.27119 63.546000 Cu 0.579226 0.323124 7.52006e-18 575 63.546 0.000183093 -8.27216 63.546000 Cu 0.689116 0.326154 1 576 63.546 0.000339413 -8.27241 63.546000 Cu 0.628091 0.338327 0.5 578 63.546 0.000626727 -8.27251 63.546000 Cu 0.73794 0.341476 0.5 611 63.546 0.000350066 -8.27146 63.546000 Cu 0.750085 0.314008 0.5 582 63.546 0.000106105 -8.27217 63.546000 Cu 0.798856 0.329343 7.52006e-18 613 63.546 0.000165552 -8.27119 63.546000 Cu 0.859758 0.317162 0.5 615 63.546 0.000198236 -8.27131 63.546000 Cu 0.969421 0.320197 0.5 458 63.546 0.000188479 -8.27142 63.546000 Cu 0.908453 0.332479 7.52006e-18 614 63.546 0.000500905 -8.27058 63.546000 Cu 0.00587812 0.362954 7.52006e-18 488 63.546 0.00041258 -8.26979 63.546000 Cu 0.0669986 0.350584 0.5 494 63.546 0.000478158 -8.27176 63.546000 Cu 0.115887 0.365748 1.66461e-17 527 63.546 0.00229111 -8.27207 63.546000 Cu 0.225847 0.368988 5.36658e-17 528 63.546 0.000853869 -8.27008 63.546000 Cu 0.176973 0.353585 0.5 529 63.546 0.00131862 -8.27203 63.546000 Cu 0.347559 0.344729 7.52006e-18 532 63.546 0.000648981 -8.26973 63.546000 Cu 0.286705 0.356904 0.5 534 63.546 0.00044049 -8.26936 63.546000 Cu 0.335313 0.372396 7.52006e-18 567 63.546 0.00186612 -8.26553 63.546000 Cu 0.39617 0.360106 0.5 569 63.546 0.0014389 -8.26751 63.546000 Cu 0.457122 0.347752 3.90744e-17 571 63.546 0.000560219 -8.26958 63.546000 Cu 0.566999 0.350584 0 572 63.546 0.000478158 -8.27176 63.546000 Cu 0.505878 0.362954 0.5 574 63.546 0.00041258 -8.26979 63.546000 Cu 0.615887 0.365748 0.5 607 63.546 0.00229111 -8.27207 63.546000 Cu 0.676973 0.353585 0 609 63.546 0.00131862 -8.27203 63.546000 Cu 0.725847 0.368988 0.5 612 63.546 0.000853869 -8.27008 63.546000 Cu 0.786705 0.356904 3.78263e-17 610 63.546 0.00044049 -8.26936 63.546000 Cu 0.847559 0.344729 0.5 616 63.546 0.000648981 -8.26973 63.546000 Cu 0.835313 0.372396 0.5 637 63.546 0.00186612 -8.26553 63.546000 Cu 0.957122 0.347752 0.5 489 63.546 0.000560219 -8.26958 63.546000 Cu 0.89617 0.360106 0 639 63.546 0.0014389 -8.26751 63.546000 Cu 0.10368 0.393173 3.63081e-17 524 63.546 0.00582369 -8.27157 63.546000 Cu 0.0546893 0.378053 0.5 525 63.546 0.00160543 -8.27025 63.546000 Cu 0.0422991 0.405544 0.5 526 63.546 0.00374826 -8.26656 63.546000 Cu 0.164875 0.381029 0.5 530 63.546 0.00375055 -8.27124 63.546000 Cu 0.213685 0.396528 0 563 63.546 0.00280428 -8.2663 63.546000 Cu 0.323004 0.40021 7.52006e-18 564 63.546 0.00625766 -8.2581 63.546000 Cu 0.274521 0.384542 0.5 565 63.546 0.00117922 -8.26473 63.546000 Cu 0.444814 0.375411 1.26777e-17 568 63.546 0.0019277 -8.26643 63.546000 Cu 0.383853 0.387872 0.5 570 63.546 0.00499034 -8.26219 63.546000 Cu 0.432232 0.403157 0 601 63.546 0.00436581 -8.25856 63.546000 Cu 0.493445 0.390537 0.5 603 63.546 0.000926314 -8.26552 63.546000 Cu 0.542299 0.405544 6.63364e-17 602 63.546 0.00374826 -8.26656 63.546000 Cu 0.554689 0.378053 4.70217e-17 605 63.546 0.00160543 -8.27025 63.546000 Cu 0.60368 0.393173 0.5 608 63.546 0.00582369 -8.27157 63.546000 Cu 0.664875 0.381029 5.07953e-17 606 63.546 0.00375055 -8.27124 63.546000 Cu 0.713685 0.396528 0.5 633 63.546 0.00280428 -8.2663 63.546000 Cu 0.774521 0.384542 6.44967e-18 635 63.546 0.00117922 -8.26473 63.546000 Cu 0.823004 0.40021 0.5 638 63.546 0.00625766 -8.2581 63.546000 Cu 0.932232 0.403157 0.5 308 63.546 0.00436581 -8.25856 63.546000 Cu 0.944814 0.375411 0.5 490 63.546 0.0019277 -8.26643 63.546000 Cu 0.993445 0.390537 0 523 63.546 0.000926314 -8.26552 63.546000 Cu 0.883853 0.387872 1.75852e-18 636 63.546 0.00499034 -8.26219 63.546000 Cu 0.0294444 0.43295 0.5 557 63.546 0.00974484 -8.25542 63.546000 Cu 0.0911691 0.420471 0 559 63.546 0.0205525 -8.26816 63.546000 Cu 0.201394 0.424115 0 560 63.546 0.00723575 -8.25616 63.546000 Cu 0.152599 0.408417 0.5 561 63.546 0.013444 -8.26854 63.546000 Cu 0.140367 0.435632 0.5 562 63.546 0.0521934 -8.24811 63.546000 Cu 0.262214 0.412305 0.5 566 63.546 0.00380212 -8.25495 63.546000 Cu 0.310263 0.428194 1.36699e-17 597 63.546 0.0167758 -8.24084 63.546000 Cu 0.371132 0.415777 0.5 599 63.546 0.0123718 -8.25095 63.546000 Cu 0.41934 0.43106 0 598 63.546 0.0126483 -8.24341 63.546000 Cu 0.48078 0.418201 0.5 604 63.546 0.00276805 -8.25585 63.546000 Cu 0.529444 0.43295 7.52006e-18 627 63.546 0.00974484 -8.25542 63.546000 Cu 0.591169 0.420471 0.5 629 63.546 0.0205525 -8.26816 63.546000 Cu 0.640367 0.435632 7.52006e-18 628 63.546 0.0521934 -8.24811 63.546000 Cu 0.652599 0.408417 0 631 63.546 0.013444 -8.26854 63.546000 Cu 0.701394 0.424115 0.5 634 63.546 0.00723575 -8.25616 63.546000 Cu 0.871132 0.415777 0 323 63.546 0.0123718 -8.25095 63.546000 Cu 0.810263 0.428194 0.5 329 63.546 0.0167758 -8.24084 63.546000 Cu 0.762214 0.412305 0 632 63.546 0.00380212 -8.25495 63.546000 Cu 0.91934 0.43106 0.5 307 63.546 0.0126483 -8.24341 63.546000 Cu 0.98078 0.418201 0 522 63.546 0.00276805 -8.25585 63.546000 Cu 0.0787016 0.447629 0 556 63.546 0.0563221 -8.25213 63.546000 Cu 0.0168796 0.460332 0.5 558 63.546 0.0199985 -8.23128 63.546000 Cu 0.1285 0.462432 0.5 591 63.546 0.248254 -8.13921 63.546000 Cu 0.18944 0.451697 2.91759e-17 593 63.546 0.0279105 -8.21462 63.546000 Cu 0.237836 0.468474 0.5 596 63.546 0.0832252 -8.07744 63.546000 Cu 0.249677 0.440217 0.5 595 63.546 0.0140212 -8.22538 63.546000 Cu 0.297704 0.456522 6.55889e-17 594 63.546 0.0582888 -8.1792 63.546000 Cu 0.358193 0.44393 0.5 600 63.546 0.0355838 -8.22595 63.546000 Cu 0.406442 0.459122 9.65925e-17 623 63.546 0.0302581 -8.22274 63.546000 Cu 0.467757 0.445883 0.5 625 63.546 0.00666876 -8.23818 63.546000 Cu 0.51688 0.460332 2.05694e-17 624 63.546 0.0199985 -8.23128 63.546000 Cu 0.578702 0.447629 0.5 630 63.546 0.0563221 -8.25213 63.546000 Cu 0.6285 0.462432 7.52006e-18 644 63.546 0.248254 -8.13921 63.546000 Cu 0.737836 0.468474 0 645 63.546 0.0832252 -8.07744 63.546000 Cu 0.68944 0.451697 0.5 646 63.546 0.0279105 -8.21462 63.546000 Cu 0.749677 0.440217 0 648 63.546 0.0140212 -8.22538 63.546000 Cu 0.797704 0.456522 0.5 326 63.546 0.0582888 -8.1792 63.546000 Cu 0.858193 0.44393 2.41041e-17 330 63.546 0.0355838 -8.22595 63.546000 Cu 0.906442 0.459122 0.5 3 63.546 0.0302581 -8.22274 63.546000 Cu 0.967757 0.445883 4.41305e-17 555 63.546 0.00666876 -8.23818 63.546000 Cu 0.00653933 0.487707 0.5 588 63.546 0.109992 -8.25556 63.546000 Cu 0.0665426 0.474429 0 589 63.546 0.206522 -8.22235 63.546000 Cu 0.116073 0.48844 0.5 592 63.546 7.82128 -7.13988 63.546000 Cu 0.178489 0.479387 7.50556e-17 590 63.546 5.73521 -7.51064 63.546000 Cu 0.222391 0.498134 0.5 618 63.546 7.56531 -1102.92 63.546000 Cu 0.285345 0.485733 2.73686e-17 619 63.546 0.32411 -8.06215 63.546000 Cu 0.345742 0.472495 0.5 621 63.546 0.103543 -8.18778 63.546000 Cu 0.39587 0.487417 8.28689e-17 620 63.546 0.104094 -8.22644 63.546000 Cu 0.455717 0.473673 0.5 626 63.546 0.0345569 -8.23369 63.546000 Cu 0.506539 0.487707 5.44837e-17 641 63.546 0.109992 -8.25556 63.546000 Cu 0.616073 0.48844 7.52006e-18 642 63.546 7.82128 -7.13988 63.546000 Cu 0.566543 0.474429 0.5 643 63.546 0.206522 -8.22235 63.546000 Cu 0.722391 0.498134 0 34 63.546 7.56531 -1102.92 63.546000 Cu 0.678489 0.479387 0.5 647 63.546 5.73521 -7.51064 63.546000 Cu 0.845742 0.472495 3.83995e-17 4 63.546 0.103543 -8.18778 63.546000 Cu 0.785345 0.485733 0.5 15 63.546 0.32411 -8.06215 63.546000 Cu 0.89587 0.487417 0.5 1 63.546 0.104094 -8.22644 63.546000 Cu 0.955717 0.473673 4.61176e-17 554 63.546 0.0345569 -8.23369 63.546000 Cu 0.00803908 0.515093 0.5 2 63.546 0.0595685 -8.24317 63.546000 Cu 0.0608953 0.501398 6.59955e-17 58 63.546 4.26563 -7.71148 63.546000 Cu 0.068169 0.528138 0 59 63.546 0.0902109 -8.2534 63.546000 Cu 0.120492 0.513913 0.5 60 63.546 7.5816 -7.00293 63.546000 Cu 0.178813 0.524462 7.52006e-18 61 63.546 7.01667 -1103.16 63.546000 Cu 0.336956 0.501433 0.5 622 63.546 0.373169 -8.11996 63.546000 Cu 0.281934 0.516037 0 32 63.546 1.56889 -7.52863 63.546000 Cu 0.345885 0.530216 0.5 38 63.546 0.20852 -8.10738 63.546000 Cu 0.395696 0.51559 0 35 63.546 0.118177 -8.20407 63.546000 Cu 0.456741 0.52919 0.5 37 63.546 0.0294729 -8.23045 63.546000 Cu 0.449932 0.501537 0.5 640 63.546 0.117424 -8.26118 63.546000 Cu 0.508039 0.515093 7.52006e-18 13 63.546 0.0595685 -8.24317 63.546000 Cu 0.560895 0.501398 0.5 14 63.546 4.26563 -7.71148 63.546000 Cu 0.620492 0.513913 0 16 63.546 7.5816 -7.00293 63.546000 Cu 0.568169 0.528138 0.5 19 63.546 0.0902109 -8.2534 63.546000 Cu 0.678813 0.524462 0.5 18 63.546 7.01667 -1103.16 63.546000 Cu 0.836956 0.501433 9.44248e-17 33 63.546 0.373169 -8.11996 63.546000 Cu 0.781934 0.516037 0.5 7 63.546 1.56889 -7.52863 63.546000 Cu 0.845885 0.530216 2.07205e-16 5 63.546 0.20852 -8.10738 63.546000 Cu 0.895696 0.51559 0.5 6 63.546 0.118177 -8.20407 63.546000 Cu 0.956741 0.52919 0 8 63.546 0.0294729 -8.23045 63.546000 Cu 0.949932 0.501537 0 587 63.546 0.117424 -8.26118 63.546000 Cu 0.0183473 0.542422 0.5 10 63.546 0.0128648 -8.24268 63.546000 Cu 0.0798083 0.555132 4.03711e-17 92 63.546 0.0350253 -8.25748 63.546000 Cu 0.190573 0.551536 0 62 63.546 0.0351561 -8.23645 63.546000 Cu 0.239202 0.53494 0.5 63 63.546 5.70048 -7.59404 63.546000 Cu 0.129551 0.540347 0.5 64 63.546 0.140482 -8.2275 63.546000 Cu 0.299294 0.546516 1.33183e-17 65 63.546 0.117153 -8.09093 63.546000 Cu 0.3595 0.559012 0.5 67 63.546 0.0401304 -8.21673 63.546000 Cu 0.407737 0.543747 7.52006e-18 36 63.546 0.0321444 -8.21665 63.546000 Cu 0.469256 0.556912 0.5 42 63.546 0.00602559 -8.24662 63.546000 Cu 0.518347 0.542422 3.53813e-18 39 63.546 0.0128648 -8.24268 63.546000 Cu 0.579808 0.555132 0.5 41 63.546 0.0350253 -8.25748 63.546000 Cu 0.629551 0.540347 0 17 63.546 0.140482 -8.2275 63.546000 Cu 0.739202 0.53494 2.84949e-18 20 63.546 5.70048 -7.59404 63.546000 Cu 0.690573 0.551536 0.5 23 63.546 0.0351561 -8.23645 63.546000 Cu 0.799294 0.546516 0.5 22 63.546 0.117153 -8.09093 63.546000 Cu 0.8595 0.559012 8.39056e-17 24 63.546 0.0401304 -8.21673 63.546000 Cu 0.969256 0.556912 7.7575e-17 9 63.546 0.00602559 -8.24662 63.546000 Cu 0.907737 0.543747 0.5 11 63.546 0.0321444 -8.21665 63.546000 Cu 0.0305378 0.56977 0.5 12 63.546 0.00492864 -8.26111 63.546000 Cu 0.091862 0.582276 0 93 63.546 0.0114497 -8.26888 63.546000 Cu 0.141264 0.567251 0.5 94 63.546 0.0411916 -8.25736 63.546000 Cu 0.202108 0.578941 0 95 63.546 0.0113955 -8.25839 63.546000 Cu 0.311309 0.574803 1.35637e-16 66 63.546 0.0161909 -8.24143 63.546000 Cu 0.251032 0.562908 0.5 68 63.546 0.0102526 -8.23274 63.546000 Cu 0.371814 0.587132 0.5 72 63.546 0.0121592 -8.25426 63.546000 Cu 0.262662 0.590706 0.5 97 63.546 0.00258698 -8.25641 63.546000 Cu 0.420377 0.571822 0 69 63.546 0.0114512 -8.25008 63.546000 Cu 0.481385 0.584599 0.5 71 63.546 0.0023256 -8.2621 63.546000 Cu 0.530538 0.56977 0 40 63.546 0.00492864 -8.26111 63.546000 Cu 0.591862 0.582276 0.5 46 63.546 0.0114497 -8.26888 63.546000 Cu 0.641264 0.567251 0 43 63.546 0.0411916 -8.25736 63.546000 Cu 0.702108 0.578941 0.5 45 63.546 0.0113955 -8.25839 63.546000 Cu 0.751032 0.562908 9.64542e-17 21 63.546 0.0102526 -8.23274 63.546000 Cu 0.871814 0.587132 6.65973e-17 25 63.546 0.0121592 -8.25426 63.546000 Cu 0.811309 0.574803 0.5 27 63.546 0.0161909 -8.24143 63.546000 Cu 0.762662 0.590706 0 47 63.546 0.00258698 -8.25641 63.546000 Cu 0.920377 0.571822 0.5 26 63.546 0.0114512 -8.25008 63.546000 Cu 0.981385 0.584599 5.94438e-17 28 63.546 0.0023256 -8.2621 63.546000 Cu 0.0425481 0.597234 0.5 30 63.546 0.00237588 -8.26827 63.546000 Cu 0.103705 0.609634 1.19235e-16 124 63.546 0.0045099 -8.2716 63.546000 Cu 0.0546949 0.62473 0.5 127 63.546 0.000800235 -8.27031 63.546000 Cu 0.213804 0.606395 8.34023e-17 96 63.546 0.00298415 -8.26781 63.546000 Cu 0.152923 0.594432 0.5 98 63.546 0.0100413 -8.26961 63.546000 Cu 0.164795 0.621832 0.5 126 63.546 0.00358242 -8.27144 63.546000 Cu 0.323206 0.602736 0 99 63.546 0.00433397 -8.25944 63.546000 Cu 0.274591 0.618378 0.5 102 63.546 0.000763251 -8.2661 63.546000 Cu 0.432601 0.599666 7.501e-17 70 63.546 0.00508503 -8.26278 63.546000 Cu 0.493574 0.612237 0.5 76 63.546 0.00113618 -8.26715 63.546000 Cu 0.383919 0.615012 0.5 101 63.546 0.00390603 -8.2633 63.546000 Cu 0.542548 0.597234 7.52006e-18 73 63.546 0.00237588 -8.26827 63.546000 Cu 0.554695 0.62473 1.15017e-16 74 63.546 0.000800235 -8.27031 63.546000 Cu 0.603705 0.609634 0.5 75 63.546 0.0045099 -8.2716 63.546000 Cu 0.652923 0.594432 0 44 63.546 0.0100413 -8.26961 63.546000 Cu 0.713804 0.606395 0.5 50 63.546 0.00298415 -8.26781 63.546000 Cu 0.664795 0.621832 3.27419e-18 77 63.546 0.00358242 -8.27144 63.546000 Cu 0.774591 0.618378 7.52006e-18 48 63.546 0.000763251 -8.2661 63.546000 Cu 0.823206 0.602736 0.5 49 63.546 0.00433397 -8.25944 63.546000 Cu 0.993574 0.612237 2.02579e-17 29 63.546 0.00113618 -8.26715 63.546000 Cu 0.932601 0.599666 0.5 31 63.546 0.00508503 -8.26278 63.546000 Cu 0.883919 0.615012 9.9856e-18 51 63.546 0.00390603 -8.2633 63.546000 Cu 0.00582368 0.639879 0 55 63.546 0.000400645 -8.26891 63.546000 Cu 0.115823 0.63708 1.50732e-17 125 63.546 0.00151638 -8.27186 63.546000 Cu 0.0669169 0.652266 0.5 157 63.546 0.000324996 -8.27104 63.546000 Cu 0.2258 0.633919 8.06359e-17 128 63.546 0.00114664 -8.27013 63.546000 Cu 0.176918 0.649296 0.5 131 63.546 0.00120477 -8.27198 63.546000 Cu 0.335347 0.630502 9.2189e-17 100 63.546 0.00143773 -8.26617 63.546000 Cu 0.286687 0.646012 0.5 130 63.546 0.000326103 -8.26916 63.546000 Cu 0.444794 0.627427 1.4083e-17 103 63.546 0.00185988 -8.26625 63.546000 Cu 0.457114 0.655114 1.2363e-16 104 63.546 0.000631632 -8.26908 63.546000 Cu 0.396182 0.64277 0.5 106 63.546 0.00133348 -8.26737 63.546000 Cu 0.615823 0.63708 0.5 80 63.546 0.00151638 -8.27186 63.546000 Cu 0.505824 0.639879 0.5 105 63.546 0.000400645 -8.26891 63.546000 Cu 0.566917 0.652266 1.85287e-17 107 63.546 0.000324996 -8.27104 63.546000 Cu 0.676918 0.649296 0 78 63.546 0.00120477 -8.27198 63.546000 Cu 0.7258 0.633919 0.5 79 63.546 0.00114664 -8.27013 63.546000 Cu 0.835347 0.630502 0.5 54 63.546 0.00143773 -8.26617 63.546000 Cu 0.786687 0.646012 3.48652e-17 81 63.546 0.000326103 -8.26916 63.546000 Cu 0.896182 0.64277 1.02397e-16 52 63.546 0.00133348 -8.26737 63.546000 Cu 0.944794 0.627427 0.5 53 63.546 0.00185988 -8.26625 63.546000 Cu 0.957114 0.655114 0.5 57 63.546 0.000631632 -8.26908 63.546000 Cu 0.0181223 0.667467 5.89946e-17 56 63.546 0.000162973 -8.27075 63.546000 Cu 0.0791734 0.679775 0.5 161 63.546 0.00012147 -8.27184 63.546000 Cu 0.237907 0.661438 7.32084e-18 129 63.546 0.000363084 -8.27144 63.546000 Cu 0.128019 0.664557 1.25369e-17 158 63.546 0.000538946 -8.27209 63.546000 Cu 0.189067 0.676765 0.5 160 63.546 0.000342079 -8.27222 63.546000 Cu 0.347559 0.658184 2.17772e-17 132 63.546 0.000465683 -8.26908 63.546000 Cu 0.359756 0.68578 3.78554e-19 133 63.546 0.000148537 -8.27088 63.546000 Cu 0.298843 0.673589 0.5 135 63.546 0.000131093 -8.2709 63.546000 Cu 0.408454 0.670432 0.5 134 63.546 0.000420313 -8.26981 63.546000 Cu 0.469407 0.682719 4.72973e-17 136 63.546 0.000188793 -8.27075 63.546000 Cu 0.579173 0.679775 1.61375e-17 108 63.546 0.00012147 -8.27184 63.546000 Cu 0.518122 0.667467 0.5 110 63.546 0.000162973 -8.27075 63.546000 Cu 0.737907 0.661438 0.5 84 63.546 0.000363084 -8.27144 63.546000 Cu 0.628019 0.664557 0.5 109 63.546 0.000538946 -8.27209 63.546000 Cu 0.689067 0.676765 1.48401e-17 111 63.546 0.000342079 -8.27222 63.546000 Cu 0.798843 0.673589 5.78355e-17 82 63.546 0.000131093 -8.2709 63.546000 Cu 0.847559 0.658184 0.5 83 63.546 0.000465683 -8.26908 63.546000 Cu 0.859756 0.68578 0.5 88 63.546 0.000148537 -8.27088 63.546000 Cu 0.908454 0.670432 6.02436e-17 85 63.546 0.000420313 -8.26981 63.546000 Cu 0.969407 0.682719 0.5 87 63.546 0.000188793 -8.27075 63.546000 Cu 0.0304023 0.695004 7.52006e-18 89 63.546 5.27761e-05 -8.27157 63.546000 Cu 0.0914184 0.707261 0.5 190 63.546 3.62762e-05 -8.27209 63.546000 Cu 0.14022 0.692024 0 159 63.546 0.000143608 -8.27228 63.546000 Cu 0.201236 0.704228 0.5 165 63.546 8.77229e-05 -8.27229 63.546000 Cu 0.250057 0.688937 2.10145e-17 162 63.546 0.000112623 -8.27194 63.546000 Cu 0.262219 0.716412 4.36163e-17 163 63.546 2.95594e-05 -8.2722 63.546000 Cu 0.311008 0.701114 0.5 164 63.546 4.83242e-05 -8.27175 63.546000 Cu 0.371954 0.713313 5.37619e-17 166 63.546 4.85963e-05 -8.27171 63.546000 Cu 0.481657 0.710261 0 137 63.546 4.56125e-05 -8.27157 63.546000 Cu 0.420692 0.698012 0.5 139 63.546 0.000114597 -8.27115 63.546000 Cu 0.530402 0.695004 0.5 138 63.546 5.27761e-05 -8.27157 63.546000 Cu 0.591418 0.707261 0 140 63.546 3.62762e-05 -8.27209 63.546000 Cu 0.701236 0.704228 0 112 63.546 8.77229e-05 -8.27229 63.546000 Cu 0.64022 0.692024 0.5 114 63.546 0.000143608 -8.27228 63.546000 Cu 0.750057 0.688937 0.5 113 63.546 0.000112623 -8.27194 63.546000 Cu 0.811008 0.701114 3.32402e-17 115 63.546 4.83242e-05 -8.27175 63.546000 Cu 0.871954 0.713313 0.5 117 63.546 4.85963e-05 -8.27171 63.546000 Cu 0.762219 0.716412 0.5 118 63.546 2.95594e-05 -8.2722 63.546000 Cu 0.920692 0.698012 4.36715e-18 86 63.546 0.000114597 -8.27115 63.546000 Cu 0.981657 0.710261 0.5 91 63.546 4.56125e-05 -8.27157 63.546000 Cu 0.0426458 0.722505 4.91651e-17 90 63.546 1.38979e-05 -8.27194 63.546000 Cu 0.103638 0.734731 0.5 194 63.546 1.27547e-05 -8.27217 63.546000 Cu 0.0548683 0.749983 1.03716e-16 222 63.546 4.4666e-06 -8.27206 63.546000 Cu 0.152427 0.719483 9.47761e-17 191 63.546 3.25593e-05 -8.2723 63.546000 Cu 0.164623 0.746937 1.05114e-16 192 63.546 8.99206e-06 -8.27227 63.546000 Cu 0.213418 0.73168 0.5 193 63.546 1.20528e-05 -8.27234 63.546000 Cu 0.323185 0.7286 0.5 169 63.546 1.77185e-05 -8.27212 63.546000 Cu 0.274396 0.743868 1.2669e-16 195 63.546 2.19269e-06 -8.27231 63.546000 Cu 0.384153 0.7408 1.32226e-16 167 63.546 1.55754e-05 -8.2721 63.546000 Cu 0.432913 0.725532 0.5 168 63.546 2.86247e-05 -8.27183 63.546000 Cu 0.493888 0.737759 3.62784e-17 170 63.546 4.75875e-06 -8.27197 63.546000 Cu 0.603638 0.734731 2.6413e-17 141 63.546 1.27547e-05 -8.27217 63.546000 Cu 0.542646 0.722505 0.5 143 63.546 1.38979e-05 -8.27194 63.546000 Cu 0.554868 0.749983 0.5 172 63.546 4.4666e-06 -8.27206 63.546000 Cu 0.652427 0.719483 0.5 142 63.546 3.25593e-05 -8.2723 63.546000 Cu 0.713418 0.73168 0 144 63.546 1.20528e-05 -8.27234 63.546000 Cu 0.664623 0.746937 0.5 147 63.546 8.99206e-06 -8.27227 63.546000 Cu 0.823185 0.7286 1.04425e-17 116 63.546 1.77185e-05 -8.27212 63.546000 Cu 0.774396 0.743868 0.5 146 63.546 2.19269e-06 -8.27231 63.546000 Cu 0.932913 0.725532 0 119 63.546 2.86247e-05 -8.27183 63.546000 Cu 0.993888 0.737759 0.5 121 63.546 4.75875e-06 -8.27197 63.546000 Cu 0.884153 0.7408 0.5 122 63.546 1.55754e-05 -8.2721 63.546000 Cu 0.00610998 0.765238 0.5 123 63.546 4.8593e-06 -8.27197 63.546000 Cu 0.0670845 0.777466 0 223 63.546 2.87447e-05 -8.27183 63.546000 Cu 0.115844 0.762197 0.5 224 63.546 1.56113e-05 -8.27209 63.546000 Cu 0.2256 0.759128 0.5 198 63.546 2.49338e-06 -8.2723 63.546000 Cu 0.176811 0.774397 1.68436e-16 225 63.546 1.68395e-05 -8.27211 63.546000 Cu 0.286579 0.771315 1.03224e-16 196 63.546 1.31319e-05 -8.27233 63.546000 Cu 0.335374 0.75606 0.5 197 63.546 9.09371e-06 -8.27228 63.546000 Cu 0.44513 0.753014 0.5 173 63.546 4.35961e-06 -8.27206 63.546000 Cu 0.396359 0.768265 5.48469e-17 199 63.546 1.25622e-05 -8.27219 63.546000 Cu 0.457351 0.780491 0.5 201 63.546 1.37274e-05 -8.27195 63.546000 Cu 0.50611 0.765238 0 171 63.546 4.8593e-06 -8.27197 63.546000 Cu 0.615844 0.762197 3.20467e-18 174 63.546 1.56113e-05 -8.27209 63.546000 Cu 0.567085 0.777466 0.5 177 63.546 2.87447e-05 -8.27183 63.546000 Cu 0.7256 0.759128 0 145 63.546 2.49338e-06 -8.2723 63.546000 Cu 0.676811 0.774397 0.5 176 63.546 1.68395e-05 -8.27211 63.546000 Cu 0.835374 0.75606 3.79978e-17 148 63.546 9.09371e-06 -8.27228 63.546000 Cu 0.786579 0.771315 0.5 151 63.546 1.31319e-05 -8.27233 63.546000 Cu 0.94513 0.753014 0 120 63.546 4.35961e-06 -8.27206 63.546000 Cu 0.896359 0.768265 0.5 150 63.546 1.25622e-05 -8.27219 63.546000 Cu 0.957351 0.780491 7.52006e-18 152 63.546 1.37274e-05 -8.27195 63.546000 Cu 0.01834 0.792735 0.5 154 63.546 4.59166e-05 -8.27159 63.546000 Cu 0.0793051 0.804984 1.07216e-17 256 63.546 0.000114373 -8.2712 63.546000 Cu 0.188991 0.801882 2.6504e-16 226 63.546 4.5369e-05 -8.27178 63.546000 Cu 0.237778 0.786584 0.5 227 63.546 2.78586e-05 -8.27219 63.546000 Cu 0.128043 0.789684 0.5 228 63.546 4.69918e-05 -8.27173 63.546000 Cu 0.34757 0.783512 0.5 202 63.546 3.49455e-05 -8.2723 63.546000 Cu 0.298759 0.798768 8.12157e-18 229 63.546 8.52679e-05 -8.27231 63.546000 Cu 0.359774 0.81097 0.5 231 63.546 0.000146974 -8.27227 63.546000 Cu 0.408579 0.795734 0 200 63.546 3.76745e-05 -8.2721 63.546000 Cu 0.469595 0.807991 0.5 206 63.546 5.19671e-05 -8.2716 63.546000 Cu 0.51834 0.792735 7.52006e-18 203 63.546 4.59166e-05 -8.27159 63.546000 Cu 0.579305 0.804984 0.5 205 63.546 0.000114373 -8.2712 63.546000 Cu 0.628043 0.789684 0 175 63.546 4.69918e-05 -8.27173 63.546000 Cu 0.737778 0.786584 0 178 63.546 2.78586e-05 -8.27219 63.546000 Cu 0.688991 0.801882 0.5 181 63.546 4.5369e-05 -8.27178 63.546000 Cu 0.84757 0.783512 1 149 63.546 3.49455e-05 -8.2723 63.546000 Cu 0.798759 0.798768 0.5 180 63.546 8.52679e-05 -8.27231 63.546000 Cu 0.859774 0.81097 0 182 63.546 0.000146974 -8.27227 63.546000 Cu 0.969595 0.807991 0 153 63.546 5.19671e-05 -8.2716 63.546000 Cu 0.908579 0.795734 0.5 155 63.546 3.76745e-05 -8.2721 63.546000 Cu 0.0305895 0.820275 0.5 156 63.546 0.000187603 -8.27083 63.546000 Cu 0.0915404 0.83256 6.43463e-17 257 63.546 0.000411416 -8.26989 63.546000 Cu 0.140242 0.817214 0.5 258 63.546 0.000146705 -8.27093 63.546000 Cu 0.201156 0.829404 5.05239e-17 259 63.546 0.000129532 -8.27099 63.546000 Cu 0.249941 0.814058 0.5 232 63.546 0.000110265 -8.27201 63.546000 Cu 0.31093 0.826229 7.52006e-18 230 63.546 0.000345744 -8.27222 63.546000 Cu 0.371979 0.83844 0.5 236 63.546 0.000507403 -8.27209 63.546000 Cu 0.26209 0.841555 0.5 261 63.546 0.000375537 -8.27136 63.546000 Cu 0.420822 0.823219 0 233 63.546 0.00012 -8.2718 63.546000 Cu 0.481871 0.835527 0.5 235 63.546 0.000156317 -8.27068 63.546000 Cu 0.530589 0.820275 0 204 63.546 0.000187603 -8.27083 63.546000 Cu 0.59154 0.83256 0.5 210 63.546 0.000411416 -8.26989 63.546000 Cu 0.640242 0.817214 2.41147e-17 207 63.546 0.000146705 -8.27093 63.546000 Cu 0.701156 0.829404 0.5 209 63.546 0.000129532 -8.27099 63.546000 Cu 0.749941 0.814058 7.52006e-18 179 63.546 0.000110265 -8.27201 63.546000 Cu 0.871979 0.83844 7.52006e-18 183 63.546 0.000507403 -8.27209 63.546000 Cu 0.81093 0.826229 0.5 185 63.546 0.000345744 -8.27222 63.546000 Cu 0.76209 0.841555 1 211 63.546 0.000375537 -8.27136 63.546000 Cu 0.920822 0.823219 0.5 184 63.546 0.00012 -8.2718 63.546000 Cu 0.981871 0.835527 0 186 63.546 0.000156317 -8.27068 63.546000 Cu 0.0428795 0.847878 0.5 188 63.546 0.000592869 -8.26894 63.546000 Cu 0.103815 0.86022 3.30146e-17 286 63.546 0.00126472 -8.26732 63.546000 Cu 0.213304 0.856979 3.54136e-17 260 63.546 0.000301603 -8.26917 63.546000 Cu 0.152439 0.844808 0.5 262 63.546 0.000460702 -8.26928 63.546000 Cu 0.164643 0.872485 0.5 288 63.546 0.00124688 -8.26591 63.546000 Cu 0.323092 0.853703 1.31802e-17 263 63.546 0.00115276 -8.27191 63.546000 Cu 0.274213 0.869083 0.5 266 63.546 0.00100678 -8.27031 63.546000 Cu 0.433073 0.850734 0 234 63.546 0.00029892 -8.27105 63.546000 Cu 0.494159 0.863123 0.5 240 63.546 0.000399959 -8.26891 63.546000 Cu 0.384179 0.865921 0.5 265 63.546 0.00154856 -8.27171 63.546000 Cu 0.542879 0.847878 0 237 63.546 0.000592869 -8.26894 63.546000 Cu 0.603815 0.86022 0.5 239 63.546 0.00126472 -8.26732 63.546000 Cu 0.652439 0.844808 1.8306e-17 208 63.546 0.000460702 -8.26928 63.546000 Cu 0.713304 0.856979 0.5 214 63.546 0.000301603 -8.26917 63.546000 Cu 0.664643 0.872485 7.52006e-18 241 63.546 0.00124688 -8.26591 63.546000 Cu 0.774213 0.869083 0 212 63.546 0.00100678 -8.27031 63.546000 Cu 0.823092 0.853703 0.5 213 63.546 0.00115276 -8.27191 63.546000 Cu 0.994159 0.863123 5.74466e-19 187 63.546 0.000399959 -8.26891 63.546000 Cu 0.933073 0.850734 0.5 189 63.546 0.00029892 -8.27105 63.546000 Cu 0.884179 0.865921 7.52006e-18 215 63.546 0.00154856 -8.27171 63.546000 Cu 0.0551805 0.875572 0.5 289 63.546 0.00187263 -8.26641 63.546000 Cu 0.00642305 0.890767 7.52006e-18 219 63.546 0.00101069 -8.26706 63.546000 Cu 0.116043 0.887983 0 287 63.546 0.00373961 -8.26323 63.546000 Cu 0.0673882 0.903331 0.5 309 63.546 0.004519 -8.26242 63.546000 Cu 0.225436 0.884617 5.11919e-17 290 63.546 0.000765567 -8.26613 63.546000 Cu 0.176785 0.900262 0.5 293 63.546 0.00436307 -8.2596 63.546000 Cu 0.335192 0.881176 7.52006e-18 264 63.546 0.00338782 -8.27148 63.546000 Cu 0.286199 0.896602 0.5 292 63.546 0.00325041 -8.26773 63.546000 Cu 0.445314 0.878276 2.01751e-17 267 63.546 0.00075219 -8.27008 63.546000 Cu 0.457416 0.905795 3.31102e-17 268 63.546 0.00212164 -8.26858 63.546000 Cu 0.396297 0.893392 0.5 270 63.546 0.00382115 -8.27169 63.546000 Cu 0.55518 0.875572 0 238 63.546 0.00187263 -8.26641 63.546000 Cu 0.616043 0.887983 0.5 244 63.546 0.00373961 -8.26323 63.546000 Cu 0.506423 0.890767 0.5 269 63.546 0.00101069 -8.26706 63.546000 Cu 0.567388 0.903331 1.59214e-16 271 63.546 0.004519 -8.26242 63.546000 Cu 0.676785 0.900262 0 242 63.546 0.00436307 -8.2596 63.546000 Cu 0.725436 0.884617 0.5 243 63.546 0.000765567 -8.26613 63.546000 Cu 0.835192 0.881176 0.5 218 63.546 0.00338782 -8.27148 63.546000 Cu 0.786199 0.896602 0 245 63.546 0.00325041 -8.26773 63.546000 Cu 0.896297 0.893392 1.2423e-17 216 63.546 0.00382115 -8.27169 63.546000 Cu 0.945314 0.878276 0.5 217 63.546 0.00075219 -8.27008 63.546000 Cu 0.957416 0.905795 0.5 221 63.546 0.00212164 -8.26858 63.546000 Cu 0.0185826 0.918428 7.52006e-18 220 63.546 0.00258164 -8.26214 63.546000 Cu 0.0795971 0.931195 0.5 313 63.546 0.0117952 -8.25023 63.546000 Cu 0.237305 0.912293 2.98626e-17 291 63.546 0.0023283 -8.25631 63.546000 Cu 0.128201 0.915863 0 310 63.546 0.0113701 -8.25407 63.546000 Cu 0.188687 0.928187 0.5 312 63.546 0.0144945 -8.24088 63.546000 Cu 0.347131 0.908591 6.27765e-17 294 63.546 0.00966963 -8.26974 63.546000 Cu 0.358699 0.935772 0 295 63.546 0.0421496 -8.25789 63.546000 Cu 0.297921 0.924091 0.5 297 63.546 0.0104087 -8.259 63.546000 Cu 0.408149 0.920742 0.5 296 63.546 0.0118513 -8.26952 63.546000 Cu 0.469518 0.933253 9.35237e-17 298 63.546 0.00453272 -8.2611 63.546000 Cu 0.579597 0.931195 5.23126e-17 272 63.546 0.0117952 -8.25023 63.546000 Cu 0.518583 0.918428 0.5 274 63.546 0.00258164 -8.26214 63.546000 Cu 0.737305 0.912293 0.5 248 63.546 0.0023283 -8.25631 63.546000 Cu 0.628201 0.915863 0.5 273 63.546 0.0113701 -8.25407 63.546000 Cu 0.688687 0.928187 0 275 63.546 0.0144945 -8.24088 63.546000 Cu 0.797921 0.924091 0 246 63.546 0.0104087 -8.259 63.546000 Cu 0.847131 0.908591 0.5 247 63.546 0.00966963 -8.26974 63.546000 Cu 0.858699 0.935772 0.5 252 63.546 0.0421496 -8.25789 63.546000 Cu 0.908149 0.920742 7.52006e-18 249 63.546 0.0118513 -8.26952 63.546000 Cu 0.969518 0.933253 0.5 251 63.546 0.00453272 -8.2611 63.546000 Cu 0.0308058 0.946112 7.52006e-18 253 63.546 0.00540955 -8.24694 63.546000 Cu 0.0923245 0.959267 0.5 324 63.546 0.0308717 -8.21575 63.546000 Cu 0.140472 0.943994 1.20122e-17 311 63.546 0.0391249 -8.21554 63.546000 Cu 0.200771 0.9565 0.5 317 63.546 0.117135 -8.08922 63.546000 Cu 0.24904 0.94011 7.54742e-17 314 63.546 0.0107486 -8.23306 63.546000 Cu 0.260726 0.968082 5.30936e-17 315 63.546 5.68861 -7.5937 63.546000 Cu 0.30939 0.95147 0.5 316 63.546 0.0386651 -8.23735 63.546000 Cu 0.370593 0.962702 1.55619e-17 318 63.546 0.138116 -8.2321 63.546000 Cu 0.4816 0.960645 1.11082e-16 299 63.546 0.0124451 -8.24284 63.546000 Cu 0.420229 0.947956 0.5 301 63.546 0.0293221 -8.25652 63.546000 Cu 0.530806 0.946112 0.5 300 63.546 0.00540955 -8.24694 63.546000 Cu 0.592324 0.959267 1.56554e-16 302 63.546 0.0308717 -8.21575 63.546000 Cu 0.700771 0.9565 7.52006e-18 276 63.546 0.117135 -8.08922 63.546000 Cu 0.640472 0.943994 0.5 278 63.546 0.0391249 -8.21554 63.546000 Cu 0.74904 0.94011 0.5 277 63.546 0.0107486 -8.23306 63.546000 Cu 0.80939 0.95147 1 279 63.546 0.0386651 -8.23735 63.546000 Cu 0.870593 0.962702 0.5 281 63.546 0.138116 -8.2321 63.546000 Cu 0.760726 0.968082 0.5 282 63.546 5.68861 -7.5937 63.546000 Cu 0.920229 0.947956 1 250 63.546 0.0293221 -8.25652 63.546000 Cu 0.9816 0.960645 0.5 255 63.546 0.0124451 -8.24284 63.546000 Cu 0.0433048 0.973865 5.32571e-17 254 63.546 0.0301955 -8.23142 63.546000 Cu 0.104294 0.987442 0.5 328 63.546 0.116942 -8.20605 63.546000 Cu 0.154266 0.9728 6.99721e-18 325 63.546 0.209549 -8.10551 63.546000 Cu 0.218062 0.986999 0.5 327 63.546 1.56221 -7.53351 63.546000 Cu 0.321311 0.978587 0.5 321 63.546 7.00763 -6.64678 63.546000 Cu 0.379437 0.989187 4.07945e-17 319 63.546 7.62976 -6.97675 63.546000 Cu 0.431904 0.974848 0.5 320 63.546 0.1022 -8.25576 63.546000 Cu 0.492106 0.987954 5.38842e-19 322 63.546 0.0653892 -8.2433 63.546000 Cu 0.604294 0.987442 1.3251e-16 303 63.546 0.116942 -8.20605 63.546000 Cu 0.543305 0.973865 0.5 305 63.546 0.0301955 -8.23142 63.546000 Cu 0.654266 0.9728 0.5 304 63.546 0.209549 -8.10551 63.546000 Cu 0.718062 0.986999 0 306 63.546 1.56221 -7.53351 63.546000 Cu 0.821311 0.978587 7.52006e-18 280 63.546 7.00763 -6.64678 63.546000 Cu 0.931904 0.974848 1 283 63.546 0.1022 -8.25576 63.546000 Cu 0.992106 0.987954 0.5 284 63.546 0.0653892 -8.2433 63.546000 Cu 0.879437 0.989187 0.5 285 63.546 7.62976 -6.97675