Number of particles = 654 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.9695 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 92.0274 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60149 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 0.0312821 0.0332948 7.10701e-16 338 63.546 0.0263079 -3.5082 63.546000 Cu 0.0439389 0.00515761 1 341 63.546 0.0574014 -3.49573 63.546000 Cu 0.152488 0.00786312 1 342 63.546 0.251483 -3.47938 63.546000 Cu 0.0921266 0.0202991 0.5 343 63.546 0.0931739 -3.50362 63.546000 Cu 0.139956 0.0363386 2.38426e-17 355 63.546 0.0495459 -3.50937 63.546000 Cu 0.199614 0.0248277 0.5 357 63.546 0.0646294 -3.48995 63.546000 Cu 0.260333 0.0149798 1 359 63.546 0.448894 -3.44382 63.546000 Cu 0.322603 0.00350963 0.5 361 63.546 0.377961 -3.47549 63.546000 Cu 0.310099 0.0299706 0.5 362 63.546 0.117666 -3.49581 63.546000 Cu 0.37202 0.017495 1 360 63.546 0.0262428 -3.50533 63.546000 Cu 0.433594 0.00437904 0.5 363 63.546 0.0235687 -3.50407 63.546000 Cu 0.421177 0.0317382 0.5 383 63.546 0.0048425 -3.50762 63.546000 Cu 0.4827 0.0185987 7.02513e-16 385 63.546 0.0106214 -3.50389 63.546000 Cu 0.592127 0.0202991 1 386 63.546 0.0931739 -3.50362 63.546000 Cu 0.543939 0.00515761 0.5 387 63.546 0.0574014 -3.49573 63.546000 Cu 0.531282 0.0332948 0.5 388 63.546 0.0263079 -3.5082 63.546000 Cu 0.652488 0.00786312 0.5 389 63.546 0.251483 -3.47938 63.546000 Cu 0.639956 0.0363386 0.5 417 63.546 0.0495459 -3.50937 63.546000 Cu 0.822603 0.00350963 4.25072e-16 331 63.546 0.377961 -3.47549 63.546000 Cu 0.699614 0.0248277 1 419 63.546 0.0646294 -3.48995 63.546000 Cu 0.810099 0.0299706 0 420 63.546 0.117666 -3.49581 63.546000 Cu 0.760333 0.0149798 0.5 421 63.546 0.448894 -3.44382 63.546000 Cu 0.933594 0.00437904 0 332 63.546 0.0235687 -3.50407 63.546000 Cu 0.87202 0.017495 0.5 333 63.546 0.0262428 -3.50533 63.546000 Cu 0.921177 0.0317382 1 337 63.546 0.0048425 -3.50762 63.546000 Cu 0.9827 0.0185987 0.5 339 63.546 0.0106214 -3.50389 63.546000 Cu 0.0186933 0.0611959 1 351 63.546 0.0115516 -3.51162 63.546000 Cu 0.127813 0.0642999 7.40324e-16 352 63.546 0.0140912 -3.51206 63.546000 Cu 0.079537 0.0485737 0.5 353 63.546 0.0317701 -3.51164 63.546000 Cu 0.0672114 0.0764959 0.5 354 63.546 0.0106234 -3.5126 63.546000 Cu 0.248661 0.0414735 1 356 63.546 0.0778053 -3.49262 63.546000 Cu 0.188147 0.0525597 0.5 358 63.546 0.010992 -3.50679 63.546000 Cu 0.237019 0.0684821 1.68584e-18 377 63.546 0.017045 -3.5054 63.546000 Cu 0.298117 0.0567574 0.5 379 63.546 0.0383726 -3.50362 63.546000 Cu 0.347412 0.0716204 1.445e-18 378 63.546 0.00895093 -3.50868 63.546000 Cu 0.35956 0.0445017 4.81668e-19 381 63.546 0.018087 -3.5069 63.546000 Cu 0.470052 0.0462765 1.47896e-15 382 63.546 0.00598131 -3.50934 63.546000 Cu 0.408732 0.0590828 0.5 384 63.546 0.0026842 -3.50969 63.546000 Cu 0.457672 0.0738769 1 411 63.546 0.00281365 -3.51118 63.546000 Cu 0.567211 0.0764959 1 412 63.546 0.0106234 -3.5126 63.546000 Cu 0.518693 0.0611959 0.5 413 63.546 0.0115516 -3.51162 63.546000 Cu 0.579537 0.0485737 1 415 63.546 0.0317701 -3.51164 63.546000 Cu 0.627813 0.0642999 0.5 418 63.546 0.0140912 -3.51206 63.546000 Cu 0.688147 0.0525597 1 416 63.546 0.010992 -3.50679 63.546000 Cu 0.748661 0.0414735 0.5 422 63.546 0.0778053 -3.49262 63.546000 Cu 0.737019 0.0684821 0.5 453 63.546 0.017045 -3.5054 63.546000 Cu 0.798117 0.0567574 1 455 63.546 0.0383726 -3.50362 63.546000 Cu 0.847412 0.0716204 0.5 336 63.546 0.00895093 -3.50868 63.546000 Cu 0.908732 0.0590828 1 334 63.546 0.0026842 -3.50969 63.546000 Cu 0.85956 0.0445017 0.5 335 63.546 0.018087 -3.5069 63.546000 Cu 0.970052 0.0462765 0.5 340 63.546 0.00598131 -3.50934 63.546000 Cu 0.957672 0.0738769 0.5 349 63.546 0.00281365 -3.51118 63.546000 Cu 0.0551075 0.104215 0.5 371 63.546 0.00331874 -3.51253 63.546000 Cu 0.115759 0.0920246 1 373 63.546 0.00428635 -3.51221 63.546000 Cu 0.164527 0.107582 0.5 376 63.546 0.000888112 -3.51102 63.546000 Cu 0.00641592 0.0889253 1.10832e-15 348 63.546 0.00465738 -3.51222 63.546000 Cu 0.176335 0.0801052 0.5 375 63.546 0.00278873 -3.5102 63.546000 Cu 0.225235 0.0956984 1 374 63.546 0.00448357 -3.50894 63.546000 Cu 0.286186 0.0837972 0.5 380 63.546 0.0121942 -3.50763 63.546000 Cu 0.274353 0.110988 0.5 405 63.546 0.00381682 -3.50953 63.546000 Cu 0.335375 0.0988294 6.57477e-16 407 63.546 0.00361044 -3.50981 63.546000 Cu 0.445469 0.101401 1 408 63.546 0.00129108 -3.5117 63.546000 Cu 0.396505 0.0864491 0.5 409 63.546 0.0012771 -3.51063 63.546000 Cu 0.384516 0.113819 0.5 410 63.546 0.000582696 -3.51114 63.546000 Cu 0.506416 0.0889253 0.5 414 63.546 0.00465738 -3.51222 63.546000 Cu 0.555108 0.104215 2.93095e-16 447 63.546 0.00331874 -3.51253 63.546000 Cu 0.664527 0.107582 1 448 63.546 0.000888112 -3.51102 63.546000 Cu 0.615759 0.0920246 0.5 449 63.546 0.00428635 -3.51221 63.546000 Cu 0.676335 0.0801052 2.90687e-16 451 63.546 0.00278873 -3.5102 63.546000 Cu 0.786186 0.0837972 1 452 63.546 0.0121942 -3.50763 63.546000 Cu 0.725235 0.0956984 0.5 454 63.546 0.00448357 -3.50894 63.546000 Cu 0.774353 0.110988 1 487 63.546 0.00381682 -3.50953 63.546000 Cu 0.835375 0.0988294 0.5 345 63.546 0.00361044 -3.50981 63.546000 Cu 0.884516 0.113819 0 344 63.546 0.000582696 -3.51114 63.546000 Cu 0.896505 0.0864491 2.44687e-16 347 63.546 0.0012771 -3.51063 63.546000 Cu 0.945469 0.101401 0.5 350 63.546 0.00129108 -3.5117 63.546000 Cu 0.103912 0.119618 1 370 63.546 0.00130073 -3.51202 63.546000 Cu 0.0433133 0.131806 0.5 372 63.546 0.00109154 -3.51225 63.546000 Cu 0.0923555 0.147145 1 399 63.546 0.000356593 -3.51194 63.546000 Cu 0.152913 0.135037 0.5 401 63.546 0.000307503 -3.51134 63.546000 Cu 0.202118 0.150379 4.94191e-16 400 63.546 0.000424566 -3.51087 63.546000 Cu 0.213535 0.123006 2.57933e-16 403 63.546 0.00131162 -3.51032 63.546000 Cu 0.323569 0.126114 7.24669e-16 404 63.546 0.00134345 -3.51067 63.546000 Cu 0.262753 0.138279 0.5 406 63.546 0.00117932 -3.51048 63.546000 Cu 0.312068 0.153453 1 439 63.546 0.000366088 -3.51093 63.546000 Cu 0.372814 0.141208 0.5 441 63.546 0.000232207 -3.51153 63.546000 Cu 0.433608 0.128888 0 443 63.546 0.000527603 -3.51195 63.546000 Cu 0.494369 0.116532 0.5 445 63.546 0.0016954 -3.51225 63.546000 Cu 0.482673 0.144072 0.5 446 63.546 0.000501011 -3.51213 63.546000 Cu 0.543313 0.131806 1 444 63.546 0.00109154 -3.51225 63.546000 Cu 0.603912 0.119618 0.5 450 63.546 0.00130073 -3.51202 63.546000 Cu 0.592356 0.147145 0.5 481 63.546 0.000356593 -3.51194 63.546000 Cu 0.652913 0.135037 0 483 63.546 0.000307503 -3.51134 63.546000 Cu 0.823569 0.126114 0.5 346 63.546 0.00134345 -3.51067 63.546000 Cu 0.762753 0.138279 4.94191e-16 484 63.546 0.00117932 -3.51048 63.546000 Cu 0.713535 0.123006 0.5 485 63.546 0.00131162 -3.51032 63.546000 Cu 0.702118 0.150379 0.5 486 63.546 0.000424566 -3.51087 63.546000 Cu 0.812068 0.153453 0.5 520 63.546 0.000366088 -3.51093 63.546000 Cu 0.872814 0.141208 1.23789e-16 365 63.546 0.000232207 -3.51153 63.546000 Cu 0.982673 0.144072 2.01096e-16 366 63.546 0.000501011 -3.51213 63.546000 Cu 0.933608 0.128888 0.5 367 63.546 0.000527603 -3.51195 63.546000 Cu 0.994369 0.116532 1 369 63.546 0.0016954 -3.51225 63.546000 Cu 0.0808598 0.174623 1 396 63.546 0.000240848 -3.51181 63.546000 Cu 0.0317483 0.159327 0.5 397 63.546 0.000364033 -3.5121 63.546000 Cu 0.0201273 0.186811 0.5 398 63.546 0.000381353 -3.51186 63.546000 Cu 0.141502 0.16247 0.5 402 63.546 0.000143628 -3.51154 63.546000 Cu 0.129828 0.189891 0.5 433 63.546 0.000232818 -3.51141 63.546000 Cu 0.190634 0.177752 1 435 63.546 0.000235129 -3.51119 63.546000 Cu 0.300511 0.180812 7.38156e-16 436 63.546 0.000238091 -3.51124 63.546000 Cu 0.251379 0.165617 0.5 437 63.546 0.000351488 -3.51088 63.546000 Cu 0.422024 0.156358 4.00989e-16 440 63.546 0.000172823 -3.5119 63.546000 Cu 0.361303 0.168614 0.5 442 63.546 0.000207032 -3.51147 63.546000 Cu 0.410342 0.183805 1 475 63.546 0.000211048 -3.51184 63.546000 Cu 0.471125 0.171572 0.5 477 63.546 0.000230518 -3.51198 63.546000 Cu 0.520127 0.186811 1 476 63.546 0.000381353 -3.51186 63.546000 Cu 0.531748 0.159327 1 479 63.546 0.000364033 -3.5121 63.546000 Cu 0.641502 0.16247 1 480 63.546 0.000143628 -3.51154 63.546000 Cu 0.58086 0.174623 0.5 482 63.546 0.000240848 -3.51181 63.546000 Cu 0.629828 0.189891 1 515 63.546 0.000232818 -3.51141 63.546000 Cu 0.690634 0.177752 0.5 517 63.546 0.000235129 -3.51119 63.546000 Cu 0.751379 0.165617 1 519 63.546 0.000351488 -3.51088 63.546000 Cu 0.800511 0.180812 0.5 521 63.546 0.000238091 -3.51124 63.546000 Cu 0.861303 0.168614 1.21621e-16 364 63.546 0.000207032 -3.51147 63.546000 Cu 0.922024 0.156358 0.5 368 63.546 0.000172823 -3.5119 63.546000 Cu 0.910342 0.183805 0.5 393 63.546 0.000211048 -3.51184 63.546000 Cu 0.971125 0.171572 3.94004e-16 395 63.546 0.000230518 -3.51198 63.546000 Cu 0.0565493 0.229489 1.22825e-16 428 63.546 3.03359e-05 -3.51164 63.546000 Cu 0.0689014 0.202061 1 431 63.546 0.000124549 -3.51176 63.546000 Cu 0.117598 0.217301 0.5 434 63.546 4.99073e-05 -3.51157 63.546000 Cu 0.00788403 0.21426 0.5 429 63.546 2.16663e-05 -3.51178 63.546000 Cu 0.239617 0.192989 0.5 438 63.546 0.00018847 -3.51114 63.546000 Cu 0.178657 0.205134 1 432 63.546 0.000108147 -3.51127 63.546000 Cu 0.227421 0.22035 0.5 469 63.546 2.77242e-05 -3.51117 63.546000 Cu 0.288476 0.2082 4.92024e-16 471 63.546 0.000121394 -3.51125 63.546000 Cu 0.349425 0.196018 0.5 473 63.546 0.000121617 -3.51154 63.546000 Cu 0.337197 0.223423 0.5 474 63.546 7.6984e-05 -3.51143 63.546000 Cu 0.398172 0.21124 1 472 63.546 4.95494e-05 -3.51161 63.546000 Cu 0.459181 0.199023 0.5 478 63.546 0.000118272 -3.51192 63.546000 Cu 0.446856 0.226459 0.5 509 63.546 7.29238e-06 -3.51162 63.546000 Cu 0.507884 0.21426 0 511 63.546 2.16663e-05 -3.51178 63.546000 Cu 0.617598 0.217301 1.15673e-15 512 63.546 4.99073e-05 -3.51157 63.546000 Cu 0.568901 0.202061 0.5 513 63.546 0.000124549 -3.51176 63.546000 Cu 0.556549 0.229489 0.5 514 63.546 3.03359e-05 -3.51164 63.546000 Cu 0.739617 0.192989 6.64943e-16 516 63.546 0.00018847 -3.51114 63.546000 Cu 0.678657 0.205134 0.5 518 63.546 0.000108147 -3.51127 63.546000 Cu 0.727421 0.22035 1 551 63.546 2.77242e-05 -3.51117 63.546000 Cu 0.788476 0.2082 0.5 552 63.546 0.000121394 -3.51125 63.546000 Cu 0.837197 0.223423 1 390 63.546 7.6984e-05 -3.51143 63.546000 Cu 0.849425 0.196018 1 391 63.546 0.000121617 -3.51154 63.546000 Cu 0.959181 0.199023 0 392 63.546 0.000118272 -3.51192 63.546000 Cu 0.898172 0.21124 0.5 394 63.546 4.95494e-05 -3.51161 63.546000 Cu 0.946856 0.226459 1 427 63.546 7.29238e-06 -3.51162 63.546000 Cu 0.0442912 0.256904 1 463 63.546 0.000147128 -3.5117 63.546000 Cu 0.154115 0.259876 1 464 63.546 0.000197369 -3.51145 63.546000 Cu 0.10526 0.24469 0.5 465 63.546 0.000104119 -3.51149 63.546000 Cu 0.166316 0.232502 2.02999e-15 467 63.546 6.53572e-05 -3.5112 63.546000 Cu 0.276123 0.235573 1 468 63.546 4.92496e-05 -3.51126 63.546000 Cu 0.215063 0.247702 0.5 470 63.546 0.000287942 -3.51121 63.546000 Cu 0.263938 0.262947 4.91061e-16 503 63.546 0.000133386 -3.51135 63.546000 Cu 0.324827 0.250826 0.5 505 63.546 0.000205998 -3.51155 63.546000 Cu 0.373721 0.266091 7.38638e-16 504 63.546 0.000218075 -3.51181 63.546000 Cu 0.385808 0.238665 1 507 63.546 0.000134498 -3.51163 63.546000 Cu 0.495488 0.24169 1 508 63.546 0.000133769 -3.51172 63.546000 Cu 0.434547 0.253894 0.5 510 63.546 0.000168707 -3.51183 63.546000 Cu 0.483461 0.269121 2.93095e-16 543 63.546 6.54567e-05 -3.51187 63.546000 Cu 0.544291 0.256904 0.5 545 63.546 0.000147128 -3.5117 63.546000 Cu 0.60526 0.24469 1 547 63.546 0.000104119 -3.51149 63.546000 Cu 0.666316 0.232502 0.5 549 63.546 6.53572e-05 -3.5112 63.546000 Cu 0.654115 0.259876 0.5 550 63.546 0.000197369 -3.51145 63.546000 Cu 0.824827 0.250826 1 423 63.546 0.000205998 -3.51155 63.546000 Cu 0.715063 0.247702 1 548 63.546 0.000287942 -3.51121 63.546000 Cu 0.776123 0.235573 0.5 553 63.546 4.92496e-05 -3.51126 63.546000 Cu 0.763938 0.262947 0.5 585 63.546 0.000133386 -3.51135 63.546000 Cu 0.934547 0.253894 1 424 63.546 0.000168707 -3.51183 63.546000 Cu 0.885808 0.238665 0.5 425 63.546 0.000134498 -3.51163 63.546000 Cu 0.873721 0.266091 0.5 426 63.546 0.000218075 -3.51181 63.546000 Cu 0.995488 0.24169 0.5 430 63.546 0.000133769 -3.51172 63.546000 Cu 0.983461 0.269121 0.5 461 63.546 6.54567e-05 -3.51187 63.546000 Cu 0.0323968 0.284328 1.22344e-16 460 63.546 9.70215e-05 -3.51166 63.546000 Cu 0.0932477 0.272088 0.5 466 63.546 4.37124e-05 -3.51156 63.546000 Cu 0.0814308 0.299486 0.5 497 63.546 0.000101445 -3.51133 63.546000 Cu 0.14225 0.287262 1 499 63.546 0.000199721 -3.5113 63.546000 Cu 0.252087 0.290317 1 500 63.546 0.000295725 -3.51114 63.546000 Cu 0.20309 0.275078 0.5 501 63.546 0.000317491 -3.51126 63.546000 Cu 0.191368 0.302438 0.5 502 63.546 0.000610129 -3.51101 63.546000 Cu 0.312892 0.278226 0.5 506 63.546 7.20652e-05 -3.51146 63.546000 Cu 0.301175 0.305618 0.5 537 63.546 7.69638e-05 -3.51141 63.546000 Cu 0.361888 0.293511 2.94299e-16 539 63.546 0.00023884 -3.51177 63.546000 Cu 0.471615 0.296574 1.22585e-16 540 63.546 0.000280224 -3.51196 63.546000 Cu 0.422659 0.28134 0.5 541 63.546 0.000187975 -3.51198 63.546000 Cu 0.593248 0.272088 8.20281e-16 544 63.546 4.37124e-05 -3.51156 63.546000 Cu 0.532397 0.284328 0.5 546 63.546 9.70215e-05 -3.51166 63.546000 Cu 0.581431 0.299486 7.38638e-16 579 63.546 0.000101445 -3.51133 63.546000 Cu 0.64225 0.287262 0.5 581 63.546 0.000199721 -3.5113 63.546000 Cu 0.691368 0.302438 1.89536e-16 580 63.546 0.000610129 -3.51101 63.546000 Cu 0.70309 0.275078 1.2427e-16 583 63.546 0.000317491 -3.51126 63.546000 Cu 0.812892 0.278226 3.70884e-16 584 63.546 7.20652e-05 -3.51146 63.546000 Cu 0.752087 0.290317 0.5 586 63.546 0.000295725 -3.51114 63.546000 Cu 0.801175 0.305618 1 617 63.546 7.69638e-05 -3.51141 63.546000 Cu 0.861888 0.293511 0.5 457 63.546 0.00023884 -3.51177 63.546000 Cu 0.922659 0.28134 1 459 63.546 0.000187975 -3.51198 63.546000 Cu 0.971615 0.296574 0.5 462 63.546 0.000280224 -3.51196 63.546000 Cu 0.0206485 0.311745 0 495 63.546 0.00016535 -3.51171 63.546000 Cu 0.130588 0.314613 1.23066e-16 496 63.546 0.000470825 -3.51095 63.546000 Cu 0.0697893 0.326852 0.5 498 63.546 0.000217784 -3.51129 63.546000 Cu 0.118989 0.341921 1 531 63.546 0.00141732 -3.51044 63.546000 Cu 0.00894282 0.339164 6.16294e-16 492 63.546 0.000373845 -3.51182 63.546000 Cu 0.179812 0.32977 0.5 533 63.546 0.00138597 -3.51046 63.546000 Cu 0.228995 0.345036 1 532 63.546 0.00151669 -3.5103 63.546000 Cu 0.240492 0.317687 0 535 63.546 0.000516047 -3.51093 63.546000 Cu 0.289603 0.333031 0.5 538 63.546 0.000251957 -3.51132 63.546000 Cu 0.350191 0.320958 1.2114e-16 536 63.546 0.000482055 -3.51188 63.546000 Cu 0.410876 0.3088 0.5 542 63.546 0.000615885 -3.51214 63.546000 Cu 0.399169 0.336291 0.5 573 63.546 0.00164849 -3.51232 63.546000 Cu 0.459864 0.324034 0 575 63.546 0.000823618 -3.5122 63.546000 Cu 0.508943 0.339164 0.5 578 63.546 0.000373845 -3.51182 63.546000 Cu 0.569789 0.326852 7.39601e-16 576 63.546 0.000217784 -3.51129 63.546000 Cu 0.520649 0.311745 0.5 577 63.546 0.00016535 -3.51171 63.546000 Cu 0.630588 0.314613 0.5 582 63.546 0.000470825 -3.51095 63.546000 Cu 0.618989 0.341921 0.5 611 63.546 0.00141732 -3.51044 63.546000 Cu 0.679812 0.32977 7.38638e-16 613 63.546 0.00138597 -3.51046 63.546000 Cu 0.789603 0.333031 0 614 63.546 0.000251957 -3.51132 63.546000 Cu 0.740492 0.317687 0.5 615 63.546 0.000516047 -3.51093 63.546000 Cu 0.728995 0.345036 0.5 616 63.546 0.00151669 -3.5103 63.546000 Cu 0.850191 0.320958 0.5 458 63.546 0.000482055 -3.51188 63.546000 Cu 0.910876 0.3088 6.79152e-17 456 63.546 0.000615885 -3.51214 63.546000 Cu 0.899169 0.336291 3.69199e-16 491 63.546 0.00164849 -3.51232 63.546000 Cu 0.959864 0.324034 0.5 493 63.546 0.000823618 -3.5122 63.546000 Cu 0.10726 0.369163 1 528 63.546 0.00403266 -3.50968 63.546000 Cu 0.0580382 0.354195 0.5 529 63.546 0.000672682 -3.51101 63.546000 Cu 0.0462539 0.381532 0.5 530 63.546 0.00144559 -3.51073 63.546000 Cu 0.156625 0.384184 0.5 565 63.546 0.013036 -3.50716 63.546000 Cu 0.168181 0.357028 0.5 534 63.546 0.00419852 -3.5093 63.546000 Cu 0.217404 0.372312 2.55284e-17 567 63.546 0.00491254 -3.50859 63.546000 Cu 0.326845 0.376024 1.23548e-16 568 63.546 0.00488451 -3.5123 63.546000 Cu 0.278005 0.360471 0.5 569 63.546 0.00089336 -3.51104 63.546000 Cu 0.338575 0.348459 5.25981e-16 571 63.546 0.00156472 -3.51214 63.546000 Cu 0.448116 0.351525 0 572 63.546 0.00189153 -3.51232 63.546000 Cu 0.387399 0.363859 0.5 574 63.546 0.0045581 -3.51269 63.546000 Cu 0.43626 0.379098 7.40805e-16 605 63.546 0.00482883 -3.51261 63.546000 Cu 0.497121 0.366609 0.5 607 63.546 0.000979908 -3.51192 63.546000 Cu 0.546254 0.381532 6.17258e-16 606 63.546 0.00144559 -3.51073 63.546000 Cu 0.558038 0.354195 2.02301e-16 609 63.546 0.000672682 -3.51101 63.546000 Cu 0.60726 0.369163 0.5 612 63.546 0.00403266 -3.50968 63.546000 Cu 0.656625 0.384184 2.6564e-16 635 63.546 0.013036 -3.50716 63.546000 Cu 0.668181 0.357028 2.4541e-16 610 63.546 0.00419852 -3.5093 63.546000 Cu 0.826845 0.376024 0.5 490 63.546 0.00488451 -3.5123 63.546000 Cu 0.717404 0.372312 0.5 637 63.546 0.00491254 -3.50859 63.546000 Cu 0.778005 0.360471 1 639 63.546 0.00089336 -3.51104 63.546000 Cu 0.838575 0.348459 0.5 489 63.546 0.00156472 -3.51214 63.546000 Cu 0.887399 0.363859 1 488 63.546 0.0045581 -3.51269 63.546000 Cu 0.948116 0.351525 0.5 494 63.546 0.00189153 -3.51232 63.546000 Cu 0.93626 0.379098 0.5 525 63.546 0.00482883 -3.51261 63.546000 Cu 0.997121 0.366609 1.23066e-16 527 63.546 0.000979908 -3.51192 63.546000 Cu 0.0343545 0.408834 0.5 561 63.546 0.00312046 -3.50962 63.546000 Cu 0.0955476 0.39633 4.65773e-16 563 63.546 0.00959186 -3.50838 63.546000 Cu 0.145039 0.411158 0.5 566 63.546 0.040969 -3.50257 63.546000 Cu 0.205999 0.399485 1 564 63.546 0.0182523 -3.50426 63.546000 Cu 0.266478 0.38792 0.5 570 63.546 0.00297006 -3.50986 63.546000 Cu 0.255034 0.415415 0.5 599 63.546 0.0122186 -3.50635 63.546000 Cu 0.315202 0.403708 1 601 63.546 0.0157018 -3.51221 63.546000 Cu 0.424329 0.406783 1 602 63.546 0.0123124 -3.51199 63.546000 Cu 0.375622 0.391529 0.5 603 63.546 0.0118197 -3.51295 63.546000 Cu 0.363669 0.419399 0.5 604 63.546 0.0333179 -3.51225 63.546000 Cu 0.485238 0.394098 0.5 608 63.546 0.00271711 -3.51144 63.546000 Cu 0.473157 0.421648 0.5 629 63.546 0.00594077 -3.50963 63.546000 Cu 0.534355 0.408834 8.62908e-16 631 63.546 0.00312046 -3.50962 63.546000 Cu 0.645039 0.411158 1 632 63.546 0.040969 -3.50257 63.546000 Cu 0.595548 0.39633 0.5 633 63.546 0.00959186 -3.50838 63.546000 Cu 0.766478 0.38792 1.22585e-16 636 63.546 0.00297006 -3.50986 63.546000 Cu 0.705999 0.399485 0.5 638 63.546 0.0182523 -3.50426 63.546000 Cu 0.755034 0.415415 2.6275e-16 652 63.546 0.0122186 -3.50635 63.546000 Cu 0.815202 0.403708 0.5 653 63.546 0.0157018 -3.51221 63.546000 Cu 0.863669 0.419399 1 522 63.546 0.0333179 -3.51225 63.546000 Cu 0.875622 0.391529 3.71607e-16 523 63.546 0.0118197 -3.51295 63.546000 Cu 0.985238 0.394098 1 524 63.546 0.00271711 -3.51144 63.546000 Cu 0.924329 0.406783 0.5 526 63.546 0.0123124 -3.51199 63.546000 Cu 0.973157 0.421648 1 559 63.546 0.00594077 -3.50963 63.546000 Cu 0.0836849 0.423386 8.62427e-16 560 63.546 0.0190742 -3.50655 63.546000 Cu 0.022237 0.436129 0.5 562 63.546 0.00522881 -3.50774 63.546000 Cu 0.0716179 0.450328 1 593 63.546 0.0271799 -3.50513 63.546000 Cu 0.13335 0.437879 0.5 595 63.546 0.123942 -3.49427 63.546000 Cu 0.18329 0.452829 1 594 63.546 0.480336 -3.43879 63.546000 Cu 0.194626 0.426418 1 597 63.546 0.0835776 -3.49 63.546000 Cu 0.303334 0.431614 1 598 63.546 0.0525678 -3.51 63.546000 Cu 0.243923 0.443108 0.5 600 63.546 0.0725824 -3.48861 63.546000 Cu 0.291227 0.460044 6.12923e-16 623 63.546 0.258409 -3.48123 63.546000 Cu 0.351431 0.447625 0.5 625 63.546 0.0957314 -3.50501 63.546000 Cu 0.41206 0.434639 2.73106e-16 627 63.546 0.028134 -3.50906 63.546000 Cu 0.460904 0.449273 0.5 630 63.546 0.0107581 -3.50444 63.546000 Cu 0.522237 0.436129 0 628 63.546 0.00522881 -3.50774 63.546000 Cu 0.583685 0.423386 0.5 634 63.546 0.0190742 -3.50655 63.546000 Cu 0.571618 0.450328 0.5 646 63.546 0.0271799 -3.50513 63.546000 Cu 0.63335 0.437879 1 648 63.546 0.123942 -3.49427 63.546000 Cu 0.68329 0.452829 0.5 651 63.546 0.480336 -3.43879 63.546000 Cu 0.791227 0.460044 0.5 16 63.546 0.258409 -3.48123 63.546000 Cu 0.743923 0.443108 2.09285e-16 649 63.546 0.0725824 -3.48861 63.546000 Cu 0.694626 0.426418 0.5 650 63.546 0.0835776 -3.49 63.546000 Cu 0.803334 0.431614 0.5 654 63.546 0.0525678 -3.51 63.546000 Cu 0.851431 0.447625 7.28041e-16 555 63.546 0.0957314 -3.50501 63.546000 Cu 0.960904 0.449273 1 556 63.546 0.0107581 -3.50444 63.546000 Cu 0.91206 0.434639 0.5 557 63.546 0.028134 -3.50906 63.546000 Cu 0.0606607 0.477296 1 590 63.546 0.108611 -3.50526 63.546000 Cu 0.121244 0.464285 0.5 596 63.546 0.392507 -3.47452 63.546000 Cu 0.114686 0.490811 0.5 618 63.546 3.36136 -3.43283 63.546000 Cu 0.0102667 0.463425 0.5 591 63.546 0.0246727 -3.50426 63.546000 Cu 0.0038554 0.490832 0.5 592 63.546 0.126403 -3.51307 63.546000 Cu 0.170287 0.478294 3.69921e-16 619 63.546 7.07456 -3.2247 63.546000 Cu 0.275769 0.490852 5.46693e-17 620 63.546 4.63266 -3.46304 63.546000 Cu 0.233415 0.471403 0.5 621 63.546 5.68196 -3.3734 63.546000 Cu 0.399888 0.462711 1 624 63.546 0.0589596 -3.49709 63.546000 Cu 0.339183 0.476518 0.5 626 63.546 0.392469 -3.47195 63.546000 Cu 0.391825 0.490863 1 641 63.546 0.245581 -3.49503 63.546000 Cu 0.450078 0.477009 0.5 643 63.546 0.0894238 -3.50538 63.546000 Cu 0.503855 0.490832 1 642 63.546 0.126403 -3.51307 63.546000 Cu 0.510267 0.463425 7.00586e-16 644 63.546 0.0246727 -3.50426 63.546000 Cu 0.614686 0.490811 1 330 63.546 3.36136 -3.43283 63.546000 Cu 0.621244 0.464285 0 645 63.546 0.392507 -3.47452 63.546000 Cu 0.560661 0.477296 0.5 647 63.546 0.108611 -3.50526 63.546000 Cu 0.670287 0.478294 0.5 60 63.546 7.07456 -3.2247 63.546000 Cu 0.775769 0.490852 0.5 3 63.546 4.63266 -3.46304 63.546000 Cu 0.733415 0.471403 0 34 63.546 5.68196 -3.3734 63.546000 Cu 0.899888 0.462711 0.5 558 63.546 0.0589596 -3.49709 63.546000 Cu 0.839183 0.476518 3.17419e-16 554 63.546 0.392469 -3.47195 63.546000 Cu 0.891825 0.490863 0.5 588 63.546 0.245581 -3.49503 63.546000 Cu 0.950078 0.477009 1 589 63.546 0.0894238 -3.50538 63.546000 Cu 0.0610577 0.504342 4.2435e-16 1 63.546 0.107831 -3.50461 63.546000 Cu 0.121987 0.517336 0.5 2 63.546 0.383243 -3.47394 63.546000 Cu 0.0110406 0.518224 0.5 6 63.546 0.0263739 -3.50339 63.546000 Cu 0.0728174 0.531285 1.29304e-15 8 63.546 0.026218 -3.50369 63.546000 Cu 0.233943 0.5103 0.5 622 63.546 5.69377 -3.37761 63.546000 Cu 0.170748 0.503294 1.23018e-15 58 63.546 7.10166 -3.22861 63.546000 Cu 0.184467 0.528758 1 59 63.546 0.451036 -3.44289 63.546000 Cu 0.292181 0.521645 1 61 63.546 0.254061 -3.4825 63.546000 Cu 0.339613 0.505199 0.5 640 63.546 0.390403 -3.47092 63.546000 Cu 0.400731 0.519012 2.95503e-16 32 63.546 0.055682 -3.49599 63.546000 Cu 0.450471 0.504686 0.5 33 63.546 0.0906857 -3.50486 63.546000 Cu 0.46216 0.532417 0.5 38 63.546 0.0104586 -3.50353 63.546000 Cu 0.35276 0.534082 0.5 63 63.546 0.0913741 -3.50469 63.546000 Cu 0.621987 0.517336 1 13 63.546 0.383243 -3.47394 63.546000 Cu 0.561058 0.504342 0.5 15 63.546 0.107831 -3.50461 63.546000 Cu 0.511041 0.518224 1 35 63.546 0.0263739 -3.50339 63.546000 Cu 0.572817 0.531285 0.5 37 63.546 0.026218 -3.50369 63.546000 Cu 0.733943 0.5103 1.08712e-15 323 63.546 5.69377 -3.37761 63.546000 Cu 0.670748 0.503294 0.5 14 63.546 7.10166 -3.22861 63.546000 Cu 0.792181 0.521645 0.5 18 63.546 0.254061 -3.4825 63.546000 Cu 0.684467 0.528758 0.5 19 63.546 0.451036 -3.44289 63.546000 Cu 0.839613 0.505199 1 587 63.546 0.390403 -3.47092 63.546000 Cu 0.950471 0.504686 1 4 63.546 0.0906857 -3.50486 63.546000 Cu 0.96216 0.532417 1 5 63.546 0.0104586 -3.50353 63.546000 Cu 0.900731 0.519012 0.5 7 63.546 0.055682 -3.49599 63.546000 Cu 0.85276 0.534082 1.85924e-16 20 63.546 0.0913741 -3.50469 63.546000 Cu 0.0858596 0.5582 9.35881e-16 9 63.546 0.0174252 -3.50578 63.546000 Cu 0.135055 0.543715 0.5 10 63.546 0.118788 -3.49405 63.546000 Cu 0.0239987 0.545501 0.5 11 63.546 0.00478713 -3.50686 63.546000 Cu 0.0371141 0.57275 0.5 26 63.546 0.00269665 -3.50884 63.546000 Cu 0.147665 0.570409 0.5 12 63.546 0.0382829 -3.5026 63.546000 Cu 0.305242 0.550053 1.72919e-16 62 63.546 0.0504211 -3.51126 63.546000 Cu 0.245334 0.538538 0.5 64 63.546 0.0682328 -3.49174 63.546000 Cu 0.196697 0.555173 3.72811e-16 92 63.546 0.0792353 -3.49214 63.546000 Cu 0.257517 0.566203 0.5 94 63.546 0.0121315 -3.50803 63.546000 Cu 0.413886 0.547059 1 65 63.546 0.0250571 -3.50821 63.546000 Cu 0.427156 0.574852 9.85734e-16 66 63.546 0.011473 -3.51152 63.546000 Cu 0.475419 0.559993 0.5 67 63.546 0.00555397 -3.50884 63.546000 Cu 0.365997 0.562272 0.5 68 63.546 0.0305149 -3.51218 63.546000 Cu 0.523999 0.545501 6.15331e-16 36 63.546 0.00478713 -3.50686 63.546000 Cu 0.635055 0.543715 1 39 63.546 0.118788 -3.49405 63.546000 Cu 0.58586 0.5582 0.5 42 63.546 0.0174252 -3.50578 63.546000 Cu 0.537114 0.57275 1 69 63.546 0.00269665 -3.50884 63.546000 Cu 0.647665 0.570409 9.83566e-16 40 63.546 0.0382829 -3.5026 63.546000 Cu 0.745334 0.538538 1 17 63.546 0.0682328 -3.49174 63.546000 Cu 0.805242 0.550053 0.5 23 63.546 0.0504211 -3.51126 63.546000 Cu 0.696697 0.555173 0.5 41 63.546 0.0792353 -3.49214 63.546000 Cu 0.757517 0.566203 3.42948e-16 43 63.546 0.0121315 -3.50803 63.546000 Cu 0.865997 0.562272 4.01952e-16 21 63.546 0.0305149 -3.51218 63.546000 Cu 0.913886 0.547059 0.5 22 63.546 0.0250571 -3.50821 63.546000 Cu 0.975419 0.559993 0 24 63.546 0.00555397 -3.50884 63.546000 Cu 0.927156 0.574852 0.5 27 63.546 0.011473 -3.51152 63.546000 Cu 0.0987955 0.585222 1.2427e-16 28 63.546 0.00838992 -3.50787 63.546000 Cu 0.111825 0.612355 1 29 63.546 0.00329562 -3.50934 63.546000 Cu 0.0501841 0.60002 0.5 31 63.546 0.00138136 -3.51007 63.546000 Cu 0.160406 0.597365 0.5 30 63.546 0.0122451 -3.50725 63.546000 Cu 0.00183221 0.614939 1 51 63.546 0.000921635 -3.51132 63.546000 Cu 0.209068 0.582091 6.16294e-16 93 63.546 0.0169066 -3.50543 63.546000 Cu 0.270124 0.593671 0.5 98 63.546 0.00281879 -3.51099 63.546000 Cu 0.221798 0.609232 0 124 63.546 0.00441925 -3.50915 63.546000 Cu 0.318135 0.577933 6.17498e-16 95 63.546 0.0137174 -3.51295 63.546000 Cu 0.331109 0.605571 5.26704e-16 96 63.546 0.00402159 -3.5127 63.546000 Cu 0.379135 0.590093 0.5 97 63.546 0.0104281 -3.51293 63.546000 Cu 0.440386 0.602489 0 99 63.546 0.00436705 -3.51205 63.546000 Cu 0.488603 0.587487 0.5 72 63.546 0.00275764 -3.51076 63.546000 Cu 0.550184 0.60002 4.94191e-16 70 63.546 0.00138136 -3.51007 63.546000 Cu 0.598795 0.585222 0.5 71 63.546 0.00838992 -3.50787 63.546000 Cu 0.611825 0.612355 0.5 76 63.546 0.00329562 -3.50934 63.546000 Cu 0.660406 0.597365 4.91542e-16 73 63.546 0.0122451 -3.50725 63.546000 Cu 0.501832 0.614939 0.5 101 63.546 0.000921635 -3.51132 63.546000 Cu 0.770124 0.593671 1.3518e-15 44 63.546 0.00281879 -3.51099 63.546000 Cu 0.709068 0.582091 0.5 46 63.546 0.0169066 -3.50543 63.546000 Cu 0.721798 0.609232 0.5 75 63.546 0.00441925 -3.50915 63.546000 Cu 0.818135 0.577933 0.5 45 63.546 0.0137174 -3.51295 63.546000 Cu 0.831109 0.605571 0.5 50 63.546 0.00402159 -3.5127 63.546000 Cu 0.988603 0.587487 7.40805e-16 25 63.546 0.00275764 -3.51076 63.546000 Cu 0.879135 0.590093 3.5812e-16 47 63.546 0.0104281 -3.51293 63.546000 Cu 0.940386 0.602489 0.5 49 63.546 0.00436705 -3.51205 63.546000 Cu 0.0148715 0.642344 1 52 63.546 0.000449028 -3.51157 63.546000 Cu 0.0633272 0.627317 0.5 53 63.546 0.000513313 -3.51073 63.546000 Cu 0.124758 0.639578 1 55 63.546 0.0012922 -3.51035 63.546000 Cu 0.234625 0.636472 0 125 63.546 0.00118899 -3.51052 63.546000 Cu 0.282988 0.621076 0.5 126 63.546 0.00085364 -3.51143 63.546000 Cu 0.173304 0.624487 0.5 127 63.546 0.00385117 -3.50936 63.546000 Cu 0.295841 0.648459 0.5 131 63.546 0.000295758 -3.51163 63.546000 Cu 0.186124 0.651716 0.5 157 63.546 0.00128433 -3.51045 63.546000 Cu 0.453528 0.63001 3.69199e-16 100 63.546 0.0018132 -3.51215 63.546000 Cu 0.392264 0.617714 0.5 102 63.546 0.00384291 -3.51266 63.546000 Cu 0.344111 0.633087 1 128 63.546 0.00118323 -3.51236 63.546000 Cu 0.405288 0.645238 0.5 130 63.546 0.00120961 -3.51228 63.546000 Cu 0.563327 0.627317 2.16991e-16 103 63.546 0.000513313 -3.51073 63.546000 Cu 0.624758 0.639578 0.5 105 63.546 0.0012922 -3.51035 63.546000 Cu 0.514872 0.642344 0.5 106 63.546 0.000449028 -3.51157 63.546000 Cu 0.673304 0.624487 1.14083e-15 74 63.546 0.00385117 -3.50936 63.546000 Cu 0.782988 0.621076 1 77 63.546 0.00085364 -3.51143 63.546000 Cu 0.795841 0.648459 1 78 63.546 0.000295758 -3.51163 63.546000 Cu 0.734625 0.636472 0.5 80 63.546 0.00118899 -3.51052 63.546000 Cu 0.686124 0.651716 0 107 63.546 0.00128433 -3.51045 63.546000 Cu 0.892264 0.617714 0 48 63.546 0.00384291 -3.51266 63.546000 Cu 0.953528 0.63001 0.5 54 63.546 0.0018132 -3.51215 63.546000 Cu 0.844111 0.633087 0.5 79 63.546 0.00118323 -3.51236 63.546000 Cu 0.905288 0.645238 1.445e-18 81 63.546 0.00120961 -3.51228 63.546000 Cu 0.137671 0.666858 1 56 63.546 0.000533431 -3.51079 63.546000 Cu 0.0762521 0.654636 0.5 57 63.546 0.000194137 -3.5111 63.546000 Cu 0.0278399 0.669743 1 85 63.546 0.000170813 -3.51162 63.546000 Cu 0.0891463 0.681975 0.5 87 63.546 0.000158088 -3.51129 63.546000 Cu 0.247471 0.66377 0 158 63.546 0.000401084 -3.51098 63.546000 Cu 0.260137 0.691113 1 159 63.546 0.000139416 -3.51124 63.546000 Cu 0.308656 0.675857 0.5 160 63.546 0.000138276 -3.51161 63.546000 Cu 0.198978 0.678998 0.5 161 63.546 0.00042159 -3.5108 63.546000 Cu 0.357016 0.660546 2.47818e-16 129 63.546 0.000326244 -3.51196 63.546000 Cu 0.466511 0.657484 5.73667e-16 132 63.546 0.000562761 -3.51194 63.546000 Cu 0.479453 0.684913 1 133 63.546 0.000306374 -3.51178 63.546000 Cu 0.418206 0.672703 0.5 135 63.546 0.000459201 -3.51197 63.546000 Cu 0.369827 0.687981 1 162 63.546 0.000171961 -3.51201 63.546000 Cu 0.576252 0.654636 1 104 63.546 0.000194137 -3.5111 63.546000 Cu 0.637671 0.666858 0.5 110 63.546 0.000533431 -3.51079 63.546000 Cu 0.52784 0.669743 0.5 134 63.546 0.000170813 -3.51162 63.546000 Cu 0.589146 0.681975 4.81668e-19 136 63.546 0.000158088 -3.51129 63.546000 Cu 0.698978 0.678998 1 108 63.546 0.00042159 -3.5108 63.546000 Cu 0.747471 0.66377 0.5 109 63.546 0.000401084 -3.51098 63.546000 Cu 0.808656 0.675857 6.18462e-16 111 63.546 0.000138276 -3.51161 63.546000 Cu 0.760137 0.691113 0.5 114 63.546 0.000139416 -3.51124 63.546000 Cu 0.918206 0.672703 8.64112e-16 82 63.546 0.000459201 -3.51197 63.546000 Cu 0.966511 0.657484 0.5 83 63.546 0.000562761 -3.51194 63.546000 Cu 0.857016 0.660546 0.5 84 63.546 0.000326244 -3.51196 63.546000 Cu 0.979453 0.684913 0.5 88 63.546 0.000306374 -3.51178 63.546000 Cu 0.869827 0.687981 0.5 113 63.546 0.000171961 -3.51201 63.546000 Cu 0.0406079 0.697135 2.46855e-16 86 63.546 0.000126867 -3.51159 63.546000 Cu 0.1017 0.709349 0.5 91 63.546 5.63704e-05 -3.51153 63.546000 Cu 0.0530108 0.724541 3.32351e-16 119 63.546 2.90924e-05 -3.51173 63.546000 Cu 0.150342 0.694174 1.1088e-15 89 63.546 0.000173838 -3.51116 63.546000 Cu 0.162763 0.721531 7.53329e-16 90 63.546 4.73068e-05 -3.5113 63.546000 Cu 0.211496 0.706326 0.5 190 63.546 6.86638e-05 -3.5112 63.546000 Cu 0.27255 0.71847 1.01728e-15 191 63.546 1.99656e-05 -3.5114 63.546000 Cu 0.321247 0.703244 0.5 165 63.546 7.8689e-05 -3.51172 63.546000 Cu 0.382289 0.715391 1 163 63.546 1.6431e-05 -3.51182 63.546000 Cu 0.430962 0.700136 0.5 164 63.546 0.000290317 -3.51194 63.546000 Cu 0.443298 0.727557 0.5 169 63.546 0.00010012 -3.5118 63.546000 Cu 0.491981 0.712334 1 166 63.546 6.5216e-05 -3.51182 63.546000 Cu 0.333626 0.730631 0.5 193 63.546 3.88597e-05 -3.51154 63.546000 Cu 0.6017 0.709349 6.88785e-17 137 63.546 5.63704e-05 -3.51153 63.546000 Cu 0.540608 0.697135 0.5 139 63.546 0.000126867 -3.51159 63.546000 Cu 0.553011 0.724541 0.5 168 63.546 2.90924e-05 -3.51173 63.546000 Cu 0.650342 0.694174 0.5 138 63.546 0.000173838 -3.51116 63.546000 Cu 0.662763 0.721531 0.5 143 63.546 4.73068e-05 -3.5113 63.546000 Cu 0.711496 0.706326 1 140 63.546 6.86638e-05 -3.5112 63.546000 Cu 0.77255 0.71847 0.5 142 63.546 1.99656e-05 -3.5114 63.546000 Cu 0.821247 0.703244 4.14957e-16 112 63.546 7.8689e-05 -3.51172 63.546000 Cu 0.991981 0.712334 0.5 117 63.546 6.5216e-05 -3.51182 63.546000 Cu 0.930962 0.700136 1 115 63.546 0.000290317 -3.51194 63.546000 Cu 0.943298 0.727557 3.62455e-16 116 63.546 0.00010012 -3.5118 63.546000 Cu 0.882289 0.715391 0.5 118 63.546 1.6431e-05 -3.51182 63.546000 Cu 0.833626 0.730631 0 144 63.546 3.88597e-05 -3.51154 63.546000 Cu 0.065504 0.75196 1 120 63.546 9.47265e-05 -3.51188 63.546000 Cu 0.114086 0.73673 0.5 121 63.546 6.11888e-05 -3.51149 63.546000 Cu 0.00440008 0.739755 0.5 122 63.546 2.12751e-05 -3.51185 63.546000 Cu 0.126512 0.764128 0.5 123 63.546 9.69303e-05 -3.51157 63.546000 Cu 0.0168076 0.7672 0.5 150 63.546 3.66045e-05 -3.51208 63.546000 Cu 0.285043 0.745844 1.26269e-15 192 63.546 0.000106307 -3.51128 63.546000 Cu 0.223871 0.73368 0.5 194 63.546 1.14202e-05 -3.51119 63.546000 Cu 0.175227 0.748887 1.10808e-15 222 63.546 7.61543e-05 -3.51115 63.546000 Cu 0.236279 0.761023 0.5 224 63.546 0.000176498 -3.5111 63.546000 Cu 0.394735 0.742804 1.11e-15 195 63.546 2.06805e-05 -3.51163 63.546000 Cu 0.455814 0.754992 0.5 197 63.546 5.2049e-05 -3.51186 63.546000 Cu 0.346117 0.758026 0.5 198 63.546 0.00013812 -3.51147 63.546000 Cu 0.5044 0.739755 1.75327e-16 167 63.546 2.12751e-05 -3.51185 63.546000 Cu 0.614086 0.73673 1 170 63.546 6.11888e-05 -3.51149 63.546000 Cu 0.626512 0.764128 1 171 63.546 9.69303e-05 -3.51157 63.546000 Cu 0.565504 0.75196 0.5 173 63.546 9.47265e-05 -3.51188 63.546000 Cu 0.516808 0.7672 1 199 63.546 3.66045e-05 -3.51208 63.546000 Cu 0.723871 0.73368 5.01898e-16 141 63.546 1.14202e-05 -3.51119 63.546000 Cu 0.785043 0.745844 0.5 147 63.546 0.000106307 -3.51128 63.546000 Cu 0.675227 0.748887 0.5 172 63.546 7.61543e-05 -3.51115 63.546000 Cu 0.736279 0.761023 1 174 63.546 0.000176498 -3.5111 63.546000 Cu 0.846117 0.758026 1.2138e-16 145 63.546 0.00013812 -3.51147 63.546000 Cu 0.894735 0.742804 0.5 146 63.546 2.06805e-05 -3.51163 63.546000 Cu 0.955814 0.754992 5.18756e-16 148 63.546 5.2049e-05 -3.51186 63.546000 Cu 0.0777709 0.779403 8.85547e-16 152 63.546 0.000235742 -3.51193 63.546000 Cu 0.138761 0.791533 0.5 154 63.546 8.75737e-05 -3.51148 63.546000 Cu 0.0291241 0.794674 0.5 155 63.546 0.000341047 -3.51217 63.546000 Cu 0.0900655 0.806854 8.75913e-16 153 63.546 0.000453425 -3.5119 63.546000 Cu 0.187476 0.776244 8.71819e-17 223 63.546 0.000213893 -3.51121 63.546000 Cu 0.297312 0.7732 8.34731e-16 225 63.546 4.97825e-05 -3.5112 63.546000 Cu 0.309584 0.80054 1 226 63.546 0.000321954 -3.51081 63.546000 Cu 0.248521 0.788372 0.5 228 63.546 0.000416271 -3.51096 63.546000 Cu 0.199747 0.803605 7.35748e-16 256 63.546 0.000495481 -3.51106 63.546000 Cu 0.407128 0.77022 7.95234e-16 196 63.546 7.47325e-05 -3.51169 63.546000 Cu 0.468117 0.782437 0.5 202 63.546 8.94092e-05 -3.51203 63.546000 Cu 0.358373 0.785403 0.5 227 63.546 6.91029e-05 -3.51125 63.546000 Cu 0.419472 0.797641 1 229 63.546 0.000228878 -3.51177 63.546000 Cu 0.529124 0.794674 1 200 63.546 0.000341047 -3.51217 63.546000 Cu 0.577771 0.779403 0.5 201 63.546 0.000235742 -3.51193 63.546000 Cu 0.638761 0.791533 2.15787e-16 203 63.546 8.75737e-05 -3.51148 63.546000 Cu 0.590065 0.806854 0.5 206 63.546 0.000453425 -3.5119 63.546000 Cu 0.748521 0.788372 7.43695e-16 175 63.546 0.000416271 -3.51096 63.546000 Cu 0.797312 0.7732 0.5 176 63.546 4.97825e-05 -3.5112 63.546000 Cu 0.687476 0.776244 0.5 177 63.546 0.000213893 -3.51121 63.546000 Cu 0.809584 0.80054 0.5 181 63.546 0.000321954 -3.51081 63.546000 Cu 0.699747 0.803605 0.5 205 63.546 0.000495481 -3.51106 63.546000 Cu 0.968117 0.782437 1 149 63.546 8.94092e-05 -3.51203 63.546000 Cu 0.907128 0.77022 0.5 151 63.546 7.47325e-05 -3.51169 63.546000 Cu 0.858373 0.785403 6.16294e-16 178 63.546 6.91029e-05 -3.51125 63.546000 Cu 0.919472 0.797641 0.5 180 63.546 0.000228878 -3.51177 63.546000 Cu 0.0414284 0.822186 0.5 184 63.546 0.00139043 -3.51236 63.546000 Cu 0.102306 0.834347 1 186 63.546 0.00127587 -3.51217 63.546000 Cu 0.150946 0.81894 0.5 156 63.546 0.000269916 -3.51147 63.546000 Cu 0.211861 0.830946 0 257 63.546 0.00145656 -3.51062 63.546000 Cu 0.260725 0.815695 0.5 258 63.546 0.00112506 -3.51057 63.546000 Cu 0.272925 0.842962 0.5 262 63.546 0.00377957 -3.50962 63.546000 Cu 0.321801 0.827843 1.28654e-15 259 63.546 0.00131218 -3.51044 63.546000 Cu 0.431773 0.825077 1.10615e-15 230 63.546 0.000493519 -3.51179 63.546000 Cu 0.480501 0.809923 0.5 231 63.546 0.000652544 -3.51227 63.546000 Cu 0.370691 0.812768 0.5 232 63.546 0.00024353 -3.51117 63.546000 Cu 0.382983 0.840116 0.5 261 63.546 0.000807853 -3.51092 63.546000 Cu 0.492821 0.837443 0.5 236 63.546 0.00222645 -3.51224 63.546000 Cu 0.541428 0.822186 1 233 63.546 0.00139043 -3.51236 63.546000 Cu 0.602306 0.834347 0.5 235 63.546 0.00127587 -3.51217 63.546000 Cu 0.650946 0.81894 7.41046e-16 204 63.546 0.000269916 -3.51147 63.546000 Cu 0.760725 0.815695 1 207 63.546 0.00112506 -3.51057 63.546000 Cu 0.772925 0.842962 0 208 63.546 0.00377957 -3.50962 63.546000 Cu 0.711861 0.830946 0.5 210 63.546 0.00145656 -3.51062 63.546000 Cu 0.821801 0.827843 0.5 209 63.546 0.00131218 -3.51044 63.546000 Cu 0.992821 0.837443 1 183 63.546 0.00222645 -3.51224 63.546000 Cu 0.870691 0.812768 3.02728e-16 179 63.546 0.00024353 -3.51117 63.546000 Cu 0.980501 0.809923 1.478e-15 182 63.546 0.000652544 -3.51227 63.546000 Cu 0.931773 0.825077 0.5 185 63.546 0.000493519 -3.51179 63.546000 Cu 0.882983 0.840116 1 211 63.546 0.000807853 -3.51092 63.546000 Cu 0.114896 0.86192 9.86697e-16 187 63.546 0.0040267 -3.51253 63.546000 Cu 0.0538658 0.849751 0.5 189 63.546 0.00398901 -3.51254 63.546000 Cu 0.00558831 0.865014 1 215 63.546 0.00490836 -3.51194 63.546000 Cu 0.0667815 0.877431 0.5 217 63.546 0.01059 -3.51259 63.546000 Cu 0.163204 0.846371 0.5 188 63.546 0.000911641 -3.51145 63.546000 Cu 0.224223 0.858254 0 286 63.546 0.0043549 -3.50939 63.546000 Cu 0.285535 0.87014 0.5 288 63.546 0.0120044 -3.50766 63.546000 Cu 0.175818 0.873847 0.5 289 63.546 0.00276362 -3.51077 63.546000 Cu 0.334244 0.855104 0 260 63.546 0.00387463 -3.50964 63.546000 Cu 0.444272 0.852533 3.29461e-16 263 63.546 0.0011196 -3.5114 63.546000 Cu 0.457269 0.880033 0 264 63.546 0.002601 -3.51053 63.546000 Cu 0.395755 0.867465 0.5 266 63.546 0.00145734 -3.51017 63.546000 Cu 0.347101 0.882293 1 290 63.546 0.00918677 -3.50828 63.546000 Cu 0.553866 0.849751 1.00669e-16 234 63.546 0.00398901 -3.51254 63.546000 Cu 0.614896 0.86192 0.5 240 63.546 0.0040267 -3.51253 63.546000 Cu 0.505588 0.865014 0.5 265 63.546 0.00490836 -3.51194 63.546000 Cu 0.566782 0.877431 8.62908e-16 267 63.546 0.01059 -3.51259 63.546000 Cu 0.663204 0.846371 1 237 63.546 0.000911641 -3.51145 63.546000 Cu 0.675818 0.873847 6.17498e-16 238 63.546 0.00276362 -3.51077 63.546000 Cu 0.724223 0.858254 0.5 239 63.546 0.0043549 -3.50939 63.546000 Cu 0.785535 0.87014 1 241 63.546 0.0120044 -3.50766 63.546000 Cu 0.895755 0.867465 1 212 63.546 0.00145734 -3.51017 63.546000 Cu 0.944272 0.852533 0.5 213 63.546 0.0011196 -3.5114 63.546000 Cu 0.834244 0.855104 0.5 214 63.546 0.00387463 -3.50964 63.546000 Cu 0.957269 0.880033 0.5 218 63.546 0.002601 -3.51053 63.546000 Cu 0.847101 0.882293 0.5 243 63.546 0.00918677 -3.50828 63.546000 Cu 0.0186777 0.892698 0 216 63.546 0.0115028 -3.51111 63.546000 Cu 0.127725 0.889622 1 219 63.546 0.0141048 -3.51239 63.546000 Cu 0.140367 0.917574 4.62883e-16 220 63.546 0.0518032 -3.50983 63.546000 Cu 0.0797457 0.905316 0.5 221 63.546 0.0309071 -3.51155 63.546000 Cu 0.0317065 0.920573 1 249 63.546 0.0260781 -3.50807 63.546000 Cu 0.236796 0.885458 1 287 63.546 0.0162405 -3.50569 63.546000 Cu 0.298179 0.897156 0.5 293 63.546 0.0377686 -3.50337 63.546000 Cu 0.188265 0.901376 0.5 309 63.546 0.0122535 -3.50744 63.546000 Cu 0.249002 0.912433 1 310 63.546 0.0780655 -3.49258 63.546000 Cu 0.359853 0.909379 1 291 63.546 0.0184651 -3.5066 63.546000 Cu 0.408739 0.894794 0.5 292 63.546 0.00295434 -3.50909 63.546000 Cu 0.470326 0.90759 2.16751e-18 294 63.546 0.0057448 -3.50889 63.546000 Cu 0.421579 0.922116 0.5 297 63.546 0.00513342 -3.50749 63.546000 Cu 0.579746 0.905316 1.66609e-15 268 63.546 0.0309071 -3.51155 63.546000 Cu 0.627725 0.889622 0.5 269 63.546 0.0141048 -3.51239 63.546000 Cu 0.518678 0.892698 0.5 270 63.546 0.0115028 -3.51111 63.546000 Cu 0.640367 0.917574 0.5 274 63.546 0.0518032 -3.50983 63.546000 Cu 0.531707 0.920573 0.5 296 63.546 0.0260781 -3.50807 63.546000 Cu 0.798179 0.897156 5.09846e-16 242 63.546 0.0377686 -3.50337 63.546000 Cu 0.736796 0.885458 0.5 244 63.546 0.0162405 -3.50569 63.546000 Cu 0.688265 0.901376 1.63526e-16 271 63.546 0.0122535 -3.50744 63.546000 Cu 0.749002 0.912433 0.5 273 63.546 0.0780655 -3.49258 63.546000 Cu 0.908739 0.894794 1 245 63.546 0.00295434 -3.50909 63.546000 Cu 0.970326 0.90759 0.5 247 63.546 0.0057448 -3.50889 63.546000 Cu 0.859853 0.909379 0.5 248 63.546 0.0184651 -3.5066 63.546000 Cu 0.921579 0.922116 7.39842e-16 246 63.546 0.00513342 -3.50749 63.546000 Cu 0.0443218 0.9487 2.45651e-16 250 63.546 0.0575044 -3.49594 63.546000 Cu 0.0925948 0.933599 0.5 251 63.546 0.0953584 -3.50371 63.546000 Cu 0.152944 0.94606 0 253 63.546 0.255152 -3.48019 63.546000 Cu 0.260822 0.938915 1 311 63.546 0.454741 -3.44177 63.546000 Cu 0.310526 0.923913 0.5 312 63.546 0.118402 -3.49547 63.546000 Cu 0.200051 0.929101 0.5 313 63.546 0.0685412 -3.48999 63.546000 Cu 0.210889 0.957448 0.5 324 63.546 5.71479 -3.37297 63.546000 Cu 0.32305 0.950364 0.5 317 63.546 0.385065 -3.47556 63.546000 Cu 0.483156 0.935244 4.68904e-16 295 63.546 0.010824 -3.50376 63.546000 Cu 0.372497 0.936363 5.63311e-16 314 63.546 0.0272894 -3.50546 63.546000 Cu 0.434038 0.949452 0.5 316 63.546 0.0277155 -3.50422 63.546000 Cu 0.592595 0.933599 1 298 63.546 0.0953584 -3.50371 63.546000 Cu 0.544322 0.9487 0.5 301 63.546 0.0575044 -3.49594 63.546000 Cu 0.652944 0.94606 0.5 300 63.546 0.255152 -3.48019 63.546000 Cu 0.700051 0.929101 1 272 63.546 0.0685412 -3.48999 63.546000 Cu 0.810526 0.923913 4.00025e-16 275 63.546 0.118402 -3.49547 63.546000 Cu 0.760822 0.938915 0.5 278 63.546 0.454741 -3.44177 63.546000 Cu 0.710889 0.957448 4.42894e-16 302 63.546 5.71479 -3.37297 63.546000 Cu 0.82305 0.950364 0 276 63.546 0.385065 -3.47556 63.546000 Cu 0.983156 0.935244 0.5 252 63.546 0.010824 -3.50376 63.546000 Cu 0.872497 0.936363 0.5 277 63.546 0.0272894 -3.50546 63.546000 Cu 0.934038 0.949452 1 279 63.546 0.0277155 -3.50422 63.546000 Cu 0.105129 0.96256 0.5 255 63.546 0.394389 -3.4697 63.546000 Cu 0.0526208 0.976919 1.45777e-15 283 63.546 0.246902 -3.49405 63.546000 Cu 0.104884 0.99133 0.5 284 63.546 0.392135 -3.4692 63.546000 Cu 0.168572 0.976934 1 254 63.546 4.65105 -3.45691 63.546000 Cu 0.274077 0.964383 1 325 63.546 7.11998 -3.22962 63.546000 Cu 0.273651 0.989475 0 326 63.546 7.09621 -3.23297 63.546000 Cu 0.210562 0.996511 0.5 328 63.546 5.76035 -3.37311 63.546000 Cu 0.329771 0.976942 0.5 327 63.546 3.40823 -3.4343 63.546000 Cu 0.383733 0.963372 1 315 63.546 0.110608 -3.50581 63.546000 Cu 0.440625 0.976911 0.5 321 63.546 0.127899 -3.51315 63.546000 Cu 0.383444 0.990472 0 329 63.546 0.103992 -3.50544 63.546000 Cu 0.494277 0.963042 1.78458e-16 318 63.546 0.0908405 -3.50489 63.546000 Cu 0.494059 0.990791 1 319 63.546 0.0884427 -3.50464 63.546000 Cu 0.605129 0.96256 0 299 63.546 0.394389 -3.4697 63.546000 Cu 0.552621 0.976919 0.5 320 63.546 0.246902 -3.49405 63.546000 Cu 0.604884 0.99133 8.11611e-17 322 63.546 0.392135 -3.4692 63.546000 Cu 0.710562 0.996511 1 303 63.546 5.76035 -3.37311 63.546000 Cu 0.774077 0.964383 0.5 304 63.546 7.11998 -3.22962 63.546000 Cu 0.668572 0.976934 0.5 305 63.546 4.65105 -3.45691 63.546000 Cu 0.773651 0.989475 0.5 308 63.546 7.09621 -3.23297 63.546000 Cu 0.829771 0.976942 0 306 63.546 3.40823 -3.4343 63.546000 Cu 0.994277 0.963042 0.5 281 63.546 0.0908405 -3.50489 63.546000 Cu 0.994059 0.990791 0.5 285 63.546 0.0884427 -3.50464 63.546000 Cu 0.940625 0.976911 4.89856e-16 280 63.546 0.127899 -3.51315 63.546000 Cu 0.883733 0.963372 0.5 282 63.546 0.110608 -3.50581 63.546000 Cu 0.883444 0.990472 0.5 307 63.546 0.103992 -3.50544