Number of particles = 796 A = 1 Angstrom (basic length-scale) H0(1,1) = 25.7912 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 102.936 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62856 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 0.00370266 0.00505896 1.03025e-16 408 63.546 0.0871558 -3.28152 63.546000 Cu 0.139983 0.00504866 1 410 63.546 6.33442 -2.98294 63.546000 Cu 0.0717581 0.00506193 0.5 411 63.546 0.615059 -3.28108 63.546000 Cu 0.00561436 0.0229414 0.5 422 63.546 0.211722 -3.27263 63.546000 Cu 0.0764484 0.0222908 3.37042e-17 424 63.546 0.459801 -3.24889 63.546000 Cu 0.161305 0.035532 3.37042e-17 425 63.546 0.0178193 -3.27794 63.546000 Cu 0.15179 0.0195761 0.5 426 63.546 3.9946 -3.16262 63.546000 Cu 0.0869771 0.0385658 0.5 427 63.546 0.0964976 -3.2649 63.546000 Cu 0.224337 0.0162736 1.9123e-17 428 63.546 9.38905 -2.98065 63.546000 Cu 0.306061 0.0269194 1.05176e-16 429 63.546 0.908514 -3.15929 63.546000 Cu 0.290118 0.00499802 0.5 430 63.546 6.82959 -3.09337 63.546000 Cu 0.236408 0.0320271 0.5 431 63.546 0.783588 -3.19088 63.546000 Cu 0.362411 0.00506665 2.39037e-17 432 63.546 0.872678 -3.23771 63.546000 Cu 0.436073 0.0234188 8.65314e-17 433 63.546 0.21747 -3.27396 63.546000 Cu 0.433718 0.00505915 0.5 434 63.546 0.130743 -3.28003 63.546000 Cu 0.368635 0.0242232 0.5 435 63.546 0.312725 -3.21024 63.546000 Cu 0.503703 0.00505896 1.23343e-16 436 63.546 0.0871558 -3.28152 63.546000 Cu 0.639983 0.00504866 2.4071e-16 403 63.546 6.33442 -2.98294 63.546000 Cu 0.65179 0.0195761 0.5 405 63.546 3.9946 -3.16262 63.546000 Cu 0.661305 0.035532 2.12743e-16 412 63.546 0.0178193 -3.27794 63.546000 Cu 0.576448 0.0222908 3.13617e-16 437 63.546 0.459801 -3.24889 63.546000 Cu 0.571758 0.00506193 0.5 438 63.546 0.615059 -3.28108 63.546000 Cu 0.505614 0.0229414 0.5 439 63.546 0.211722 -3.27263 63.546000 Cu 0.586977 0.0385658 0.5 466 63.546 0.0964976 -3.2649 63.546000 Cu 0.724337 0.0162736 1.85254e-16 404 63.546 9.38905 -2.98065 63.546000 Cu 0.790118 0.00499802 0.5 407 63.546 6.82959 -3.09337 63.546000 Cu 0.736408 0.0320271 0.5 414 63.546 0.783588 -3.19088 63.546000 Cu 0.806061 0.0269194 4.87636e-17 416 63.546 0.908514 -3.15929 63.546000 Cu 0.862411 0.00506665 2.00791e-17 406 63.546 0.872678 -3.23771 63.546000 Cu 0.933718 0.00505915 0.5 409 63.546 0.130743 -3.28003 63.546000 Cu 0.868635 0.0242232 0.5 418 63.546 0.312725 -3.21024 63.546000 Cu 0.936073 0.0234188 1.38642e-17 420 63.546 0.21747 -3.27396 63.546000 Cu 0.0140845 0.0405353 1.43422e-17 421 63.546 0.174806 -3.26988 63.546000 Cu 0.0384515 0.0751234 1 449 63.546 0.00643644 -3.2806 63.546000 Cu 0.0261438 0.0578787 0.5 450 63.546 0.0540338 -3.27763 63.546000 Cu 0.0982163 0.0551528 3.37042e-17 452 63.546 0.0218415 -3.27627 63.546000 Cu 0.109824 0.0721505 0.5 455 63.546 0.015715 -3.28171 63.546000 Cu 0.181688 0.0692513 3.37042e-17 453 63.546 0.0482288 -3.28124 63.546000 Cu 0.172026 0.052099 0.5 454 63.546 0.0427771 -3.27545 63.546000 Cu 0.244894 0.0487815 6.93208e-18 456 63.546 0.191706 -3.27054 63.546000 Cu 0.321055 0.0646242 1.10913e-16 457 63.546 0.0244043 -3.27989 63.546000 Cu 0.313949 0.0461414 0.5 458 63.546 0.14131 -3.26692 63.546000 Cu 0.252215 0.0667177 0.5 459 63.546 0.0305814 -3.27947 63.546000 Cu 0.379179 0.0438099 5.68908e-17 460 63.546 0.0450414 -3.2558 63.546000 Cu 0.456758 0.0602648 5.37834e-17 461 63.546 0.0521219 -3.27648 63.546000 Cu 0.44508 0.0420236 0.5 462 63.546 0.113 -3.26688 63.546000 Cu 0.388908 0.0624471 0.5 463 63.546 0.0414858 -3.27929 63.546000 Cu 0.468215 0.0778767 0.5 491 63.546 0.0192138 -3.28017 63.546000 Cu 0.514085 0.0405353 1.76648e-16 464 63.546 0.174806 -3.26988 63.546000 Cu 0.598216 0.0551528 9.13122e-17 465 63.546 0.0218415 -3.27627 63.546000 Cu 0.526144 0.0578787 0.5 467 63.546 0.0540338 -3.27763 63.546000 Cu 0.538451 0.0751234 9.70491e-17 493 63.546 0.00643644 -3.2806 63.546000 Cu 0.609824 0.0721505 0.5 495 63.546 0.015715 -3.28171 63.546000 Cu 0.744894 0.0487815 7.93603e-17 413 63.546 0.191706 -3.27054 63.546000 Cu 0.672026 0.052099 0.5 415 63.546 0.0427771 -3.27545 63.546000 Cu 0.813949 0.0461414 0.5 419 63.546 0.14131 -3.26692 63.546000 Cu 0.681688 0.0692513 1.76887e-17 440 63.546 0.0482288 -3.28124 63.546000 Cu 0.752215 0.0667177 0.5 442 63.546 0.0305814 -3.27947 63.546000 Cu 0.821055 0.0646242 1 444 63.546 0.0244043 -3.27989 63.546000 Cu 0.879179 0.0438099 0 417 63.546 0.0450414 -3.2558 63.546000 Cu 0.94508 0.0420236 0.5 423 63.546 0.113 -3.26688 63.546000 Cu 0.888908 0.0624471 0.5 446 63.546 0.0414858 -3.27929 63.546000 Cu 0.956758 0.0602648 0 448 63.546 0.0521219 -3.27648 63.546000 Cu 0.968215 0.0778767 0.5 451 63.546 0.0192138 -3.28017 63.546000 Cu 0.0604988 0.109768 3.37042e-17 478 63.546 0.00514899 -3.28351 63.546000 Cu 0.0499381 0.0923728 0.5 479 63.546 0.00337102 -3.28249 63.546000 Cu 0.120563 0.0895148 3.37042e-17 481 63.546 0.0158003 -3.28385 63.546000 Cu 0.130493 0.107131 0.5 484 63.546 0.00554479 -3.28329 63.546000 Cu 0.200043 0.1047 3.37042e-17 482 63.546 0.00135163 -3.28257 63.546000 Cu 0.190732 0.0869023 0.5 483 63.546 0.0143844 -3.28318 63.546000 Cu 0.260258 0.0846506 1 485 63.546 0.00305496 -3.28165 63.546000 Cu 0.329523 0.0825187 0.5 487 63.546 0.00970079 -3.28143 63.546000 Cu 0.269445 0.102423 0.5 488 63.546 0.0029592 -3.28225 63.546000 Cu 0.339044 0.100154 3.37042e-17 486 63.546 0.00611033 -3.28191 63.546000 Cu 0.398756 0.080314 1 489 63.546 0.019419 -3.28104 63.546000 Cu 0.479318 0.095194 3.37042e-17 490 63.546 0.00304935 -3.28146 63.546000 Cu 0.409 0.0977921 0.5 492 63.546 0.00716791 -3.28148 63.546000 Cu 0.349236 0.117655 0.5 517 63.546 0.00273868 -3.28246 63.546000 Cu 0.419531 0.115144 6.11935e-17 519 63.546 0.00120129 -3.28259 63.546000 Cu 0.490052 0.112492 0.5 521 63.546 0.0010485 -3.28302 63.546000 Cu 0.620563 0.0895148 1 494 63.546 0.0158003 -3.28385 63.546000 Cu 0.549938 0.0923728 0.5 496 63.546 0.00337102 -3.28249 63.546000 Cu 0.560499 0.109768 4.5178e-17 523 63.546 0.00514899 -3.28351 63.546000 Cu 0.630493 0.107131 0.5 524 63.546 0.00554479 -3.28329 63.546000 Cu 0.760258 0.0846506 3.37042e-17 441 63.546 0.00305496 -3.28165 63.546000 Cu 0.690732 0.0869023 0.5 443 63.546 0.0143844 -3.28318 63.546000 Cu 0.829523 0.0825187 0.5 447 63.546 0.00970079 -3.28143 63.546000 Cu 0.700043 0.1047 0 469 63.546 0.00135163 -3.28257 63.546000 Cu 0.769445 0.102423 0.5 471 63.546 0.0029592 -3.28225 63.546000 Cu 0.898756 0.080314 1 445 63.546 0.019419 -3.28104 63.546000 Cu 0.839044 0.100154 3.37042e-17 473 63.546 0.00611033 -3.28191 63.546000 Cu 0.919531 0.115144 3.37042e-17 474 63.546 0.00120129 -3.28259 63.546000 Cu 0.909 0.0977921 0.5 475 63.546 0.00716791 -3.28148 63.546000 Cu 0.849236 0.117655 0.5 476 63.546 0.00273868 -3.28246 63.546000 Cu 0.979318 0.095194 3.37042e-17 477 63.546 0.00304935 -3.28146 63.546000 Cu 0.990052 0.112492 0.5 480 63.546 0.0010485 -3.28302 63.546000 Cu 0.000388036 0.129897 3.37042e-17 507 63.546 0.00168308 -3.28361 63.546000 Cu 0.0803309 0.144895 1.57765e-17 508 63.546 0.000464306 -3.28311 63.546000 Cu 0.0705164 0.127304 0.5 509 63.546 0.00244743 -3.28339 63.546000 Cu 0.0103912 0.147395 0.5 510 63.546 0.000951028 -3.28346 63.546000 Cu 0.140235 0.124814 9.56149e-19 511 63.546 0.00070838 -3.28275 63.546000 Cu 0.150042 0.142455 0.5 514 63.546 0.000199432 -3.2827 63.546000 Cu 0.219712 0.140035 3.34652e-18 512 63.546 0.000812996 -3.28255 63.546000 Cu 0.209736 0.122424 0.5 513 63.546 0.00079593 -3.28245 63.546000 Cu 0.279341 0.120061 3.37042e-17 515 63.546 0.00239605 -3.28238 63.546000 Cu 0.289544 0.137591 0.5 518 63.546 0.00104581 -3.28262 63.546000 Cu 0.229825 0.157572 0.5 542 63.546 0.000455091 -3.28276 63.546000 Cu 0.299801 0.155072 1 544 63.546 0.000281746 -3.28288 63.546000 Cu 0.35965 0.135093 3.37042e-17 516 63.546 0.000591477 -3.28289 63.546000 Cu 0.430004 0.132517 0.5 522 63.546 0.000325467 -3.28329 63.546000 Cu 0.369953 0.152527 0.5 546 63.546 0.000104284 -3.28315 63.546000 Cu 0.440211 0.149953 3.37042e-17 548 63.546 0.000492324 -3.28343 63.546000 Cu 0.500388 0.129897 3.37042e-17 520 63.546 0.00168308 -3.28361 63.546000 Cu 0.640235 0.124814 2.24695e-17 468 63.546 0.00070838 -3.28275 63.546000 Cu 0.650042 0.142455 0.5 498 63.546 0.000199432 -3.2827 63.546000 Cu 0.570516 0.127304 0.5 525 63.546 0.00244743 -3.28339 63.546000 Cu 0.510391 0.147395 0.5 550 63.546 0.000951028 -3.28346 63.546000 Cu 0.580331 0.144895 7.64919e-17 552 63.546 0.000464306 -3.28311 63.546000 Cu 0.779341 0.120061 1.17128e-17 470 63.546 0.00239605 -3.28238 63.546000 Cu 0.709736 0.122424 0.5 472 63.546 0.00079593 -3.28245 63.546000 Cu 0.719712 0.140035 6.4301e-17 499 63.546 0.000812996 -3.28255 63.546000 Cu 0.799801 0.155072 2.07962e-17 500 63.546 0.000281746 -3.28288 63.546000 Cu 0.789544 0.137591 0.5 501 63.546 0.00104581 -3.28262 63.546000 Cu 0.729825 0.157572 0.5 502 63.546 0.000455091 -3.28276 63.546000 Cu 0.85965 0.135093 1.52984e-17 503 63.546 0.000591477 -3.28289 63.546000 Cu 0.940211 0.149953 5.01978e-18 504 63.546 0.000492324 -3.28343 63.546000 Cu 0.930004 0.132517 0.5 505 63.546 0.000325467 -3.28329 63.546000 Cu 0.869953 0.152527 0.5 506 63.546 0.000104284 -3.28315 63.546000 Cu 0.0202332 0.164937 2.84454e-17 536 63.546 0.000208872 -3.28321 63.546000 Cu 0.100002 0.180019 3.37042e-17 537 63.546 7.69049e-05 -3.28296 63.546000 Cu 0.0901385 0.162476 0.5 538 63.546 7.22325e-05 -3.28297 63.546000 Cu 0.0300836 0.182479 0.5 539 63.546 2.53096e-05 -3.28307 63.546000 Cu 0.159966 0.160034 2.94016e-17 540 63.546 0.000318848 -3.28279 63.546000 Cu 0.10994 0.197534 0.5 566 63.546 0.000104141 -3.28299 63.546000 Cu 0.239936 0.175063 3.37042e-17 541 63.546 0.000143133 -3.28293 63.546000 Cu 0.169942 0.177555 0.5 543 63.546 0.000191418 -3.2829 63.546000 Cu 0.309993 0.172538 0.5 547 63.546 3.64492e-05 -3.28306 63.546000 Cu 0.179946 0.195046 2.19914e-17 568 63.546 8.38952e-05 -3.283 63.546000 Cu 0.250008 0.192537 0.5 570 63.546 2.28615e-05 -3.28305 63.546000 Cu 0.320094 0.190011 3.37042e-17 572 63.546 3.8825e-05 -3.28314 63.546000 Cu 0.380101 0.169988 7.64919e-18 545 63.546 0.000119359 -3.28325 63.546000 Cu 0.45021 0.167443 0.5 551 63.546 0.000328851 -3.28332 63.546000 Cu 0.390152 0.187479 0.5 574 63.546 0.000115549 -3.28322 63.546000 Cu 0.460149 0.184962 7.17111e-19 576 63.546 0.000114649 -3.28319 63.546000 Cu 0.659966 0.160034 3.37042e-17 497 63.546 0.000318848 -3.28279 63.546000 Cu 0.520233 0.164937 7.81651e-17 549 63.546 0.000208872 -3.28321 63.546000 Cu 0.590138 0.162476 0.5 553 63.546 7.22325e-05 -3.28297 63.546000 Cu 0.530084 0.182479 0.5 578 63.546 2.53096e-05 -3.28307 63.546000 Cu 0.600002 0.180019 4.30267e-17 580 63.546 7.69049e-05 -3.28296 63.546000 Cu 0.60994 0.197534 0.5 581 63.546 0.000104141 -3.28299 63.546000 Cu 0.679946 0.195046 9.46587e-17 526 63.546 8.38952e-05 -3.283 63.546000 Cu 0.669942 0.177555 0.5 527 63.546 0.000191418 -3.2829 63.546000 Cu 0.739936 0.175063 5.8086e-17 528 63.546 0.000143133 -3.28293 63.546000 Cu 0.820094 0.190011 1.36251e-17 529 63.546 3.8825e-05 -3.28314 63.546000 Cu 0.809993 0.172538 0.5 530 63.546 3.64492e-05 -3.28306 63.546000 Cu 0.750008 0.192537 0.5 531 63.546 2.28615e-05 -3.28305 63.546000 Cu 0.880101 0.169988 3.37042e-17 532 63.546 0.000119359 -3.28325 63.546000 Cu 0.960149 0.184962 1.07567e-17 533 63.546 0.000114649 -3.28319 63.546000 Cu 0.95021 0.167443 0.5 534 63.546 0.000328851 -3.28332 63.546000 Cu 0.890152 0.187479 0.5 535 63.546 0.000115549 -3.28322 63.546000 Cu 0.0399982 0.20001 5.49785e-18 564 63.546 3.6845e-05 -3.28301 63.546000 Cu 0.119957 0.215025 7.88823e-18 565 63.546 3.5966e-05 -3.28298 63.546000 Cu 0.0499746 0.217518 0.5 567 63.546 3.6563e-05 -3.28297 63.546000 Cu 0.0599933 0.235009 1.43422e-17 594 63.546 7.4716e-06 -3.28302 63.546000 Cu 0.130004 0.232508 0.5 596 63.546 3.79929e-06 -3.28306 63.546000 Cu 0.260048 0.210007 9.32245e-18 569 63.546 1.26211e-05 -3.28306 63.546000 Cu 0.189987 0.212521 0.5 571 63.546 8.25976e-06 -3.28302 63.546000 Cu 0.330107 0.207491 0.5 575 63.546 4.79958e-05 -3.28311 63.546000 Cu 0.200029 0.23 2.00791e-17 598 63.546 1.38814e-05 -3.28312 63.546000 Cu 0.270054 0.227489 0.5 600 63.546 2.67409e-05 -3.28316 63.546000 Cu 0.400123 0.204983 3.37042e-17 573 63.546 5.17643e-05 -3.28312 63.546000 Cu 0.470078 0.202489 0.5 579 63.546 1.54684e-05 -3.28307 63.546000 Cu 0.340067 0.224984 1 602 63.546 2.08411e-05 -3.28316 63.546000 Cu 0.410055 0.222489 0.5 604 63.546 6.21602e-06 -3.2831 63.546000 Cu 0.480017 0.220002 3.37042e-17 606 63.546 1.26204e-05 -3.28302 63.546000 Cu 0.489997 0.237502 0.5 609 63.546 1.25331e-05 -3.28302 63.546000 Cu 0.42001 0.239993 2.15133e-18 603 63.546 1.04655e-05 -3.28308 63.546000 Cu 0.539998 0.20001 3.37042e-17 577 63.546 3.6845e-05 -3.28301 63.546000 Cu 0.559993 0.235009 3.37042e-17 607 63.546 7.4716e-06 -3.28302 63.546000 Cu 0.549975 0.217518 0.5 608 63.546 3.6563e-05 -3.28297 63.546000 Cu 0.619957 0.215025 4.78074e-18 610 63.546 3.5966e-05 -3.28298 63.546000 Cu 0.630004 0.232508 0.5 611 63.546 3.79929e-06 -3.28306 63.546000 Cu 0.700029 0.23 3.37042e-17 554 63.546 1.38814e-05 -3.28312 63.546000 Cu 0.689987 0.212521 0.5 555 63.546 8.25976e-06 -3.28302 63.546000 Cu 0.760048 0.210007 3.37042e-17 556 63.546 1.26211e-05 -3.28306 63.546000 Cu 0.830107 0.207491 0.5 558 63.546 4.79958e-05 -3.28311 63.546000 Cu 0.770054 0.227489 0.5 559 63.546 2.67409e-05 -3.28316 63.546000 Cu 0.840067 0.224984 2.43818e-17 557 63.546 2.08411e-05 -3.28316 63.546000 Cu 0.900123 0.204983 5.25882e-18 560 63.546 5.17643e-05 -3.28312 63.546000 Cu 0.980017 0.220002 1.67326e-18 561 63.546 1.26204e-05 -3.28302 63.546000 Cu 0.970078 0.202489 0.5 562 63.546 1.54684e-05 -3.28307 63.546000 Cu 0.910055 0.222489 0.5 563 63.546 6.21602e-06 -3.2831 63.546000 Cu 0.989997 0.237502 0.5 592 63.546 1.25331e-05 -3.28302 63.546000 Cu 0.92001 0.239993 2.50989e-17 590 63.546 1.04655e-05 -3.28308 63.546000 Cu 1.81429e-05 0.254992 3.37042e-17 591 63.546 1.74308e-07 -3.28302 63.546000 Cu 0.140028 0.249999 3.37042e-17 595 63.546 6.27252e-06 -3.28309 63.546000 Cu 0.0700224 0.252498 0.5 597 63.546 3.65868e-06 -3.28305 63.546000 Cu 0.0100316 0.272483 0.5 622 63.546 8.43684e-06 -3.28302 63.546000 Cu 0.0800183 0.269991 3.34652e-18 624 63.546 6.24682e-06 -3.28308 63.546000 Cu 0.150009 0.267494 0.5 626 63.546 2.32672e-06 -3.28314 63.546000 Cu 0.28003 0.244989 3.92021e-17 599 63.546 1.32768e-06 -3.28315 63.546000 Cu 0.210032 0.247494 0.5 601 63.546 3.97903e-06 -3.28314 63.546000 Cu 0.220006 0.264992 3.37042e-17 628 63.546 1.39663e-06 -3.28316 63.546000 Cu 0.290006 0.262487 0.5 630 63.546 4.45327e-06 -3.28314 63.546000 Cu 0.300018 0.279983 2.65331e-17 629 63.546 1.17128e-05 -3.2831 63.546000 Cu 0.350022 0.242488 0.5 605 63.546 4.29376e-06 -3.28313 63.546000 Cu 0.360009 0.259984 3.37042e-17 632 63.546 5.62246e-06 -3.2831 63.546000 Cu 0.440041 0.274976 3.37042e-17 633 63.546 6.14614e-06 -3.283 63.546000 Cu 0.430014 0.257486 0.5 634 63.546 2.08417e-06 -3.28305 63.546000 Cu 0.370037 0.277476 0.5 635 63.546 3.61337e-06 -3.28304 63.546000 Cu 0.500018 0.254992 1 636 63.546 1.74308e-07 -3.28302 63.546000 Cu 0.640028 0.249999 3.51385e-17 582 63.546 6.27252e-06 -3.28309 63.546000 Cu 0.650009 0.267494 0.5 585 63.546 2.32672e-06 -3.28314 63.546000 Cu 0.580018 0.269991 3.37042e-17 637 63.546 6.24682e-06 -3.28308 63.546000 Cu 0.570022 0.252498 0.5 638 63.546 3.65868e-06 -3.28305 63.546000 Cu 0.510032 0.272483 0.5 639 63.546 8.43684e-06 -3.28302 63.546000 Cu 0.720006 0.264992 8.60534e-17 583 63.546 1.39663e-06 -3.28316 63.546000 Cu 0.710032 0.247494 0.5 584 63.546 3.97903e-06 -3.28314 63.546000 Cu 0.78003 0.244989 2.39037e-17 586 63.546 1.32768e-06 -3.28315 63.546000 Cu 0.790006 0.262487 0.5 589 63.546 4.45327e-06 -3.28314 63.546000 Cu 0.800018 0.279983 3.37042e-17 616 63.546 1.17128e-05 -3.2831 63.546000 Cu 0.860009 0.259984 3.37042e-17 587 63.546 5.62246e-06 -3.2831 63.546000 Cu 0.850022 0.242488 0.5 588 63.546 4.29376e-06 -3.28313 63.546000 Cu 0.930014 0.257486 0.5 593 63.546 2.08417e-06 -3.28305 63.546000 Cu 0.870037 0.277476 0.5 618 63.546 3.61337e-06 -3.28304 63.546000 Cu 0.940041 0.274976 5.49785e-17 620 63.546 6.14614e-06 -3.283 63.546000 Cu 0.0200104 0.289982 2.22305e-17 621 63.546 1.03786e-05 -3.28305 63.546000 Cu 0.159973 0.284997 3.37042e-17 625 63.546 1.64421e-05 -3.28315 63.546000 Cu 0.0899779 0.287494 0.5 627 63.546 6.17557e-06 -3.28311 63.546000 Cu 0.0299664 0.307497 0.5 650 63.546 1.31604e-05 -3.28307 63.546000 Cu 0.0999253 0.305 5.95202e-17 652 63.546 4.17881e-05 -3.28311 63.546000 Cu 0.229992 0.282492 0.5 631 63.546 2.07611e-05 -3.28314 63.546000 Cu 0.169938 0.302489 0.5 654 63.546 3.2469e-05 -3.28311 63.546000 Cu 0.23999 0.299973 1.69716e-17 656 63.546 6.02878e-06 -3.28307 63.546000 Cu 0.320069 0.314943 3.37042e-17 657 63.546 4.77636e-05 -3.28302 63.546000 Cu 0.310045 0.297461 0.5 658 63.546 1.12143e-05 -3.28304 63.546000 Cu 0.250018 0.317449 0.5 659 63.546 1.88953e-05 -3.28306 63.546000 Cu 0.179951 0.319972 1 653 63.546 2.94131e-05 -3.28315 63.546000 Cu 0.380069 0.29496 3.37042e-17 660 63.546 3.49771e-05 -3.28302 63.546000 Cu 0.460032 0.309979 1.38642e-17 661 63.546 1.91275e-05 -3.28301 63.546000 Cu 0.450051 0.292468 0.5 662 63.546 3.12922e-05 -3.28302 63.546000 Cu 0.390076 0.312457 0.5 663 63.546 5.47602e-05 -3.283 63.546000 Cu 0.659973 0.284997 1.2908e-17 612 63.546 1.64421e-05 -3.28315 63.546000 Cu 0.52001 0.289982 2.10353e-17 664 63.546 1.03786e-05 -3.28305 63.546000 Cu 0.599925 0.305 3.37042e-17 665 63.546 4.17881e-05 -3.28311 63.546000 Cu 0.589978 0.287494 0.5 666 63.546 6.17557e-06 -3.28311 63.546000 Cu 0.529966 0.307497 0.5 667 63.546 1.31604e-05 -3.28307 63.546000 Cu 0.73999 0.299973 3.37042e-17 613 63.546 6.02878e-06 -3.28307 63.546000 Cu 0.729992 0.282492 0.5 614 63.546 2.07611e-05 -3.28314 63.546000 Cu 0.669938 0.302489 0.5 615 63.546 3.2469e-05 -3.28311 63.546000 Cu 0.810045 0.297461 0.5 619 63.546 1.12143e-05 -3.28304 63.546000 Cu 0.750018 0.317449 0.5 642 63.546 1.88953e-05 -3.28306 63.546000 Cu 0.820069 0.314943 6.50181e-17 644 63.546 4.77636e-05 -3.28302 63.546000 Cu 0.679951 0.319972 2.17524e-17 640 63.546 2.94131e-05 -3.28315 63.546000 Cu 0.880069 0.29496 1.36251e-17 617 63.546 3.49771e-05 -3.28302 63.546000 Cu 0.950051 0.292468 0.5 623 63.546 3.12922e-05 -3.28302 63.546000 Cu 0.890076 0.312457 0.5 646 63.546 5.47602e-05 -3.283 63.546000 Cu 0.960032 0.309979 4.25486e-17 648 63.546 1.91275e-05 -3.28301 63.546000 Cu 0.0399013 0.325017 3.37042e-17 649 63.546 8.50908e-05 -3.28316 63.546000 Cu 0.1099 0.322502 0.5 655 63.546 8.8472e-05 -3.28321 63.546000 Cu 0.0498322 0.342536 0.5 679 63.546 0.000310333 -3.28334 63.546000 Cu 0.119939 0.339993 3.37042e-17 681 63.546 0.000113536 -3.28327 63.546000 Cu 0.130077 0.357455 0.5 684 63.546 0.000111403 -3.28315 63.546000 Cu 0.200219 0.354913 4.30267e-18 682 63.546 0.000224473 -3.28285 63.546000 Cu 0.190044 0.337447 0.5 683 63.546 3.30631e-05 -3.28307 63.546000 Cu 0.260089 0.334924 0 685 63.546 0.000105392 -3.28294 63.546000 Cu 0.330079 0.332432 0.5 687 63.546 0.000157104 -3.28289 63.546000 Cu 0.270203 0.352413 0.5 688 63.546 0.000376269 -3.28275 63.546000 Cu 0.340083 0.349948 1 686 63.546 0.00030588 -3.28279 63.546000 Cu 0.400023 0.329964 3.37042e-17 689 63.546 8.21337e-05 -3.28292 63.546000 Cu 0.479818 0.345041 3.37042e-17 690 63.546 0.000184015 -3.28324 63.546000 Cu 0.469953 0.3275 0.5 691 63.546 2.30477e-05 -3.28304 63.546000 Cu 0.409916 0.347503 0.5 692 63.546 6.99442e-05 -3.28299 63.546000 Cu 0.539901 0.325017 4.54171e-18 693 63.546 8.50908e-05 -3.28316 63.546000 Cu 0.619939 0.339993 3.37042e-17 694 63.546 0.000113536 -3.28327 63.546000 Cu 0.6099 0.322502 0.5 695 63.546 8.8472e-05 -3.28321 63.546000 Cu 0.549832 0.342536 0.5 696 63.546 0.000310333 -3.28334 63.546000 Cu 0.630077 0.357455 0.5 724 63.546 0.000111403 -3.28315 63.546000 Cu 0.760089 0.334924 1 641 63.546 0.000105392 -3.28294 63.546000 Cu 0.690044 0.337447 0.5 643 63.546 3.30631e-05 -3.28307 63.546000 Cu 0.830079 0.332432 0.5 647 63.546 0.000157104 -3.28289 63.546000 Cu 0.700219 0.354913 3.37042e-17 669 63.546 0.000224473 -3.28285 63.546000 Cu 0.770203 0.352413 0.5 671 63.546 0.000376269 -3.28275 63.546000 Cu 0.900023 0.329964 8.10336e-17 645 63.546 8.21337e-05 -3.28292 63.546000 Cu 0.969953 0.3275 0.5 651 63.546 2.30477e-05 -3.28304 63.546000 Cu 0.840083 0.349948 4.06363e-17 673 63.546 0.00030588 -3.28279 63.546000 Cu 0.909916 0.347503 0.5 675 63.546 6.99442e-05 -3.28299 63.546000 Cu 0.979818 0.345041 5.01978e-18 677 63.546 0.000184015 -3.28324 63.546000 Cu 0.0598319 0.360026 3.37042e-17 678 63.546 0.000501652 -3.28345 63.546000 Cu 0.0805111 0.394828 0 708 63.546 0.00119967 -3.28261 63.546000 Cu 0.0700522 0.377463 0.5 709 63.546 0.000332249 -3.28329 63.546000 Cu 0.0099561 0.397476 0.5 710 63.546 0.00115755 -3.283 63.546000 Cu 0.140392 0.374888 1 711 63.546 0.000543761 -3.28284 63.546000 Cu 0.150818 0.392319 0.5 714 63.546 0.00282344 -3.28245 63.546000 Cu 0.220704 0.38991 1 712 63.546 0.00253386 -3.28243 63.546000 Cu 0.210479 0.372386 0.5 713 63.546 0.000993498 -3.28256 63.546000 Cu 0.280321 0.369939 0 715 63.546 0.000879936 -3.28254 63.546000 Cu 0.290302 0.387545 0.5 718 63.546 0.000879935 -3.28247 63.546000 Cu 0.359784 0.385155 0 716 63.546 0.000745113 -3.28277 63.546000 Cu 0.35001 0.367518 0.5 717 63.546 0.000241784 -3.28269 63.546000 Cu 0.419728 0.365081 0 719 63.546 0.000422144 -3.28312 63.546000 Cu 0.499664 0.380079 1.2669e-17 720 63.546 0.00167124 -3.28359 63.546000 Cu 0.489671 0.362583 0.5 721 63.546 0.00090901 -3.28348 63.546000 Cu 0.429518 0.382666 0.5 722 63.546 0.00243293 -3.28341 63.546000 Cu 0.640392 0.374888 3.37042e-17 668 63.546 0.000543761 -3.28284 63.546000 Cu 0.650818 0.392319 0.5 698 63.546 0.00282344 -3.28245 63.546000 Cu 0.559832 0.360026 3.37042e-17 723 63.546 0.000501652 -3.28345 63.546000 Cu 0.570052 0.377463 0.5 725 63.546 0.000332249 -3.28329 63.546000 Cu 0.509956 0.397476 0.5 750 63.546 0.00115755 -3.283 63.546000 Cu 0.580511 0.394828 8.17507e-17 752 63.546 0.00119967 -3.28261 63.546000 Cu 0.780321 0.369939 3.37042e-17 670 63.546 0.000879936 -3.28254 63.546000 Cu 0.710479 0.372386 0.5 672 63.546 0.000993498 -3.28256 63.546000 Cu 0.720704 0.38991 1 699 63.546 0.00253386 -3.28243 63.546000 Cu 0.790302 0.387545 0.5 701 63.546 0.000879935 -3.28247 63.546000 Cu 0.999664 0.380079 0 707 63.546 0.00167124 -3.28359 63.546000 Cu 0.919728 0.365081 3.37042e-17 674 63.546 0.000422144 -3.28312 63.546000 Cu 0.85001 0.367518 0.5 676 63.546 0.000241784 -3.28269 63.546000 Cu 0.989671 0.362583 0.5 680 63.546 0.00090901 -3.28348 63.546000 Cu 0.859784 0.385155 1 703 63.546 0.000745113 -3.28277 63.546000 Cu 0.929518 0.382666 0.5 705 63.546 0.00243293 -3.28341 63.546000 Cu 0.0206776 0.414767 0 736 63.546 0.00303193 -3.28142 63.546000 Cu 0.101256 0.429633 4.39828e-17 737 63.546 0.0205532 -3.28098 63.546000 Cu 0.0910304 0.412172 0.5 738 63.546 0.00716829 -3.28141 63.546000 Cu 0.031797 0.432074 0.5 739 63.546 0.0196007 -3.28014 63.546000 Cu 0.160996 0.409815 0 740 63.546 0.00611909 -3.28179 63.546000 Cu 0.239756 0.425311 1 741 63.546 0.00305906 -3.2817 63.546000 Cu 0.230589 0.407549 0.5 742 63.546 0.00292137 -3.28226 63.546000 Cu 0.170482 0.427433 0.5 743 63.546 0.0101272 -3.28141 63.546000 Cu 0.299992 0.40527 3.37042e-17 744 63.546 0.00137697 -3.28255 63.546000 Cu 0.3093 0.423062 0.5 747 63.546 0.0143368 -3.28317 63.546000 Cu 0.379448 0.420449 2.31866e-17 745 63.546 0.0159161 -3.28384 63.546000 Cu 0.369507 0.402835 0.5 746 63.546 0.00572058 -3.28332 63.546000 Cu 0.439523 0.400196 3.37042e-17 748 63.546 0.0050314 -3.28354 63.546000 Cu 0.450079 0.417589 0.5 751 63.546 0.00338847 -3.2825 63.546000 Cu 0.390181 0.437809 0.5 774 63.546 0.0159803 -3.28174 63.546000 Cu 0.461553 0.434833 3.37042e-17 776 63.546 0.00634049 -3.28058 63.546000 Cu 0.660996 0.409815 5.47395e-17 697 63.546 0.00611909 -3.28179 63.546000 Cu 0.520678 0.414767 1.81668e-17 749 63.546 0.00303193 -3.28142 63.546000 Cu 0.59103 0.412172 0.5 753 63.546 0.00716829 -3.28141 63.546000 Cu 0.531797 0.432074 0.5 778 63.546 0.0196007 -3.28014 63.546000 Cu 0.601256 0.429633 3.37042e-17 780 63.546 0.0205532 -3.28098 63.546000 Cu 0.799992 0.40527 3.37042e-17 700 63.546 0.00137697 -3.28255 63.546000 Cu 0.730589 0.407549 0.5 702 63.546 0.00292137 -3.28226 63.546000 Cu 0.670482 0.427433 0.5 727 63.546 0.0101272 -3.28141 63.546000 Cu 0.739756 0.425311 0 728 63.546 0.00305906 -3.2817 63.546000 Cu 0.8093 0.423062 0.5 730 63.546 0.0143368 -3.28317 63.546000 Cu 0.939523 0.400196 1 704 63.546 0.0050314 -3.28354 63.546000 Cu 0.869507 0.402835 0.5 706 63.546 0.00572058 -3.28332 63.546000 Cu 0.879448 0.420449 1 732 63.546 0.0159161 -3.28384 63.546000 Cu 0.961553 0.434833 0 733 63.546 0.00634049 -3.28058 63.546000 Cu 0.950079 0.417589 0.5 734 63.546 0.00338847 -3.2825 63.546000 Cu 0.890181 0.437809 0.5 735 63.546 0.0159803 -3.28174 63.546000 Cu 0.0432592 0.449679 3.37042e-17 764 63.546 0.0530413 -3.27647 63.546000 Cu 0.120804 0.466131 3.37042e-17 765 63.546 0.0453833 -3.25583 63.546000 Cu 0.111089 0.447504 0.5 766 63.546 0.0408733 -3.27925 63.546000 Cu 0.0549329 0.467916 0.5 767 63.546 0.11367 -3.26677 63.546000 Cu 0.17895 0.445335 3.37042e-17 768 63.546 0.0236147 -3.28001 63.546000 Cu 0.255096 0.461171 3.68117e-17 769 63.546 0.191212 -3.27068 63.546000 Cu 0.247804 0.443243 0.5 770 63.546 0.0305608 -3.27948 63.546000 Cu 0.186034 0.463803 0.5 771 63.546 0.141964 -3.26699 63.546000 Cu 0.318312 0.440709 3.37042e-17 772 63.546 0.0486392 -3.28126 63.546000 Cu 0.327958 0.457859 0.5 775 63.546 0.0438942 -3.27536 63.546000 Cu 0.263549 0.477928 0.5 793 63.546 0.782389 -3.19103 63.546000 Cu 0.485941 0.469402 3.37042e-17 395 63.546 0.17709 -3.26993 63.546000 Cu 0.413054 0.471377 0.5 402 63.546 0.0981183 -3.26467 63.546000 Cu 0.401806 0.454804 4.39828e-17 773 63.546 0.0223056 -3.27614 63.546000 Cu 0.473864 0.452071 0.5 779 63.546 0.053828 -3.27755 63.546000 Cu 0.338687 0.474417 5.97593e-17 795 63.546 0.0180247 -3.2777 63.546000 Cu 0.620804 0.466131 1 7 63.546 0.0453833 -3.25583 63.546000 Cu 0.554933 0.467916 0.5 18 63.546 0.11367 -3.26677 63.546000 Cu 0.543259 0.449679 3.39433e-17 777 63.546 0.0530413 -3.27647 63.546000 Cu 0.611089 0.447504 0.5 781 63.546 0.0408733 -3.27925 63.546000 Cu 0.67895 0.445335 2.24695e-17 726 63.546 0.0236147 -3.28001 63.546000 Cu 0.818312 0.440709 4.08753e-17 729 63.546 0.0486392 -3.28126 63.546000 Cu 0.747804 0.443243 0.5 731 63.546 0.0305608 -3.27948 63.546000 Cu 0.686034 0.463803 0.5 755 63.546 0.141964 -3.26699 63.546000 Cu 0.755096 0.461171 4.46999e-17 756 63.546 0.191212 -3.27068 63.546000 Cu 0.827958 0.457859 0.5 758 63.546 0.0438942 -3.27536 63.546000 Cu 0.763549 0.477928 0.5 759 63.546 0.782389 -3.19103 63.546000 Cu 0.838687 0.474417 1 757 63.546 0.0180247 -3.2777 63.546000 Cu 0.901806 0.454804 1 760 63.546 0.0223056 -3.27614 63.546000 Cu 0.985941 0.469402 3.37042e-17 761 63.546 0.17709 -3.26993 63.546000 Cu 0.973864 0.452071 0.5 762 63.546 0.053828 -3.27755 63.546000 Cu 0.913054 0.471377 0.5 763 63.546 0.0981183 -3.26467 63.546000 Cu 0.0662772 0.504883 0.5 5 63.546 0.130549 -3.28005 63.546000 Cu 0.0639271 0.486533 3.37042e-17 788 63.546 0.218491 -3.27389 63.546000 Cu 0.137584 0.504878 1.05176e-17 789 63.546 0.872527 -3.23786 63.546000 Cu 0.131351 0.485723 0.5 790 63.546 0.311572 -3.21043 63.546000 Cu 0.275789 0.516154 4.08753e-17 6 63.546 9.36804 -2.98083 63.546000 Cu 0.193912 0.483028 3.75288e-17 791 63.546 0.907262 -3.15993 63.546000 Cu 0.275646 0.493666 4.63732e-17 792 63.546 9.38205 -2.98047 63.546000 Cu 0.209877 0.504921 0.5 794 63.546 6.82615 -3.09403 63.546000 Cu 0.34818 0.519403 0.5 8 63.546 3.98289 -3.16432 63.546000 Cu 0.360017 0.504876 2.35452e-16 9 63.546 6.32728 -2.98248 63.546000 Cu 0.428238 0.504866 0.5 11 63.546 0.616426 -3.28098 63.546000 Cu 0.496289 0.504874 3.77679e-17 12 63.546 0.0870658 -3.28153 63.546000 Cu 0.494425 0.487008 0.5 16 63.546 0.21391 -3.27257 63.546000 Cu 0.348196 0.490359 0.5 401 63.546 3.99763 -3.16215 63.546000 Cu 0.423578 0.487649 1.32427e-16 796 63.546 0.462371 -3.24858 63.546000 Cu 0.631351 0.485723 0.5 4 63.546 0.311572 -3.21043 63.546000 Cu 0.566277 0.504883 0.5 14 63.546 0.130549 -3.28005 63.546000 Cu 0.563927 0.486533 0 393 63.546 0.218491 -3.27389 63.546000 Cu 0.637584 0.504878 0 782 63.546 0.872527 -3.23786 63.546000 Cu 0.775789 0.516154 0 20 63.546 9.36804 -2.98083 63.546000 Cu 0.693912 0.483028 1 754 63.546 0.907262 -3.15993 63.546000 Cu 0.709877 0.504921 0.5 783 63.546 6.82615 -3.09403 63.546000 Cu 0.775646 0.493666 1.07567e-17 784 63.546 9.38205 -2.98047 63.546000 Cu 0.860017 0.504876 1 1 63.546 6.32728 -2.98248 63.546000 Cu 0.996289 0.504874 0 2 63.546 0.0870658 -3.28153 63.546000 Cu 0.928238 0.504866 0.5 3 63.546 0.616426 -3.28098 63.546000 Cu 0.84818 0.519403 0.5 22 63.546 3.98289 -3.16432 63.546000 Cu 0.848196 0.490359 0.5 785 63.546 3.99763 -3.16215 63.546000 Cu 0.923578 0.487649 1 786 63.546 0.462371 -3.24858 63.546000 Cu 0.994425 0.487008 0.5 787 63.546 0.21391 -3.27257 63.546000 Cu 0.0638442 0.523228 1.48203e-17 28 63.546 0.217661 -3.27363 63.546000 Cu 0.12067 0.54362 3.89631e-17 29 63.546 0.0445078 -3.25573 63.546000 Cu 0.13128 0.524036 0.5 30 63.546 0.310555 -3.21137 63.546000 Cu 0.0547619 0.541828 0.5 31 63.546 0.112834 -3.26656 63.546000 Cu 0.193905 0.526735 1.64936e-17 32 63.546 0.903625 -3.16188 63.546000 Cu 0.254853 0.548644 3.01187e-17 33 63.546 0.196218 -3.27077 63.546000 Cu 0.263538 0.531895 0.5 34 63.546 0.770531 -3.19191 63.546000 Cu 0.18585 0.545966 0.5 35 63.546 0.142731 -3.26635 63.546000 Cu 0.327782 0.551979 0.5 37 63.546 0.0397639 -3.27518 63.546000 Cu 0.423435 0.522118 3.20788e-16 10 63.546 0.453473 -3.24854 63.546000 Cu 0.494273 0.522765 0.5 15 63.546 0.208425 -3.27233 63.546000 Cu 0.338579 0.535414 2.13699e-16 36 63.546 0.0173463 -3.27886 63.546000 Cu 0.401583 0.55501 1.01113e-16 38 63.546 0.0214806 -3.27643 63.546000 Cu 0.412863 0.538398 0.5 39 63.546 0.0922397 -3.26486 63.546000 Cu 0.48574 0.540364 3.43735e-16 40 63.546 0.172913 -3.26931 63.546000 Cu 0.473651 0.557701 0.5 43 63.546 0.0527491 -3.2773 63.546000 Cu 0.563844 0.523228 1.45096e-16 13 63.546 0.217661 -3.27363 63.546000 Cu 0.63128 0.524036 0.5 19 63.546 0.310555 -3.21137 63.546000 Cu 0.554762 0.541828 0.5 42 63.546 0.112834 -3.26656 63.546000 Cu 0.62067 0.54362 1.79278e-17 44 63.546 0.0445078 -3.25573 63.546000 Cu 0.693905 0.526735 0 17 63.546 0.903625 -3.16188 63.546000 Cu 0.763538 0.531895 0.5 23 63.546 0.770531 -3.19191 63.546000 Cu 0.68585 0.545966 0.5 46 63.546 0.142731 -3.26635 63.546000 Cu 0.754853 0.548644 4.73294e-17 48 63.546 0.196218 -3.27077 63.546000 Cu 0.827782 0.551979 0.5 50 63.546 0.0397639 -3.27518 63.546000 Cu 0.923435 0.522118 1 24 63.546 0.453473 -3.24854 63.546000 Cu 0.838579 0.535414 3.37042e-17 21 63.546 0.0173463 -3.27886 63.546000 Cu 0.98574 0.540364 1.42227e-16 25 63.546 0.172913 -3.26931 63.546000 Cu 0.994273 0.522765 0.5 26 63.546 0.208425 -3.27233 63.546000 Cu 0.912863 0.538398 0.5 27 63.546 0.0922397 -3.26486 63.546000 Cu 0.901583 0.55501 2.24456e-16 52 63.546 0.0214806 -3.27643 63.546000 Cu 0.973651 0.557701 0.5 54 63.546 0.0527491 -3.2773 63.546000 Cu 0.0430502 0.56008 1.17845e-16 56 63.546 0.0521327 -3.27628 63.546000 Cu 0.100937 0.580139 4.30267e-17 57 63.546 0.0188582 -3.28104 63.546000 Cu 0.11087 0.562267 0.5 58 63.546 0.0416859 -3.27919 63.546000 Cu 0.031514 0.577692 0.5 59 63.546 0.0181829 -3.2801 63.546000 Cu 0.020422 0.595021 3.37042e-17 84 63.546 0.00304777 -3.28154 63.546000 Cu 0.0907137 0.597619 0.5 86 63.546 0.0064941 -3.28151 63.546000 Cu 0.160656 0.599997 1 88 63.546 0.00531662 -3.282 63.546000 Cu 0.178659 0.56447 3.92021e-17 60 63.546 0.0254645 -3.2797 63.546000 Cu 0.239478 0.584516 2.96406e-17 61 63.546 0.00305701 -3.28168 63.546000 Cu 0.247437 0.566578 0.5 62 63.546 0.0319378 -3.2795 63.546000 Cu 0.170185 0.582368 0.5 63 63.546 0.0103642 -3.28152 63.546000 Cu 0.318029 0.569104 3.37042e-17 64 63.546 0.0501931 -3.28133 63.546000 Cu 0.309025 0.586751 0.5 65 63.546 0.0151377 -3.28324 63.546000 Cu 0.379212 0.589355 1.14738e-17 66 63.546 0.0165917 -3.2838 63.546000 Cu 0.389988 0.57201 0.5 67 63.546 0.0148473 -3.28152 63.546000 Cu 0.461343 0.57495 1.33861e-16 68 63.546 0.00639628 -3.28055 63.546000 Cu 0.449814 0.59221 0.5 71 63.546 0.00356268 -3.28248 63.546000 Cu 0.54305 0.56008 4.35048e-17 41 63.546 0.0521327 -3.27628 63.546000 Cu 0.61087 0.562267 0.5 47 63.546 0.0416859 -3.27919 63.546000 Cu 0.520422 0.595021 1.43422e-17 69 63.546 0.00304777 -3.28154 63.546000 Cu 0.531514 0.577692 0.5 70 63.546 0.0181829 -3.2801 63.546000 Cu 0.600937 0.580139 7.33844e-17 72 63.546 0.0188582 -3.28104 63.546000 Cu 0.660656 0.599997 3.37042e-17 73 63.546 0.00531662 -3.282 63.546000 Cu 0.590714 0.597619 0.5 75 63.546 0.0064941 -3.28151 63.546000 Cu 0.678659 0.56447 2.77283e-17 45 63.546 0.0254645 -3.2797 63.546000 Cu 0.818029 0.569104 6.19106e-17 49 63.546 0.0501931 -3.28133 63.546000 Cu 0.747437 0.566578 0.5 51 63.546 0.0319378 -3.2795 63.546000 Cu 0.670185 0.582368 0.5 74 63.546 0.0103642 -3.28152 63.546000 Cu 0.739478 0.584516 1 76 63.546 0.00305701 -3.28168 63.546000 Cu 0.809025 0.586751 0.5 78 63.546 0.0151377 -3.28324 63.546000 Cu 0.961343 0.57495 9.22683e-17 53 63.546 0.00639628 -3.28055 63.546000 Cu 0.889988 0.57201 0.5 55 63.546 0.0148473 -3.28152 63.546000 Cu 0.879212 0.589355 6.86037e-17 80 63.546 0.0165917 -3.2838 63.546000 Cu 0.949814 0.59221 0.5 82 63.546 0.00356268 -3.28248 63.546000 Cu 0.0802917 0.614976 3.37042e-17 85 63.546 0.00107656 -3.28256 63.546000 Cu 0.00976437 0.612327 0.5 87 63.546 0.00106804 -3.28296 63.546000 Cu 0.150595 0.617493 0.5 91 63.546 0.00267179 -3.28253 63.546000 Cu 0.0699119 0.632348 0.5 114 63.546 0.000320921 -3.28321 63.546000 Cu 0.140276 0.634928 3.37042e-17 116 63.546 0.000541232 -3.2829 63.546000 Cu 0.220504 0.619902 3.37042e-17 89 63.546 0.00219319 -3.28249 63.546000 Cu 0.230335 0.602276 0.5 90 63.546 0.00299864 -3.28235 63.546000 Cu 0.299785 0.604554 0 92 63.546 0.00130198 -3.28255 63.546000 Cu 0.290121 0.622279 0.5 93 63.546 0.00070759 -3.28251 63.546000 Cu 0.210398 0.637438 0.5 118 63.546 0.00112102 -3.2827 63.546000 Cu 0.280275 0.639896 3.37042e-17 120 63.546 0.000997901 -3.28265 63.546000 Cu 0.359656 0.624673 0 94 63.546 0.000624789 -3.28274 63.546000 Cu 0.369324 0.606982 0.5 95 63.546 0.00536306 -3.28326 63.546000 Cu 0.439298 0.609611 1 96 63.546 0.00545771 -3.28347 63.546000 Cu 0.499545 0.629732 1 97 63.546 0.00178773 -3.28349 63.546000 Cu 0.429405 0.627154 0.5 99 63.546 0.00239518 -3.28333 63.546000 Cu 0.509764 0.612327 0.5 98 63.546 0.00106804 -3.28296 63.546000 Cu 0.580292 0.614976 2.5577e-17 100 63.546 0.00107656 -3.28256 63.546000 Cu 0.640276 0.634928 0 101 63.546 0.000541232 -3.2829 63.546000 Cu 0.650595 0.617493 0.5 102 63.546 0.00267179 -3.28253 63.546000 Cu 0.569912 0.632348 0.5 103 63.546 0.000320921 -3.28321 63.546000 Cu 0.799785 0.604554 8.3663e-18 77 63.546 0.00130198 -3.28255 63.546000 Cu 0.730335 0.602276 0.5 79 63.546 0.00299864 -3.28235 63.546000 Cu 0.720504 0.619902 3.89631e-17 104 63.546 0.00219319 -3.28249 63.546000 Cu 0.780275 0.639896 3.37042e-17 105 63.546 0.000997901 -3.28265 63.546000 Cu 0.790121 0.622279 0.5 106 63.546 0.00070759 -3.28251 63.546000 Cu 0.710398 0.637438 0.5 107 63.546 0.00112102 -3.2827 63.546000 Cu 0.939298 0.609611 7.91213e-17 81 63.546 0.00545771 -3.28347 63.546000 Cu 0.869324 0.606982 0.5 83 63.546 0.00536306 -3.28326 63.546000 Cu 0.859656 0.624673 0 108 63.546 0.000624789 -3.28274 63.546000 Cu 0.929405 0.627154 0.5 110 63.546 0.00239518 -3.28333 63.546000 Cu 0.999545 0.629732 2.39037e-19 112 63.546 0.00178773 -3.28349 63.546000 Cu 0.0597512 0.649792 2.29476e-17 113 63.546 0.000671511 -3.28339 63.546000 Cu 0.130002 0.652364 0.5 119 63.546 0.000108265 -3.28312 63.546000 Cu 0.049802 0.667302 0.5 142 63.546 0.00037411 -3.2833 63.546000 Cu 0.119894 0.669837 0 144 63.546 0.0002351 -3.28325 63.546000 Cu 0.200203 0.654918 7.24282e-17 117 63.546 0.000218619 -3.28286 63.546000 Cu 0.270252 0.657432 0.5 123 63.546 0.000574349 -3.28276 63.546000 Cu 0.190017 0.672386 0.5 146 63.546 4.45109e-05 -3.28308 63.546000 Cu 0.260099 0.674923 3.37042e-17 148 63.546 7.2654e-05 -3.28295 63.546000 Cu 0.330119 0.677432 0.5 150 63.546 0.000209098 -3.2829 63.546000 Cu 0.340144 0.659905 3.58556e-18 121 63.546 0.00049246 -3.28278 63.546000 Cu 0.349984 0.642318 0.5 122 63.546 0.000215739 -3.28271 63.546000 Cu 0.419703 0.644755 0 124 63.546 0.000353771 -3.28307 63.546000 Cu 0.479822 0.664807 1.50593e-17 125 63.546 0.000155162 -3.28317 63.546000 Cu 0.489615 0.647244 0.5 126 63.546 0.000979067 -3.28341 63.546000 Cu 0.40996 0.662352 0.5 127 63.546 0.000100482 -3.28294 63.546000 Cu 0.400072 0.679909 2.07962e-17 152 63.546 0.000153636 -3.28295 63.546000 Cu 0.559751 0.649792 3.37042e-17 128 63.546 0.000671511 -3.28339 63.546000 Cu 0.619894 0.669837 9.56149e-19 129 63.546 0.0002351 -3.28325 63.546000 Cu 0.630002 0.652364 0.5 130 63.546 0.000108265 -3.28312 63.546000 Cu 0.549802 0.667302 0.5 131 63.546 0.00037411 -3.2833 63.546000 Cu 0.700203 0.654918 3.37042e-17 132 63.546 0.000218619 -3.28286 63.546000 Cu 0.760099 0.674923 5.49785e-18 133 63.546 7.2654e-05 -3.28295 63.546000 Cu 0.770252 0.657432 0.5 134 63.546 0.000574349 -3.28276 63.546000 Cu 0.690017 0.672386 0.5 135 63.546 4.45109e-05 -3.28308 63.546000 Cu 0.830119 0.677432 0.5 139 63.546 0.000209098 -3.2829 63.546000 Cu 0.919703 0.644755 3.37042e-17 109 63.546 0.000353771 -3.28307 63.546000 Cu 0.849984 0.642318 0.5 111 63.546 0.000215739 -3.28271 63.546000 Cu 0.989615 0.647244 0.5 115 63.546 0.000979067 -3.28341 63.546000 Cu 0.840144 0.659905 2.12743e-17 136 63.546 0.00049246 -3.28278 63.546000 Cu 0.900072 0.679909 3.37042e-17 137 63.546 0.000153636 -3.28295 63.546000 Cu 0.90996 0.662352 0.5 138 63.546 0.000100482 -3.28294 63.546000 Cu 0.979822 0.664807 1.38642e-17 140 63.546 0.000155162 -3.28317 63.546000 Cu 0.0399038 0.684851 0 141 63.546 7.67421e-05 -3.28322 63.546000 Cu 0.109877 0.687357 0.5 147 63.546 0.000124517 -3.28329 63.546000 Cu 0.0199899 0.719938 1.12347e-17 169 63.546 1.35993e-05 -3.28301 63.546000 Cu 0.0299598 0.702406 0.5 170 63.546 1.71486e-05 -3.28307 63.546000 Cu 0.0999041 0.704897 1 172 63.546 2.96635e-05 -3.28314 63.546000 Cu 0.179908 0.689885 1 145 63.546 7.64102e-05 -3.28324 63.546000 Cu 0.320045 0.694935 5.76079e-17 149 63.546 3.71407e-05 -3.28304 63.546000 Cu 0.249978 0.692415 0.5 151 63.546 1.85417e-05 -3.28313 63.546000 Cu 0.169899 0.707402 0.5 174 63.546 4.02808e-05 -3.28315 63.546000 Cu 0.239938 0.709916 3.37042e-17 176 63.546 2.17723e-05 -3.28313 63.546000 Cu 0.309988 0.712433 0.5 178 63.546 4.81806e-06 -3.28309 63.546000 Cu 0.460033 0.699923 3.37042e-17 153 63.546 6.31619e-05 -3.283 63.546000 Cu 0.469986 0.682373 0.5 154 63.546 3.71384e-05 -3.28307 63.546000 Cu 0.39007 0.697437 0.5 155 63.546 9.08482e-05 -3.28299 63.546000 Cu 0.380023 0.714945 1 180 63.546 1.47282e-05 -3.28303 63.546000 Cu 0.450019 0.717446 0.5 182 63.546 2.46237e-05 -3.283 63.546000 Cu 0.539904 0.684851 3.37042e-17 156 63.546 7.67421e-05 -3.28322 63.546000 Cu 0.599904 0.704897 3.37042e-17 157 63.546 2.96635e-05 -3.28314 63.546000 Cu 0.609877 0.687357 0.5 158 63.546 0.000124517 -3.28329 63.546000 Cu 0.52996 0.702406 0.5 159 63.546 1.71486e-05 -3.28307 63.546000 Cu 0.51999 0.719938 3.37042e-17 184 63.546 1.35993e-05 -3.28301 63.546000 Cu 0.679908 0.689885 2.29476e-17 160 63.546 7.64102e-05 -3.28324 63.546000 Cu 0.739938 0.709916 3.37042e-17 161 63.546 2.17723e-05 -3.28313 63.546000 Cu 0.749978 0.692415 0.5 162 63.546 1.85417e-05 -3.28313 63.546000 Cu 0.669899 0.707402 0.5 163 63.546 4.02808e-05 -3.28315 63.546000 Cu 0.820045 0.694935 1.52984e-17 164 63.546 3.71407e-05 -3.28304 63.546000 Cu 0.809988 0.712433 0.5 167 63.546 4.81806e-06 -3.28309 63.546000 Cu 0.969986 0.682373 0.5 143 63.546 3.71384e-05 -3.28307 63.546000 Cu 0.880023 0.714945 1 165 63.546 1.47282e-05 -3.28303 63.546000 Cu 0.89007 0.697437 0.5 166 63.546 9.08482e-05 -3.28299 63.546000 Cu 0.960033 0.699923 0 168 63.546 6.31619e-05 -3.283 63.546000 Cu 0.950019 0.717446 0.5 171 63.546 2.46237e-05 -3.283 63.546000 Cu 0.159942 0.724923 1.53223e-16 173 63.546 9.28317e-06 -3.28312 63.546000 Cu 0.0899577 0.722427 0.5 175 63.546 3.36068e-06 -3.28307 63.546000 Cu 0.00999914 0.737458 0.5 198 63.546 1.33629e-05 -3.28302 63.546000 Cu 0.0799955 0.739951 6.69304e-18 200 63.546 1.04748e-05 -3.28306 63.546000 Cu 0.140008 0.759964 4.23096e-17 201 63.546 6.29983e-06 -3.28309 63.546000 Cu 0.149987 0.742448 0.5 202 63.546 3.90375e-06 -3.2831 63.546000 Cu 0.0700009 0.757462 0.5 203 63.546 3.262e-06 -3.28306 63.546000 Cu 0.299958 0.72994 3.37042e-17 177 63.546 1.06454e-05 -3.28312 63.546000 Cu 0.229945 0.727428 0.5 179 63.546 1.66661e-05 -3.28313 63.546000 Cu 0.219974 0.744949 3.37042e-17 204 63.546 9.69788e-07 -3.28312 63.546000 Cu 0.289966 0.747455 0.5 206 63.546 5.09365e-06 -3.28312 63.546000 Cu 0.439993 0.73496 1 181 63.546 8.78724e-06 -3.28303 63.546000 Cu 0.369978 0.732453 0.5 183 63.546 3.90388e-06 -3.28307 63.546000 Cu 0.359967 0.749962 3.37042e-17 209 63.546 7.62081e-06 -3.2831 63.546000 Cu 0.429977 0.752466 0.5 211 63.546 4.64898e-06 -3.28307 63.546000 Cu 0.49999 0.754964 6.26277e-17 212 63.546 1.27354e-06 -3.28305 63.546000 Cu 0.579996 0.739951 3.37042e-17 185 63.546 1.04748e-05 -3.28306 63.546000 Cu 0.589958 0.722427 0.5 186 63.546 3.36068e-06 -3.28307 63.546000 Cu 0.509999 0.737458 0.5 187 63.546 1.33629e-05 -3.28302 63.546000 Cu 0.659942 0.724923 4.11144e-17 188 63.546 9.28317e-06 -3.28312 63.546000 Cu 0.649987 0.742448 0.5 191 63.546 3.90375e-06 -3.2831 63.546000 Cu 0.570001 0.757462 0.5 214 63.546 3.262e-06 -3.28306 63.546000 Cu 0.640008 0.759964 1 216 63.546 6.29983e-06 -3.28309 63.546000 Cu 0.719974 0.744949 1.2669e-17 189 63.546 9.69788e-07 -3.28312 63.546000 Cu 0.729945 0.727428 0.5 190 63.546 1.66661e-05 -3.28313 63.546000 Cu 0.799958 0.72994 1.17128e-17 192 63.546 1.06454e-05 -3.28312 63.546000 Cu 0.789966 0.747455 0.5 195 63.546 5.09365e-06 -3.28312 63.546000 Cu 0.859967 0.749962 1 193 63.546 7.62081e-06 -3.2831 63.546000 Cu 0.869978 0.732453 0.5 194 63.546 3.90388e-06 -3.28307 63.546000 Cu 0.939993 0.73496 1 196 63.546 8.78724e-06 -3.28303 63.546000 Cu 0.99999 0.754964 1 197 63.546 1.27354e-06 -3.28305 63.546000 Cu 0.929977 0.752466 0.5 199 63.546 4.64898e-06 -3.28307 63.546000 Cu 0.0599838 0.774974 3.37042e-17 228 63.546 2.73637e-06 -3.28303 63.546000 Cu 0.119955 0.794984 4.54171e-18 229 63.546 1.68706e-05 -3.28304 63.546000 Cu 0.129991 0.777479 0.5 230 63.546 3.06175e-06 -3.28306 63.546000 Cu 0.0499634 0.792484 0.5 231 63.546 2.75587e-05 -3.283 63.546000 Cu 0.279996 0.764977 3.37042e-17 205 63.546 9.40074e-07 -3.28313 63.546000 Cu 0.210005 0.76247 0.5 207 63.546 4.08383e-06 -3.28312 63.546000 Cu 0.200004 0.779988 1 232 63.546 9.16804e-06 -3.2831 63.546000 Cu 0.27002 0.782497 0.5 234 63.546 1.0285e-05 -3.28311 63.546000 Cu 0.189984 0.797493 0.5 235 63.546 3.68056e-06 -3.28309 63.546000 Cu 0.349989 0.767481 0.5 208 63.546 2.05349e-06 -3.28311 63.546000 Cu 0.419985 0.769981 3.37042e-17 210 63.546 3.99539e-06 -3.28307 63.546000 Cu 0.489983 0.772477 0.5 215 63.546 3.85916e-06 -3.28303 63.546000 Cu 0.340028 0.785001 3.37042e-17 236 63.546 4.52038e-06 -3.28309 63.546000 Cu 0.410021 0.787499 0.5 239 63.546 8.34094e-06 -3.28305 63.546000 Cu 0.479994 0.789991 3.37042e-17 240 63.546 2.10863e-05 -3.28301 63.546000 Cu 0.559984 0.774974 3.37042e-17 213 63.546 2.73637e-06 -3.28303 63.546000 Cu 0.629991 0.777479 0.5 219 63.546 3.06175e-06 -3.28306 63.546000 Cu 0.549963 0.792484 0.5 242 63.546 2.75587e-05 -3.283 63.546000 Cu 0.619955 0.794984 4.30267e-18 244 63.546 1.68706e-05 -3.28304 63.546000 Cu 0.700004 0.779988 3.37042e-17 217 63.546 9.16804e-06 -3.2831 63.546000 Cu 0.710005 0.76247 0.5 218 63.546 4.08383e-06 -3.28312 63.546000 Cu 0.779996 0.764977 8.00774e-17 220 63.546 9.40074e-07 -3.28313 63.546000 Cu 0.77002 0.782497 0.5 223 63.546 1.0285e-05 -3.28311 63.546000 Cu 0.689984 0.797493 0.5 246 63.546 3.68056e-06 -3.28309 63.546000 Cu 0.840028 0.785001 3.34652e-18 221 63.546 4.52038e-06 -3.28309 63.546000 Cu 0.849989 0.767481 0.5 222 63.546 2.05349e-06 -3.28311 63.546000 Cu 0.919985 0.769981 0 224 63.546 3.99539e-06 -3.28307 63.546000 Cu 0.979994 0.789991 3.34652e-18 225 63.546 2.10863e-05 -3.28301 63.546000 Cu 0.989983 0.772477 0.5 226 63.546 3.85916e-06 -3.28303 63.546000 Cu 0.910021 0.787499 0.5 227 63.546 8.34094e-06 -3.28305 63.546000 Cu 0.0399442 0.810011 9.08341e-18 256 63.546 3.71428e-05 -3.28302 63.546000 Cu 0.0999084 0.830019 1.3147e-17 257 63.546 0.000162865 -3.2829 63.546000 Cu 0.109918 0.812497 0.5 258 63.546 5.20794e-05 -3.283 63.546000 Cu 0.0299867 0.827553 0.5 259 63.546 4.50161e-05 -3.28302 63.546000 Cu 0.260031 0.800009 4.18315e-17 233 63.546 1.35903e-05 -3.28313 63.546000 Cu 0.330064 0.802523 0.5 237 63.546 2.88295e-05 -3.28317 63.546000 Cu 0.179946 0.814997 3.58556e-18 260 63.546 2.52985e-05 -3.28305 63.546000 Cu 0.23988 0.83501 1.43422e-17 261 63.546 5.45922e-05 -3.28296 63.546000 Cu 0.250003 0.817515 0.5 262 63.546 2.5366e-05 -3.28313 63.546000 Cu 0.169866 0.8325 0.5 263 63.546 0.000177418 -3.28289 63.546000 Cu 0.320056 0.820043 6.59742e-17 264 63.546 6.46197e-05 -3.28323 63.546000 Cu 0.309954 0.837545 0.5 265 63.546 4.62668e-05 -3.2831 63.546000 Cu 0.400057 0.805031 3.58556e-18 238 63.546 2.18175e-05 -3.28316 63.546000 Cu 0.470004 0.807526 0.5 243 63.546 9.41503e-06 -3.28309 63.546000 Cu 0.390081 0.82257 0.5 267 63.546 0.000102647 -3.28326 63.546000 Cu 0.460054 0.825075 3.89631e-17 268 63.546 6.03221e-05 -3.28317 63.546000 Cu 0.539944 0.810011 1.45335e-16 241 63.546 3.71428e-05 -3.28302 63.546000 Cu 0.609918 0.812497 0.5 247 63.546 5.20794e-05 -3.283 63.546000 Cu 0.529987 0.827553 0.5 270 63.546 4.50161e-05 -3.28302 63.546000 Cu 0.599908 0.830019 9.56149e-19 272 63.546 0.000162865 -3.2829 63.546000 Cu 0.760031 0.800009 1 248 63.546 1.35903e-05 -3.28313 63.546000 Cu 0.679946 0.814997 3.37042e-17 245 63.546 2.52985e-05 -3.28305 63.546000 Cu 0.820056 0.820043 3.37042e-17 249 63.546 6.46197e-05 -3.28323 63.546000 Cu 0.830064 0.802523 0.5 250 63.546 2.88295e-05 -3.28317 63.546000 Cu 0.750003 0.817515 0.5 251 63.546 2.5366e-05 -3.28313 63.546000 Cu 0.669866 0.8325 0.5 274 63.546 0.000177418 -3.28289 63.546000 Cu 0.73988 0.83501 5.37834e-17 276 63.546 5.45922e-05 -3.28296 63.546000 Cu 0.809954 0.837545 0.5 278 63.546 4.62668e-05 -3.2831 63.546000 Cu 0.900057 0.805031 1 252 63.546 2.18175e-05 -3.28316 63.546000 Cu 0.960054 0.825075 3.37042e-17 253 63.546 6.03221e-05 -3.28317 63.546000 Cu 0.970004 0.807526 0.5 254 63.546 9.41503e-06 -3.28309 63.546000 Cu 0.890081 0.82257 0.5 255 63.546 0.000102647 -3.28326 63.546000 Cu 0.0201407 0.84512 3.37042e-17 284 63.546 0.000135651 -3.28321 63.546000 Cu 0.0802447 0.865178 3.37042e-17 285 63.546 0.000344377 -3.28307 63.546000 Cu 0.0899917 0.847577 0.5 286 63.546 0.000128888 -3.28297 63.546000 Cu 0.0103347 0.862691 0.5 287 63.546 0.00100297 -3.28343 63.546000 Cu 0.159808 0.850026 0 288 63.546 0.000521392 -3.2828 63.546000 Cu 0.149962 0.86761 0.5 291 63.546 0.0002822 -3.28269 63.546000 Cu 0.219689 0.870032 0 289 63.546 0.00111984 -3.28262 63.546000 Cu 0.229721 0.852502 0.5 290 63.546 0.000503869 -3.28276 63.546000 Cu 0.299779 0.855017 0 292 63.546 0.000168659 -3.28285 63.546000 Cu 0.289577 0.872492 0.5 293 63.546 0.00111026 -3.28264 63.546000 Cu 0.380079 0.840091 3.37042e-17 266 63.546 0.000221688 -3.28328 63.546000 Cu 0.450171 0.842625 0.5 271 63.546 0.00035683 -3.28333 63.546000 Cu 0.359686 0.875006 6.83646e-17 294 63.546 0.000512356 -3.28285 63.546000 Cu 0.369979 0.857568 0.5 295 63.546 0.000129443 -3.28315 63.546000 Cu 0.440222 0.860141 0 296 63.546 0.000728047 -3.28342 63.546000 Cu 0.430042 0.877587 0.5 299 63.546 0.000339954 -3.28318 63.546000 Cu 0.520141 0.84512 3.37042e-17 269 63.546 0.000135651 -3.28321 63.546000 Cu 0.659808 0.850026 3.37042e-17 273 63.546 0.000521392 -3.2828 63.546000 Cu 0.589992 0.847577 0.5 275 63.546 0.000128888 -3.28297 63.546000 Cu 0.510335 0.862691 0.5 298 63.546 0.00100297 -3.28343 63.546000 Cu 0.580245 0.865178 2.46208e-17 300 63.546 0.000344377 -3.28307 63.546000 Cu 0.649962 0.86761 0.5 302 63.546 0.0002822 -3.28269 63.546000 Cu 0.799779 0.855017 3.37042e-17 277 63.546 0.000168659 -3.28285 63.546000 Cu 0.729721 0.852502 0.5 279 63.546 0.000503869 -3.28276 63.546000 Cu 0.719689 0.870032 1.57765e-17 304 63.546 0.00111984 -3.28262 63.546000 Cu 0.789577 0.872492 0.5 306 63.546 0.00111026 -3.28264 63.546000 Cu 0.880079 0.840091 5.8086e-17 280 63.546 0.000221688 -3.28328 63.546000 Cu 0.940222 0.860141 3.37042e-17 281 63.546 0.000728047 -3.28342 63.546000 Cu 0.950171 0.842625 0.5 282 63.546 0.00035683 -3.28333 63.546000 Cu 0.869979 0.857568 0.5 283 63.546 0.000129443 -3.28315 63.546000 Cu 0.859686 0.875006 2.36647e-17 308 63.546 0.000512356 -3.28285 63.546000 Cu 0.930042 0.877587 0.5 310 63.546 0.000339954 -3.28318 63.546000 Cu 0.000412716 0.880203 7.88823e-18 312 63.546 0.00182034 -3.28344 63.546000 Cu 0.0606848 0.900321 0 313 63.546 0.00542534 -3.28348 63.546000 Cu 0.0705684 0.882778 0.5 314 63.546 0.00244823 -3.28332 63.546000 Cu 0.140328 0.885258 1 316 63.546 0.000691265 -3.28273 63.546000 Cu 0.130681 0.902954 0.5 319 63.546 0.00567675 -3.28327 63.546000 Cu 0.050168 0.917723 0.5 342 63.546 0.00359747 -3.28246 63.546000 Cu 0.200187 0.905384 0 317 63.546 0.00135296 -3.28251 63.546000 Cu 0.209837 0.88765 0.5 318 63.546 0.00082484 -3.28252 63.546000 Cu 0.279446 0.890026 0 320 63.546 0.00243285 -3.28255 63.546000 Cu 0.269629 0.907662 0.5 323 63.546 0.00299067 -3.28236 63.546000 Cu 0.339307 0.909937 8.07945e-17 321 63.546 0.0053707 -3.28192 63.546000 Cu 0.349355 0.892439 0.5 322 63.546 0.00280445 -3.28254 63.546000 Cu 0.419676 0.894954 3.37042e-17 324 63.546 0.00110917 -3.28259 63.546000 Cu 0.479587 0.914908 4.54171e-17 325 63.546 0.00310559 -3.28152 63.546000 Cu 0.490236 0.897603 0.5 326 63.546 0.00119266 -3.28292 63.546000 Cu 0.409258 0.91231 0.5 327 63.546 0.00658867 -3.2815 63.546000 Cu 0.500413 0.880203 1 297 63.546 0.00182034 -3.28344 63.546000 Cu 0.640328 0.885258 3.82459e-18 301 63.546 0.000691265 -3.28273 63.546000 Cu 0.570568 0.882778 0.5 303 63.546 0.00244823 -3.28332 63.546000 Cu 0.560685 0.900321 2.6055e-17 328 63.546 0.00542534 -3.28348 63.546000 Cu 0.630681 0.902954 0.5 330 63.546 0.00567675 -3.28327 63.546000 Cu 0.550168 0.917723 0.5 331 63.546 0.00359747 -3.28246 63.546000 Cu 0.779446 0.890026 3.37042e-17 305 63.546 0.00243285 -3.28255 63.546000 Cu 0.709837 0.88765 0.5 307 63.546 0.00082484 -3.28252 63.546000 Cu 0.700187 0.905384 3.37042e-17 332 63.546 0.00135296 -3.28251 63.546000 Cu 0.769629 0.907662 0.5 334 63.546 0.00299067 -3.28236 63.546000 Cu 0.919676 0.894954 3.37042e-17 309 63.546 0.00110917 -3.28259 63.546000 Cu 0.849355 0.892439 0.5 311 63.546 0.00280445 -3.28254 63.546000 Cu 0.990236 0.897603 0.5 315 63.546 0.00119266 -3.28292 63.546000 Cu 0.839307 0.909937 6.50181e-17 336 63.546 0.0053707 -3.28192 63.546000 Cu 0.909258 0.91231 0.5 338 63.546 0.00658867 -3.2815 63.546000 Cu 0.979587 0.914908 3.37042e-17 340 63.546 0.00310559 -3.28152 63.546000 Cu 0.120781 0.920583 1.02786e-17 344 63.546 0.0169474 -3.28376 63.546000 Cu 0.038631 0.934981 1.9123e-18 341 63.546 0.00647794 -3.28056 63.546000 Cu 0.109998 0.937927 0.5 347 63.546 0.0149424 -3.28153 63.546000 Cu 0.0263161 0.952233 0.5 370 63.546 0.0526987 -3.27726 63.546000 Cu 0.0983718 0.954928 3.37042e-17 372 63.546 0.0220243 -3.27633 63.546000 Cu 0.18196 0.940836 3.37042e-17 345 63.546 0.0508677 -3.2813 63.546000 Cu 0.19095 0.923189 0.5 346 63.546 0.0153814 -3.28318 63.546000 Cu 0.260509 0.925419 3.08358e-17 348 63.546 0.00303709 -3.28171 63.546000 Cu 0.32134 0.945468 3.75288e-17 349 63.546 0.0248201 -3.27976 63.546000 Cu 0.329807 0.927557 0.5 350 63.546 0.0108565 -3.28149 63.546000 Cu 0.252547 0.943362 0.5 351 63.546 0.0321148 -3.27953 63.546000 Cu 0.172208 0.957961 0.5 374 63.546 0.0405446 -3.27507 63.546000 Cu 0.399035 0.929781 1.44617e-16 352 63.546 0.0202075 -3.28104 63.546000 Cu 0.45691 0.949848 2.05572e-17 353 63.546 0.052788 -3.2763 63.546000 Cu 0.468462 0.932234 0.5 354 63.546 0.0185534 -3.28014 63.546000 Cu 0.389113 0.947667 0.5 355 63.546 0.0409026 -3.27908 63.546000 Cu 0.620781 0.920583 5.01978e-17 329 63.546 0.0169474 -3.28376 63.546000 Cu 0.538631 0.934981 6.454e-17 356 63.546 0.00647794 -3.28056 63.546000 Cu 0.598372 0.954928 2.85171e-16 357 63.546 0.0220243 -3.27633 63.546000 Cu 0.609998 0.937927 0.5 358 63.546 0.0149424 -3.28153 63.546000 Cu 0.526316 0.952233 0.5 359 63.546 0.0526987 -3.27726 63.546000 Cu 0.760509 0.925419 3.37042e-17 333 63.546 0.00303709 -3.28171 63.546000 Cu 0.69095 0.923189 0.5 335 63.546 0.0153814 -3.28318 63.546000 Cu 0.829807 0.927557 0.5 339 63.546 0.0108565 -3.28149 63.546000 Cu 0.68196 0.940836 1.02069e-16 360 63.546 0.0508677 -3.2813 63.546000 Cu 0.752547 0.943362 0.5 362 63.546 0.0321148 -3.27953 63.546000 Cu 0.672208 0.957961 0.5 363 63.546 0.0405446 -3.27507 63.546000 Cu 0.82134 0.945468 1 364 63.546 0.0248201 -3.27976 63.546000 Cu 0.899035 0.929781 3.37042e-17 337 63.546 0.0202075 -3.28104 63.546000 Cu 0.968462 0.932234 0.5 343 63.546 0.0185534 -3.28014 63.546000 Cu 0.889113 0.947667 0.5 366 63.546 0.0409026 -3.27908 63.546000 Cu 0.95691 0.949848 3.37042e-17 368 63.546 0.052788 -3.2763 63.546000 Cu 0.014212 0.969563 3.37042e-17 369 63.546 0.175577 -3.26937 63.546000 Cu 0.161401 0.974518 3.37042e-17 373 63.546 0.0175379 -3.27859 63.546000 Cu 0.0870868 0.971531 0.5 375 63.546 0.0939453 -3.26477 63.546000 Cu 0.00568456 0.98718 0.5 397 63.546 0.209304 -3.27231 63.546000 Cu 0.0765197 0.987815 3.37042e-17 398 63.546 0.455206 -3.24869 63.546000 Cu 0.151797 0.990519 0.5 399 63.546 3.98987 -3.16396 63.546000 Cu 0.24516 0.961293 1.62545e-17 376 63.546 0.197368 -3.27076 63.546000 Cu 0.306112 0.983207 2.22305e-17 377 63.546 0.90493 -3.16227 63.546000 Cu 0.314154 0.963966 0.5 378 63.546 0.143297 -3.26618 63.546000 Cu 0.236485 0.978046 0.5 379 63.546 0.770581 -3.19201 63.546000 Cu 0.224204 0.993779 3.70508e-17 400 63.546 9.36248 -2.98105 63.546000 Cu 0.379319 0.96631 4.56561e-17 380 63.546 0.044824 -3.25572 63.546000 Cu 0.436147 0.986719 1.59677e-16 381 63.546 0.21825 -3.27351 63.546000 Cu 0.445211 0.9681 0.5 382 63.546 0.11322 -3.26648 63.546000 Cu 0.368727 0.985902 0.5 383 63.546 0.308524 -3.21131 63.546000 Cu 0.514212 0.969563 1.57286e-16 384 63.546 0.175577 -3.26937 63.546000 Cu 0.57652 0.987815 2.96406e-16 385 63.546 0.455206 -3.24869 63.546000 Cu 0.587087 0.971531 0.5 386 63.546 0.0939453 -3.26477 63.546000 Cu 0.505685 0.98718 0.5 387 63.546 0.209304 -3.27231 63.546000 Cu 0.661401 0.974518 9.75271e-17 388 63.546 0.0175379 -3.27859 63.546000 Cu 0.651797 0.990519 0.5 391 63.546 3.98987 -3.16396 63.546000 Cu 0.74516 0.961293 1.79995e-16 361 63.546 0.197368 -3.27076 63.546000 Cu 0.814154 0.963966 0.5 367 63.546 0.143297 -3.26618 63.546000 Cu 0.724204 0.993779 1.13782e-16 389 63.546 9.36248 -2.98105 63.546000 Cu 0.736485 0.978046 0.5 390 63.546 0.770581 -3.19201 63.546000 Cu 0.806112 0.983207 1.18801e-16 392 63.546 0.90493 -3.16227 63.546000 Cu 0.879319 0.96631 3.37042e-17 365 63.546 0.044824 -3.25572 63.546000 Cu 0.945211 0.9681 0.5 371 63.546 0.11322 -3.26648 63.546000 Cu 0.868727 0.985902 0.5 394 63.546 0.308524 -3.21131 63.546000 Cu 0.936147 0.986719 3.37042e-17 396 63.546 0.21825 -3.27351