Number of particles = 591 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.2018 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 88.5501 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.63731 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 0.0850185 0.00665979 3.09763e-16 303 63.546 0.699477 -3.2844 63.546000 Cu 0.00517572 0.00665591 0.5 304 63.546 0.230101 -3.28039 63.546000 Cu 0.164491 0.00666791 0.5 305 63.546 6.46569 -2.98184 63.546000 Cu 0.00839886 0.0276142 2.17865e-16 314 63.546 0.378702 -3.27438 63.546000 Cu 0.104851 0.0456953 1.55299e-16 315 63.546 0.114251 -3.26879 63.546000 Cu 0.0908866 0.0266688 0.5 316 63.546 0.490758 -3.24721 63.546000 Cu 0.0221324 0.0485379 0.5 317 63.546 0.180491 -3.2693 63.546000 Cu 0.178737 0.02346 4.8399e-16 318 63.546 3.82128 -3.16653 63.546000 Cu 0.190511 0.042054 0.5 321 63.546 0.0282353 -3.28073 63.546000 Cu 0.277563 0.0379219 2.06837e-16 319 63.546 0.728455 -3.19851 63.546000 Cu 0.262714 0.019708 0.5 320 63.546 9.38205 -2.9789 63.546000 Cu 0.338676 0.00668224 3.21626e-17 322 63.546 6.86932 -3.10986 63.546000 Cu 0.430086 0.0287323 2.5751e-16 323 63.546 0.382998 -3.2146 63.546000 Cu 0.422201 0.00668574 0.5 324 63.546 1.02394 -3.24392 63.546000 Cu 0.357818 0.0320424 0.5 325 63.546 0.800249 -3.1665 63.546000 Cu 0.368815 0.0541571 2.92892e-16 346 63.546 0.113346 -3.27366 63.546000 Cu 0.444728 0.0511426 0.5 348 63.546 0.0728147 -3.25945 63.546000 Cu 0.664576 0.00670329 5.05541e-17 298 63.546 6.47672 -2.98184 63.546000 Cu 0.678802 0.0234892 0.5 300 63.546 3.82171 -3.16616 63.546000 Cu 0.690597 0.0420722 3.48454e-17 306 63.546 0.0273774 -3.28048 63.546000 Cu 0.505207 0.00668709 9.1987e-17 326 63.546 0.229169 -3.2804 63.546000 Cu 0.59093 0.0266919 2.27672e-16 327 63.546 0.49074 -3.2472 63.546000 Cu 0.58509 0.00669099 0.5 328 63.546 0.697621 -3.28453 63.546000 Cu 0.508395 0.0276314 0.5 329 63.546 0.379241 -3.27444 63.546000 Cu 0.522108 0.048549 1.61052e-16 350 63.546 0.181389 -3.26922 63.546000 Cu 0.604886 0.0457145 0.5 352 63.546 0.114141 -3.26851 63.546000 Cu 0.762808 0.0197091 1 299 63.546 9.37835 -2.97894 63.546000 Cu 0.922204 0.00665663 9.62793e-17 301 63.546 1.0272 -3.24386 63.546000 Cu 0.838745 0.0066654 0.5 302 63.546 6.86812 -3.10935 63.546000 Cu 0.777679 0.0379296 0.5 308 63.546 0.735441 -3.19813 63.546000 Cu 0.857925 0.0320397 4.36387e-17 310 63.546 0.80504 -3.1659 63.546000 Cu 0.944772 0.0511385 1.94049e-16 311 63.546 0.072923 -3.25935 63.546000 Cu 0.930142 0.0287194 0.5 312 63.546 0.381091 -3.21424 63.546000 Cu 0.868876 0.0541566 0.5 313 63.546 0.114081 -3.27338 63.546000 Cu 0.0387194 0.068964 2.3885e-16 338 63.546 0.039288 -3.27805 63.546000 Cu 0.13602 0.0851117 3.51166e-16 339 63.546 0.00920318 -3.28252 63.546000 Cu 0.120485 0.065221 0.5 340 63.546 0.020501 -3.27964 63.546000 Cu 0.0542823 0.0889618 0.5 341 63.546 0.00495697 -3.28024 63.546000 Cu 0.204681 0.0613698 2.21562e-16 342 63.546 0.0379222 -3.27983 63.546000 Cu 0.218124 0.0813554 0.5 345 63.546 0.0309603 -3.28377 63.546000 Cu 0.0687161 0.108921 4.5299e-16 364 63.546 0.00263503 -3.28265 63.546000 Cu 0.15017 0.105272 0.5 366 63.546 0.00813394 -3.28367 63.546000 Cu 0.230977 0.101794 2.62726e-16 368 63.546 0.0066474 -3.28324 63.546000 Cu 0.299438 0.0780444 2.38194e-16 343 63.546 0.0172867 -3.28186 63.546000 Cu 0.28867 0.0573728 0.5 344 63.546 0.1402 -3.27771 63.546000 Cu 0.458917 0.0722535 2.88927e-16 347 63.546 0.0480539 -3.2801 63.546000 Cu 0.379581 0.0752535 0.5 349 63.546 0.0251102 -3.28106 63.546000 Cu 0.311444 0.0986808 0.5 370 63.546 0.00315722 -3.28198 63.546000 Cu 0.39205 0.0956862 1.93363e-16 372 63.546 0.0102835 -3.28113 63.546000 Cu 0.472983 0.0925277 0.5 374 63.546 0.0142758 -3.28036 63.546000 Cu 0.704716 0.0613722 0.5 309 63.546 0.0391151 -3.27967 63.546000 Cu 0.718091 0.0813646 3.25501e-17 330 63.546 0.030936 -3.28373 63.546000 Cu 0.730901 0.101807 0.5 333 63.546 0.00645875 -3.28325 63.546000 Cu 0.620479 0.0652233 7.0108e-17 351 63.546 0.0210115 -3.27955 63.546000 Cu 0.538678 0.0689603 0.5 353 63.546 0.0388099 -3.278 63.546000 Cu 0.554216 0.0889676 1.55001e-16 376 63.546 0.00499715 -3.28033 63.546000 Cu 0.650087 0.105284 3.48454e-17 377 63.546 0.00792375 -3.28371 63.546000 Cu 0.635961 0.0851185 0.5 378 63.546 0.00920335 -3.28256 63.546000 Cu 0.568636 0.108934 0.5 379 63.546 0.00253707 -3.28272 63.546000 Cu 0.788736 0.0573772 1 307 63.546 0.142251 -3.27737 63.546000 Cu 0.811393 0.0986923 2.44812e-16 331 63.546 0.0035118 -3.28202 63.546000 Cu 0.799429 0.07806 0.5 332 63.546 0.016896 -3.28182 63.546000 Cu 0.879592 0.0752684 3.53253e-16 334 63.546 0.026554 -3.28111 63.546000 Cu 0.973018 0.0925259 2.7608e-16 335 63.546 0.0141982 -3.28032 63.546000 Cu 0.958947 0.0722641 0.5 336 63.546 0.0500167 -3.28026 63.546000 Cu 0.89204 0.0956918 0.5 337 63.546 0.0106728 -3.28113 63.546000 Cu 0.00086138 0.132532 4.26848e-16 361 63.546 0.000533751 -3.28337 63.546000 Cu 0.163441 0.1256 3.59631e-16 365 63.546 0.00203599 -3.28327 63.546000 Cu 0.0823929 0.129039 0.5 367 63.546 0.00245024 -3.2837 63.546000 Cu 0.014544 0.152686 0.5 388 63.546 0.000617894 -3.2836 63.546000 Cu 0.0957333 0.149285 1.79294e-16 390 63.546 0.000702364 -3.28353 63.546000 Cu 0.189979 0.16625 2.97512e-16 391 63.546 0.000128926 -3.28283 63.546000 Cu 0.176686 0.145949 0.5 392 63.546 0.000241023 -3.28294 63.546000 Cu 0.24406 0.122289 0.5 371 63.546 0.000582531 -3.28248 63.546000 Cu 0.324552 0.119092 1.15297e-16 369 63.546 0.00273933 -3.28214 63.546000 Cu 0.486961 0.112521 1.38934e-16 373 63.546 0.00183949 -3.28202 63.546000 Cu 0.405472 0.115873 0.5 375 63.546 0.00377594 -3.2821 63.546000 Cu 0.257375 0.142663 1.96374e-16 394 63.546 0.000572932 -3.28245 63.546000 Cu 0.35186 0.159571 1.82782e-16 395 63.546 0.00038507 -3.28273 63.546000 Cu 0.338162 0.139375 0.5 396 63.546 0.00146259 -3.2825 63.546000 Cu 0.270888 0.162936 0.5 397 63.546 0.000491624 -3.28262 63.546000 Cu 0.419293 0.136013 2.92206e-16 398 63.546 0.000742303 -3.28293 63.546000 Cu 0.433105 0.15615 0.5 401 63.546 7.86086e-05 -3.28315 63.546000 Cu 0.676603 0.145951 1.16817e-16 354 63.546 0.000223747 -3.28289 63.546000 Cu 0.663363 0.125618 0.5 355 63.546 0.00182357 -3.28325 63.546000 Cu 0.744002 0.1223 2.42815e-16 356 63.546 0.00063924 -3.28246 63.546000 Cu 0.689968 0.166239 0.5 381 63.546 0.000127571 -3.28286 63.546000 Cu 0.514409 0.152715 3.06067e-16 399 63.546 0.000429851 -3.28355 63.546000 Cu 0.500766 0.132562 0.5 400 63.546 0.000418995 -3.28344 63.546000 Cu 0.582298 0.129063 1.39262e-16 402 63.546 0.0021727 -3.28372 63.546000 Cu 0.595603 0.1493 0.5 403 63.546 0.000576537 -3.28347 63.546000 Cu 0.838189 0.139351 2.72026e-16 357 63.546 0.0013298 -3.2824 63.546000 Cu 0.824534 0.119094 0.5 358 63.546 0.00297381 -3.28209 63.546000 Cu 0.757345 0.142652 0.5 359 63.546 0.000585415 -3.28238 63.546000 Cu 0.905494 0.115867 2.78316e-16 360 63.546 0.00382781 -3.282 63.546000 Cu 0.987024 0.112508 0.5 362 63.546 0.00172524 -3.28191 63.546000 Cu 0.919363 0.135981 0.5 363 63.546 0.00061657 -3.28281 63.546000 Cu 0.770931 0.162913 2.68867e-16 382 63.546 0.000410136 -3.28268 63.546000 Cu 0.851951 0.159538 0.5 384 63.546 0.000287699 -3.28282 63.546000 Cu 0.933235 0.156114 3.02073e-16 386 63.546 0.000147062 -3.28322 63.546000 Cu 0.0280357 0.17292 2.57659e-16 387 63.546 0.000210822 -3.2833 63.546000 Cu 0.109081 0.169561 0.5 393 63.546 0.000119709 -3.28312 63.546000 Cu 0.0550149 0.213439 9.14504e-17 411 63.546 4.16862e-05 -3.28307 63.546000 Cu 0.0414917 0.193172 0.5 412 63.546 5.45073e-05 -3.28314 63.546000 Cu 0.122433 0.189834 6.43849e-18 414 63.546 6.76294e-05 -3.28299 63.546000 Cu 0.217015 0.206719 3.48454e-17 415 63.546 3.76288e-05 -3.28303 63.546000 Cu 0.203381 0.186499 0.5 416 63.546 0.000249414 -3.28291 63.546000 Cu 0.135945 0.210087 0.5 417 63.546 0.000126395 -3.28303 63.546000 Cu 0.28446 0.183147 2.15868e-16 418 63.546 0.000166895 -3.28289 63.546000 Cu 0.379271 0.199948 2.84665e-16 419 63.546 5.65345e-05 -3.2832 63.546000 Cu 0.365585 0.17975 0.5 420 63.546 2.35535e-05 -3.28306 63.546000 Cu 0.298094 0.203344 0.5 421 63.546 2.52906e-05 -3.28308 63.546000 Cu 0.446755 0.17633 1.59353e-16 422 63.546 0.000116658 -3.28323 63.546000 Cu 0.460374 0.19655 0.5 425 63.546 8.46709e-05 -3.28318 63.546000 Cu 0.392828 0.220162 0.5 446 63.546 4.40713e-05 -3.28317 63.546000 Cu 0.473908 0.216786 2.85797e-16 448 63.546 3.25623e-05 -3.28316 63.546000 Cu 0.703477 0.186479 1.62542e-16 380 63.546 0.000150541 -3.28292 63.546000 Cu 0.717081 0.206687 0.5 405 63.546 3.60959e-05 -3.28303 63.546000 Cu 0.541434 0.193164 2.65439e-16 423 63.546 8.7714e-05 -3.28314 63.546000 Cu 0.527924 0.172933 0.5 424 63.546 0.000147422 -3.28327 63.546000 Cu 0.609018 0.169563 1.29843e-16 426 63.546 0.000105891 -3.2831 63.546000 Cu 0.622468 0.189817 0.5 427 63.546 1.46575e-05 -3.28298 63.546000 Cu 0.554939 0.213424 0.5 450 63.546 6.27179e-06 -3.28315 63.546000 Cu 0.635939 0.210062 9.03773e-17 452 63.546 0.000107412 -3.28309 63.546000 Cu 0.865742 0.179723 3.78261e-17 383 63.546 2.95525e-05 -3.28311 63.546000 Cu 0.784602 0.183119 0.5 385 63.546 0.000108044 -3.28293 63.546000 Cu 0.946917 0.176305 0.5 389 63.546 0.000214778 -3.28329 63.546000 Cu 0.798231 0.203311 2.90418e-16 406 63.546 1.70853e-05 -3.28308 63.546000 Cu 0.892939 0.220133 1.27369e-16 407 63.546 6.26526e-05 -3.28314 63.546000 Cu 0.879414 0.19992 0.5 408 63.546 9.93776e-05 -3.28319 63.546000 Cu 0.960495 0.196536 3.23981e-16 410 63.546 0.000111808 -3.28318 63.546000 Cu 0.97401 0.216778 0.5 413 63.546 3.96371e-05 -3.28312 63.546000 Cu 0.0820893 0.253889 1.58935e-16 437 63.546 1.70982e-05 -3.28302 63.546000 Cu 0.0685894 0.233679 0.5 438 63.546 9.4372e-05 -3.28299 63.546000 Cu 0.000966834 0.257241 0.5 439 63.546 4.67187e-05 -3.28302 63.546000 Cu 0.149607 0.230315 6.14935e-17 440 63.546 4.67152e-05 -3.28301 63.546000 Cu 0.23065 0.226932 0.5 442 63.546 1.37131e-05 -3.28306 63.546000 Cu 0.16316 0.25053 0.5 443 63.546 2.60709e-05 -3.28297 63.546000 Cu 0.0144815 0.277455 3.48454e-17 462 63.546 3.84613e-05 -3.28301 63.546000 Cu 0.0955733 0.274096 0.5 464 63.546 4.38932e-06 -3.28308 63.546000 Cu 0.176689 0.27073 8.04811e-18 466 63.546 2.14358e-05 -3.28306 63.546000 Cu 0.244217 0.247148 2.43232e-17 441 63.546 6.31217e-06 -3.28301 63.546000 Cu 0.311719 0.223548 2.7459e-16 444 63.546 1.82896e-05 -3.2831 63.546000 Cu 0.406332 0.24039 2.59477e-16 445 63.546 1.90966e-05 -3.2831 63.546000 Cu 0.325253 0.243764 0.5 447 63.546 1.7919e-05 -3.2831 63.546000 Cu 0.487381 0.237029 0.5 451 63.546 4.35594e-06 -3.28307 63.546000 Cu 0.257764 0.267366 0.5 468 63.546 3.90026e-05 -3.28308 63.546000 Cu 0.338782 0.263996 1.42332e-16 470 63.546 1.41979e-05 -3.28316 63.546000 Cu 0.419809 0.260625 0.5 472 63.546 7.64836e-06 -3.28311 63.546000 Cu 0.730637 0.22689 5.57704e-17 404 63.546 1.90605e-05 -3.28308 63.546000 Cu 0.663063 0.250498 2.19833e-16 428 63.546 1.14447e-05 -3.28309 63.546000 Cu 0.744176 0.247101 0.5 430 63.546 4.22397e-06 -3.28311 63.546000 Cu 0.676552 0.270702 0.5 431 63.546 3.80201e-05 -3.28317 63.546000 Cu 0.568466 0.23367 4.1263e-16 449 63.546 6.27665e-05 -3.28303 63.546000 Cu 0.649543 0.230291 0.5 453 63.546 5.10548e-05 -3.28305 63.546000 Cu 0.50084 0.257263 3.28721e-16 474 63.546 2.5978e-05 -3.28309 63.546000 Cu 0.595423 0.274102 1.44568e-17 475 63.546 4.3205e-05 -3.28318 63.546000 Cu 0.581947 0.253883 0.5 476 63.546 1.56098e-05 -3.28307 63.546000 Cu 0.514322 0.277495 0.5 477 63.546 4.4074e-05 -3.28318 63.546000 Cu 0.81178 0.223507 0.5 409 63.546 9.99307e-06 -3.28311 63.546000 Cu 0.75773 0.267304 1.08977e-16 429 63.546 2.63006e-05 -3.28308 63.546000 Cu 0.825267 0.243708 1.57147e-16 432 63.546 5.41602e-05 -3.28313 63.546000 Cu 0.919906 0.260564 7.79177e-17 433 63.546 5.91919e-05 -3.28308 63.546000 Cu 0.906427 0.240346 0.5 434 63.546 5.13818e-05 -3.28306 63.546000 Cu 0.838821 0.263926 0.5 435 63.546 3.46895e-05 -3.28313 63.546000 Cu 0.987514 0.237014 1.96076e-16 436 63.546 1.56385e-05 -3.28302 63.546000 Cu 0.109074 0.294306 2.76319e-17 463 63.546 2.88167e-05 -3.28316 63.546000 Cu 0.0280462 0.297674 0.5 465 63.546 4.36306e-05 -3.28303 63.546000 Cu 0.190165 0.29095 0.5 469 63.546 1.99112e-05 -3.28317 63.546000 Cu 0.0414659 0.317897 1.76969e-16 486 63.546 2.93826e-05 -3.28314 63.546000 Cu 0.122532 0.314539 0.5 488 63.546 3.3655e-06 -3.2832 63.546000 Cu 0.203558 0.311178 3.09256e-16 490 63.546 1.98377e-05 -3.28312 63.546000 Cu 0.217039 0.331404 0.5 493 63.546 2.58047e-05 -3.28306 63.546000 Cu 0.271215 0.287597 3.14502e-16 467 63.546 1.12143e-05 -3.28311 63.546000 Cu 0.433258 0.280872 2.68032e-16 471 63.546 1.91601e-05 -3.28309 63.546000 Cu 0.352259 0.284236 0.5 473 63.546 1.9281e-05 -3.28305 63.546000 Cu 0.298066 0.328052 1.18039e-16 491 63.546 3.25772e-05 -3.28299 63.546000 Cu 0.284641 0.307821 0.5 492 63.546 9.52118e-06 -3.28301 63.546000 Cu 0.365671 0.30446 5.28493e-17 494 63.546 9.8889e-06 -3.28295 63.546000 Cu 0.460121 0.321326 8.49523e-18 495 63.546 0.000180367 -3.28315 63.546000 Cu 0.446712 0.301108 0.5 496 63.546 7.07418e-05 -3.28305 63.546000 Cu 0.379012 0.324697 0.5 497 63.546 7.69027e-05 -3.28306 63.546000 Cu 0.690135 0.290884 4.30723e-17 454 63.546 1.92581e-05 -3.28315 63.546000 Cu 0.703726 0.311055 0.5 457 63.546 7.1919e-05 -3.28303 63.546000 Cu 0.717372 0.331204 1.19768e-16 478 63.546 0.000213975 -3.28281 63.546000 Cu 0.527779 0.297718 5.93772e-17 498 63.546 0.000100098 -3.28319 63.546000 Cu 0.622505 0.31448 5.21339e-17 499 63.546 6.03195e-05 -3.28317 63.546000 Cu 0.60894 0.294304 0.5 500 63.546 5.74098e-05 -3.28321 63.546000 Cu 0.541252 0.317921 0.5 501 63.546 0.000270299 -3.28316 63.546000 Cu 0.784901 0.30768 6.75147e-17 455 63.546 6.64569e-05 -3.28296 63.546000 Cu 0.771318 0.287491 0.5 456 63.546 4.81623e-05 -3.28305 63.546000 Cu 0.852428 0.284133 1.70322e-16 458 63.546 4.78422e-05 -3.28297 63.546000 Cu 0.947023 0.301012 2.03051e-16 459 63.546 3.64698e-05 -3.2828 63.546000 Cu 0.933476 0.280799 0.5 460 63.546 2.28234e-05 -3.28295 63.546000 Cu 0.865994 0.304328 0.5 461 63.546 8.61437e-05 -3.28282 63.546000 Cu 0.798512 0.327856 0.5 480 63.546 0.000220691 -3.28282 63.546000 Cu 0.879518 0.324541 3.57694e-17 482 63.546 8.41353e-05 -3.28288 63.546000 Cu 0.960472 0.32123 0.5 484 63.546 2.93428e-05 -3.283 63.546000 Cu 0.136013 0.334774 3.01566e-16 487 63.546 2.29201e-05 -3.28312 63.546000 Cu 0.0549335 0.338122 0.5 489 63.546 2.75981e-05 -3.28328 63.546000 Cu 0.00050707 0.381914 1.68861e-16 509 63.546 0.000227164 -3.28346 63.546000 Cu 0.0684216 0.358361 2.26659e-16 512 63.546 0.000100174 -3.28337 63.546000 Cu 0.162984 0.375227 3.34146e-17 513 63.546 0.000461319 -3.28297 63.546000 Cu 0.14951 0.354989 0.5 514 63.546 9.11048e-05 -3.28308 63.546000 Cu 0.081805 0.378567 0.5 515 63.546 0.000274697 -3.28332 63.546000 Cu 0.230497 0.351646 1.76433e-16 516 63.546 5.38579e-05 -3.28291 63.546000 Cu 0.243869 0.371904 0.5 519 63.546 8.79278e-05 -3.28276 63.546000 Cu 0.324787 0.368567 9.69052e-17 517 63.546 0.000374739 -3.28299 63.546000 Cu 0.311442 0.348301 0.5 518 63.546 2.14144e-05 -3.28296 63.546000 Cu 0.392398 0.34494 7.38936e-17 520 63.546 0.000361061 -3.28321 63.546000 Cu 0.487151 0.361683 2.39059e-16 521 63.546 0.000677746 -3.28334 63.546000 Cu 0.473559 0.341524 0.5 522 63.546 0.00042174 -3.28339 63.546000 Cu 0.405828 0.36516 0.5 523 63.546 0.001127 -3.28332 63.546000 Cu 0.338046 0.388828 0.5 544 63.546 0.00236066 -3.28325 63.546000 Cu 0.419308 0.38531 2.29431e-16 546 63.546 0.00220523 -3.28339 63.546000 Cu 0.73107 0.351355 0.5 481 63.546 0.000682007 -3.28253 63.546000 Cu 0.663704 0.374836 0.5 503 63.546 0.00198413 -3.28239 63.546000 Cu 0.744599 0.371543 1.32675e-16 504 63.546 0.00129635 -3.28233 63.546000 Cu 0.554847 0.338072 3.35338e-17 524 63.546 0.000172821 -3.28319 63.546000 Cu 0.649928 0.354726 3.00344e-16 525 63.546 0.000447114 -3.28265 63.546000 Cu 0.636169 0.334618 0.5 526 63.546 7.58753e-05 -3.28298 63.546000 Cu 0.568556 0.35818 0.5 527 63.546 0.000132007 -3.28302 63.546000 Cu 0.500923 0.381733 0.5 548 63.546 0.000343326 -3.28304 63.546000 Cu 0.582466 0.378237 3.26902e-16 550 63.546 0.000829146 -3.28264 63.546000 Cu 0.812086 0.348054 1.14253e-16 479 63.546 0.000455224 -3.28273 63.546000 Cu 0.973951 0.341479 7.72321e-17 483 63.546 0.000116072 -3.2833 63.546000 Cu 0.892982 0.34478 0.5 485 63.546 9.23005e-05 -3.28306 63.546000 Cu 0.838344 0.388611 7.69638e-17 505 63.546 0.000785009 -3.28309 63.546000 Cu 0.825348 0.368302 0.5 506 63.546 0.00024163 -3.2828 63.546000 Cu 0.906235 0.365035 3.48454e-17 508 63.546 0.000238334 -3.28333 63.546000 Cu 0.987307 0.361717 0.5 510 63.546 0.000252887 -3.28343 63.546000 Cu 0.919248 0.385278 0.5 511 63.546 0.000686068 -3.28339 63.546000 Cu 0.0265539 0.422117 1 535 63.546 0.00507509 -3.28111 63.546000 Cu 0.0136046 0.40205 0.5 536 63.546 0.000310794 -3.28273 63.546000 Cu 0.0950618 0.398728 3.48454e-17 538 63.546 0.00111792 -3.2829 63.546000 Cu 0.189042 0.415741 9.68754e-18 539 63.546 0.00223597 -3.2822 63.546000 Cu 0.176257 0.395469 0.5 540 63.546 0.00135546 -3.28262 63.546000 Cu 0.107834 0.418862 0.5 541 63.546 0.0035376 -3.28139 63.546000 Cu 0.0396599 0.442304 0.5 560 63.546 0.0253909 -3.28143 63.546000 Cu 0.119806 0.439066 3.48454e-17 562 63.546 0.0201991 -3.28032 63.546000 Cu 0.200851 0.436147 0.5 564 63.546 0.0139846 -3.28184 63.546000 Cu 0.257145 0.392216 3.20136e-17 542 63.546 0.000884223 -3.2828 63.546000 Cu 0.351489 0.409026 1.319e-16 543 63.546 0.00655687 -3.28325 63.546000 Cu 0.270137 0.412564 0.5 545 63.546 0.00785408 -3.28326 63.546000 Cu 0.433196 0.405335 0.5 549 63.546 0.00145974 -3.28231 63.546000 Cu 0.282959 0.432783 1.53212e-17 566 63.546 0.0259497 -3.2827 63.546000 Cu 0.365695 0.429046 0.5 568 63.546 0.00846678 -3.28173 63.546000 Cu 0.447712 0.425218 7.64273e-17 570 63.546 0.00451777 -3.27976 63.546000 Cu 0.677281 0.395034 1.81023e-16 502 63.546 0.00365844 -3.28206 63.546000 Cu 0.702317 0.435941 3.48454e-17 528 63.546 0.00986129 -3.28199 63.546000 Cu 0.690333 0.415362 0.5 529 63.546 0.00361498 -3.28201 63.546000 Cu 0.514945 0.401708 1.16996e-16 547 63.546 0.00187523 -3.28178 63.546000 Cu 0.59636 0.398289 0.5 551 63.546 0.0041152 -3.28183 63.546000 Cu 0.5433 0.441834 6.95119e-17 571 63.546 0.0455293 -3.27926 63.546000 Cu 0.529058 0.42164 0.5 572 63.546 0.0134286 -3.27987 63.546000 Cu 0.609873 0.418414 1.36013e-16 574 63.546 0.0111543 -3.28083 63.546000 Cu 0.622539 0.438813 0.5 575 63.546 0.0230886 -3.28112 63.546000 Cu 0.757794 0.391842 0.5 507 63.546 0.000832995 -3.28244 63.546000 Cu 0.770599 0.412294 4.92723e-17 530 63.546 0.0032091 -3.2835 63.546000 Cu 0.864651 0.429154 1 531 63.546 0.00258482 -3.28293 63.546000 Cu 0.851195 0.408929 0.5 532 63.546 0.00280942 -3.28343 63.546000 Cu 0.783195 0.432745 0.5 533 63.546 0.0178271 -3.2859 63.546000 Cu 0.932191 0.405462 1 534 63.546 0.00134676 -3.2825 63.546000 Cu 0.945602 0.425611 0.5 537 63.546 0.00201051 -3.28144 63.546000 Cu 0.0537389 0.463071 5.07627e-17 559 63.546 0.0661643 -3.26842 63.546000 Cu 0.211506 0.456552 2.93905e-17 563 63.546 0.123153 -3.27849 63.546000 Cu 0.130604 0.459799 0.5 565 63.546 0.114312 -3.27609 63.546000 Cu 0.0695785 0.485004 0.5 581 63.546 0.451919 -3.22378 63.546000 Cu 0.141804 0.481646 3.48454e-17 582 63.546 0.754804 -3.17291 63.546000 Cu 0.222198 0.475795 0.5 584 63.546 0.747027 -3.1956 63.546000 Cu 0.237224 0.493813 5.44589e-17 583 63.546 9.36384 -2.9716 63.546000 Cu 0.493303 0.486106 0.5 297 63.546 0.373446 -3.27514 63.546000 Cu 0.381081 0.448821 9.35072e-17 567 63.546 0.0266475 -3.27817 63.546000 Cu 0.29616 0.452607 0.5 569 63.546 0.0377737 -3.27728 63.546000 Cu 0.463334 0.445143 0.5 573 63.546 0.0379271 -3.27715 63.546000 Cu 0.309959 0.471704 1.73571e-16 585 63.546 0.0268162 -3.27772 63.546000 Cu 0.409937 0.48696 3.48454e-17 586 63.546 0.482032 -3.24011 63.546000 Cu 0.396341 0.468176 0.5 587 63.546 0.114572 -3.26425 63.546000 Cu 0.321265 0.49015 0.5 588 63.546 3.83583 -3.1614 63.546000 Cu 0.479917 0.465412 3.48454e-17 589 63.546 0.188486 -3.26936 63.546000 Cu 0.64568 0.48186 0.5 14 63.546 0.71942 -3.18773 63.546000 Cu 0.633832 0.459841 3.48454e-17 292 63.546 0.0835853 -3.2766 63.546000 Cu 0.724848 0.476391 3.48454e-17 552 63.546 0.586668 -3.22275 63.546000 Cu 0.713403 0.456676 0.5 553 63.546 0.113348 -3.28535 63.546000 Cu 0.742743 0.494354 0.5 577 63.546 10.2977 -2.87141 63.546000 Cu 0.572601 0.485002 1.58578e-17 590 63.546 0.395173 -3.21939 63.546000 Cu 0.557798 0.462851 0.5 591 63.546 0.0662084 -3.26203 63.546000 Cu 0.796096 0.452714 3.48454e-17 554 63.546 0.0189199 -3.27874 63.546000 Cu 0.892603 0.469469 8.43562e-17 555 63.546 0.0509784 -3.29001 63.546000 Cu 0.879019 0.449307 0.5 556 63.546 0.0171162 -3.28249 63.546000 Cu 0.809687 0.472053 0.5 557 63.546 0.109575 -3.27206 63.546000 Cu 0.959789 0.445867 1 558 63.546 0.00493463 -3.2811 63.546000 Cu 0.974887 0.466247 0.5 561 63.546 0.0818624 -3.28176 63.546000 Cu 0.819328 0.492455 3.48454e-17 578 63.546 9.86086 -3.07813 63.546000 Cu 0.902676 0.488808 0.5 579 63.546 4.03635 -3.17294 63.546000 Cu 0.989551 0.486349 2.72861e-16 580 63.546 0.418162 -3.27398 63.546000 Cu 0.0771137 0.506815 4.03002e-17 2 63.546 1.12288 -3.24781 63.546000 Cu 0.236599 0.519642 3.98829e-17 4 63.546 9.42782 -2.97472 63.546000 Cu 0.161045 0.506754 0.5 5 63.546 6.85594 -3.13389 63.546000 Cu 0.0529669 0.550534 1.36013e-16 23 63.546 0.0652829 -3.26798 63.546000 Cu 0.0690885 0.528588 0.5 24 63.546 0.44686 -3.22162 63.546000 Cu 0.141329 0.531941 4.81396e-17 26 63.546 0.741613 -3.17338 63.546000 Cu 0.221513 0.537687 0.5 28 63.546 0.74644 -3.19986 63.546000 Cu 0.129804 0.553775 0.5 29 63.546 0.112109 -3.27738 63.546000 Cu 0.320596 0.52323 0.5 6 63.546 3.91251 -3.16322 63.546000 Cu 0.335445 0.506699 1 7 63.546 6.44412 -2.96869 63.546000 Cu 0.409407 0.526464 3.85415e-17 8 63.546 0.477811 -3.23708 63.546000 Cu 0.41536 0.506716 0.5 9 63.546 0.663614 -3.28295 63.546000 Cu 0.496148 0.50672 1.01138e-16 10 63.546 0.215062 -3.28086 63.546000 Cu 0.492842 0.527325 0.5 13 63.546 0.37489 -3.27294 63.546000 Cu 0.309157 0.541719 1 30 63.546 0.028073 -3.27888 63.546000 Cu 0.39544 0.545228 0.5 33 63.546 0.111539 -3.26346 63.546000 Cu 0.479007 0.548019 6.20003e-18 34 63.546 0.190768 -3.26724 63.546000 Cu 0.572119 0.528427 4.64108e-17 11 63.546 0.404701 -3.21743 63.546000 Cu 0.580653 0.506732 0.5 12 63.546 1.07391 -3.24571 63.546000 Cu 0.724281 0.53715 3.48454e-17 15 63.546 0.592941 -3.22287 63.546000 Cu 0.742506 0.519207 0.5 16 63.546 10.3057 -2.87161 63.546000 Cu 0.645215 0.531627 0.5 17 63.546 0.721803 -3.18691 63.546000 Cu 0.5568 0.550588 0.5 36 63.546 0.0635483 -3.26025 63.546000 Cu 0.632718 0.553622 3.48454e-17 38 63.546 0.0861181 -3.27714 63.546000 Cu 0.667264 0.506711 7.45196e-19 576 63.546 6.96979 -3.16294 63.546000 Cu 0.914728 0.506799 5.76185e-17 1 63.546 6.16871 -3.04295 63.546000 Cu 0.994773 0.5068 0.5 3 63.546 0.657225 -3.29129 63.546000 Cu 0.819144 0.521214 0 18 63.546 9.86111 -3.07928 63.546000 Cu 0.892032 0.54417 1.60843e-16 19 63.546 0.0518288 -3.29004 63.546000 Cu 0.902324 0.524787 0.5 20 63.546 4.0573 -3.17367 63.546000 Cu 0.809086 0.541569 0.5 21 63.546 0.116487 -3.27226 63.546000 Cu 0.989147 0.527253 1.69934e-16 22 63.546 0.411223 -3.27185 63.546000 Cu 0.974173 0.547363 0.5 25 63.546 0.0808484 -3.28101 63.546000 Cu 0.210652 0.556985 3.48454e-17 27 63.546 0.115511 -3.28018 63.546000 Cu 0.02507 0.591507 4.46819e-17 47 63.546 0.00618437 -3.28128 63.546000 Cu 0.0385596 0.571293 0.5 48 63.546 0.0244665 -3.2816 63.546000 Cu 0.118675 0.574503 3.48454e-17 50 63.546 0.0194588 -3.28088 63.546000 Cu 0.187529 0.597812 7.52648e-17 51 63.546 0.00271921 -3.28242 63.546000 Cu 0.1997 0.577396 0.5 52 63.546 0.0132452 -3.28232 63.546000 Cu 0.106349 0.594725 0.5 53 63.546 0.00376053 -3.28156 63.546000 Cu 0.295159 0.560877 0.5 31 63.546 0.0374622 -3.27802 63.546000 Cu 0.379896 0.564622 3.5203e-17 32 63.546 0.0279438 -3.27822 63.546000 Cu 0.461955 0.56832 0.5 37 63.546 0.0372946 -3.27658 63.546000 Cu 0.281686 0.580726 3.48454e-17 54 63.546 0.0261442 -3.28324 63.546000 Cu 0.26853 0.601009 0.5 55 63.546 0.00622513 -3.28352 63.546000 Cu 0.349618 0.604534 8.94235e-17 56 63.546 0.00599712 -3.28349 63.546000 Cu 0.364136 0.58445 0.5 57 63.546 0.0094077 -3.28206 63.546000 Cu 0.445911 0.588282 1.15744e-16 58 63.546 0.0044063 -3.2798 63.546000 Cu 0.431059 0.608211 0.5 61 63.546 0.00229664 -3.28247 63.546000 Cu 0.541738 0.57164 1 35 63.546 0.0447355 -3.27875 63.546000 Cu 0.70061 0.577549 1 39 63.546 0.0118724 -3.28222 63.546000 Cu 0.712264 0.556856 0.5 40 63.546 0.114778 -3.28615 63.546000 Cu 0.620868 0.574661 0.5 41 63.546 0.0220861 -3.28084 63.546000 Cu 0.527058 0.59187 0.5 60 63.546 0.0139103 -3.27985 63.546000 Cu 0.607785 0.595082 1 62 63.546 0.0105222 -3.28063 63.546000 Cu 0.688209 0.598115 0.5 64 63.546 0.0024731 -3.28197 63.546000 Cu 0.795007 0.560867 1 42 63.546 0.0183292 -3.2789 63.546000 Cu 0.863134 0.584449 3.48454e-17 43 63.546 0.00237046 -3.28281 63.546000 Cu 0.878016 0.564335 0.5 44 63.546 0.0185102 -3.28209 63.546000 Cu 0.781619 0.580798 0.5 45 63.546 0.0183993 -3.28607 63.546000 Cu 0.958767 0.567784 2.2028e-17 46 63.546 0.00590896 -3.28081 63.546000 Cu 0.944127 0.588027 0.5 49 63.546 0.00274385 -3.28145 63.546000 Cu 0.768541 0.601215 1 66 63.546 0.00405241 -3.28362 63.546000 Cu 0.849159 0.604634 0.5 68 63.546 0.00339852 -3.28355 63.546000 Cu 0.930335 0.608139 1 70 63.546 0.00119589 -3.28256 63.546000 Cu 0.0117591 0.61156 0.5 72 63.546 0.000551745 -3.28255 63.546000 Cu 0.0932342 0.614853 1 74 63.546 0.00118619 -3.28276 63.546000 Cu 0.160858 0.638344 3.42194e-17 75 63.546 0.000370539 -3.28282 63.546000 Cu 0.174383 0.618094 0.5 76 63.546 0.00126239 -3.28251 63.546000 Cu 0.0797765 0.635009 0.5 77 63.546 0.000432895 -3.28322 63.546000 Cu 0.241694 0.641671 0.5 80 63.546 7.82497e-05 -3.28268 63.546000 Cu 0.066193 0.655192 1 98 63.546 6.29548e-05 -3.28327 63.546000 Cu 0.147322 0.658569 0.5 100 63.546 0.000119357 -3.28297 63.546000 Cu 0.228262 0.661937 3.48454e-17 102 63.546 7.41009e-05 -3.28286 63.546000 Cu 0.255138 0.621372 1 78 63.546 0.000556485 -3.2827 63.546000 Cu 0.322524 0.645037 3.48454e-17 79 63.546 0.000324774 -3.28302 63.546000 Cu 0.335951 0.624767 0.5 81 63.546 0.00175578 -3.28326 63.546000 Cu 0.417098 0.628277 1 82 63.546 0.00176839 -3.28354 63.546000 Cu 0.48478 0.651919 1.49039e-19 83 63.546 0.000449656 -3.28345 63.546000 Cu 0.498579 0.631811 0.5 84 63.546 0.000446488 -3.28324 63.546000 Cu 0.403553 0.648455 0.5 85 63.546 0.000646979 -3.28342 63.546000 Cu 0.309171 0.665296 0.5 104 63.546 4.35047e-05 -3.28295 63.546000 Cu 0.512635 0.611821 3.48454e-17 59 63.546 0.00183976 -3.28163 63.546000 Cu 0.674868 0.618457 1 63 63.546 0.00278677 -3.28182 63.546000 Cu 0.594005 0.61522 0.5 65 63.546 0.00366234 -3.2816 63.546000 Cu 0.579989 0.63529 1 86 63.546 0.000688675 -3.28273 63.546000 Cu 0.647444 0.658798 3.48454e-17 87 63.546 0.000408592 -3.28271 63.546000 Cu 0.661128 0.638658 0.5 88 63.546 0.0012915 -3.28229 63.546000 Cu 0.566116 0.655379 0.5 89 63.546 0.000146257 -3.28308 63.546000 Cu 0.741982 0.641941 1 90 63.546 0.000649028 -3.28233 63.546000 Cu 0.728547 0.662145 0.5 93 63.546 0.000496926 -3.28258 63.546000 Cu 0.835942 0.624913 5.66349e-18 67 63.546 0.00116807 -3.28319 63.546000 Cu 0.755334 0.621647 0.5 69 63.546 0.000559295 -3.28238 63.546000 Cu 0.998406 0.631652 1.17741e-17 71 63.546 0.000166299 -3.2834 63.546000 Cu 0.916974 0.628273 0.5 73 63.546 0.000859702 -3.2834 63.546000 Cu 0.80956 0.665434 1 91 63.546 0.000173357 -3.28282 63.546000 Cu 0.822788 0.645193 0.5 92 63.546 0.000144276 -3.28288 63.546000 Cu 0.903786 0.648471 1 94 63.546 0.000370946 -3.28342 63.546000 Cu 0.984985 0.651816 0.5 96 63.546 0.000227818 -3.28351 63.546000 Cu 0.133825 0.678783 3.48454e-17 99 63.546 2.21847e-05 -3.28306 63.546000 Cu 0.0527312 0.675393 0.5 101 63.546 4.86201e-05 -3.28317 63.546000 Cu 0.214822 0.682169 0.5 105 63.546 5.73865e-05 -3.28298 63.546000 Cu 0.0392894 0.695604 2.78703e-17 122 63.546 9.39239e-05 -3.28312 63.546000 Cu 0.106901 0.719203 1 123 63.546 7.8138e-05 -3.28311 63.546000 Cu 0.12033 0.698991 0.5 124 63.546 1.71644e-05 -3.2831 63.546000 Cu 0.0258909 0.715843 0.5 125 63.546 2.34492e-05 -3.28313 63.546000 Cu 0.201412 0.702385 3.48454e-17 126 63.546 2.76638e-05 -3.28306 63.546000 Cu 0.295837 0.685536 4.19396e-17 103 63.546 2.82359e-05 -3.28302 63.546000 Cu 0.390128 0.66867 2.25645e-17 106 63.546 0.000275285 -3.28309 63.546000 Cu 0.45792 0.692275 1 107 63.546 0.000116826 -3.28313 63.546000 Cu 0.471277 0.672085 0.5 108 63.546 0.000222656 -3.28317 63.546000 Cu 0.376839 0.688897 0.5 109 63.546 3.89303e-05 -3.28304 63.546000 Cu 0.282497 0.705759 0.5 128 63.546 2.95411e-05 -3.28309 63.546000 Cu 0.36357 0.709136 3.48454e-17 130 63.546 4.34554e-05 -3.28312 63.546000 Cu 0.444581 0.7125 0.5 132 63.546 2.7615e-05 -3.28316 63.546000 Cu 0.552514 0.6755 1 110 63.546 0.000173972 -3.28314 63.546000 Cu 0.620277 0.699074 1 111 63.546 5.70198e-05 -3.28312 63.546000 Cu 0.6338 0.678925 0.5 112 63.546 7.78934e-05 -3.283 63.546000 Cu 0.539068 0.695675 0.5 113 63.546 9.37008e-05 -3.28316 63.546000 Cu 0.715038 0.682299 1.1944e-16 114 63.546 0.000130477 -3.28285 63.546000 Cu 0.701549 0.702453 0.5 117 63.546 2.89538e-05 -3.28303 63.546000 Cu 0.525684 0.71587 3.48454e-17 134 63.546 7.23101e-05 -3.28311 63.546000 Cu 0.606871 0.719238 0.5 136 63.546 6.00942e-05 -3.28313 63.546000 Cu 0.971624 0.672031 3.48454e-17 95 63.546 0.000103448 -3.28321 63.546000 Cu 0.890562 0.668706 0.5 97 63.546 7.21671e-05 -3.2831 63.546000 Cu 0.782772 0.705808 1 115 63.546 6.62058e-05 -3.28302 63.546000 Cu 0.796234 0.685632 0.5 116 63.546 0.000221282 -3.2829 63.546000 Cu 0.877285 0.688937 5.00772e-18 118 63.546 6.47533e-05 -3.28296 63.546000 Cu 0.944926 0.712497 5.85128e-17 119 63.546 2.47888e-05 -3.2831 63.546000 Cu 0.958284 0.692251 0.5 120 63.546 8.05741e-05 -3.28305 63.546000 Cu 0.863931 0.709161 0.5 121 63.546 0.000165747 -3.28304 63.546000 Cu 0.188 0.722587 0.5 129 63.546 1.08352e-05 -3.28304 63.546000 Cu 0.0125337 0.736076 2.44066e-16 146 63.546 1.24354e-05 -3.28306 63.546000 Cu 0.0802638 0.759656 3.48454e-17 147 63.546 1.48549e-05 -3.28314 63.546000 Cu 0.0935853 0.739425 0.5 148 63.546 2.64298e-05 -3.28312 63.546000 Cu 0.174667 0.742794 6.73657e-17 150 63.546 3.4497e-05 -3.28312 63.546000 Cu 0.242344 0.766399 1.12376e-17 151 63.546 1.899e-05 -3.28307 63.546000 Cu 0.161309 0.763026 0.5 153 63.546 1.29508e-05 -3.28316 63.546000 Cu 0.269093 0.725968 1 127 63.546 6.13755e-06 -3.28303 63.546000 Cu 0.431242 0.732732 1.14641e-16 131 63.546 4.67105e-05 -3.28308 63.546000 Cu 0.350164 0.729361 0.5 133 63.546 3.71817e-05 -3.28305 63.546000 Cu 0.255689 0.746181 0.5 152 63.546 1.94655e-05 -3.28304 63.546000 Cu 0.323434 0.769767 0.5 154 63.546 1.5311e-05 -3.28308 63.546000 Cu 0.336779 0.749567 1 155 63.546 1.77863e-05 -3.28302 63.546000 Cu 0.404588 0.773143 3.48454e-17 156 63.546 7.19805e-06 -3.28313 63.546000 Cu 0.417899 0.752938 0.5 157 63.546 2.30515e-05 -3.28307 63.546000 Cu 0.49908 0.756297 6.13147e-17 158 63.546 1.55407e-05 -3.28313 63.546000 Cu 0.485769 0.776512 0.5 161 63.546 2.52512e-05 -3.28312 63.546000 Cu 0.593522 0.739429 6.30137e-17 135 63.546 5.51506e-05 -3.28313 63.546000 Cu 0.512364 0.736079 0.5 137 63.546 1.4033e-05 -3.2831 63.546000 Cu 0.688131 0.722617 3.48454e-17 138 63.546 2.09018e-05 -3.2831 63.546000 Cu 0.674734 0.742798 0.5 141 63.546 2.91332e-05 -3.28313 63.546000 Cu 0.580218 0.759635 0.5 160 63.546 4.40217e-05 -3.28313 63.546000 Cu 0.66136 0.762999 1 162 63.546 3.22813e-05 -3.28314 63.546000 Cu 0.742488 0.766374 0.5 164 63.546 1.42356e-05 -3.283 63.546000 Cu 0.755875 0.74618 1.05043e-16 139 63.546 8.79391e-06 -3.28304 63.546000 Cu 0.769326 0.725986 0.5 140 63.546 4.0066e-05 -3.28309 63.546000 Cu 0.850449 0.729369 1 142 63.546 5.31554e-05 -3.28306 63.546000 Cu 0.91809 0.75294 3.95252e-17 143 63.546 3.142e-05 -3.283 63.546000 Cu 0.931479 0.732732 0.5 144 63.546 6.16798e-05 -3.28301 63.546000 Cu 0.83699 0.749569 0.5 145 63.546 2.84231e-05 -3.28299 63.546000 Cu 0.999202 0.756303 0.5 149 63.546 2.36583e-05 -3.28308 63.546000 Cu 0.823612 0.769755 1 166 63.546 6.66696e-06 -3.28302 63.546000 Cu 0.904757 0.773144 0.5 168 63.546 3.42815e-05 -3.28309 63.546000 Cu 0.985842 0.776524 6.16724e-17 170 63.546 2.87807e-05 -3.28312 63.546000 Cu 0.0535142 0.800124 1.45164e-16 171 63.546 6.38278e-05 -3.28296 63.546000 Cu 0.0668863 0.779896 0.5 172 63.546 1.90287e-05 -3.28307 63.546000 Cu 0.147899 0.783248 1.26594e-16 174 63.546 3.16311e-05 -3.28303 63.546000 Cu 0.215649 0.806816 2.22963e-16 175 63.546 1.50038e-05 -3.28298 63.546000 Cu 0.228986 0.786613 0.5 176 63.546 2.4426e-05 -3.28306 63.546000 Cu 0.134553 0.803461 0.5 177 63.546 2.89841e-05 -3.2829 63.546000 Cu 0.0402151 0.820337 0.5 196 63.546 5.62344e-05 -3.283 63.546000 Cu 0.121277 0.823682 9.01985e-17 198 63.546 1.60603e-05 -3.28291 63.546000 Cu 0.202324 0.827016 0.5 200 63.546 8.40163e-05 -3.2829 63.546000 Cu 0.310091 0.789966 7.49667e-17 178 63.546 4.38518e-05 -3.28314 63.546000 Cu 0.296823 0.81017 0.5 179 63.546 4.77975e-05 -3.28309 63.546000 Cu 0.37798 0.81355 4.7156e-17 180 63.546 4.06676e-05 -3.28321 63.546000 Cu 0.391301 0.793344 0.5 181 63.546 1.24491e-05 -3.28317 63.546000 Cu 0.472444 0.796723 3.48454e-17 182 63.546 1.83656e-05 -3.2831 63.546000 Cu 0.459105 0.816944 0.5 185 63.546 4.02921e-05 -3.28319 63.546000 Cu 0.283412 0.830361 5.22531e-17 202 63.546 0.000113037 -3.28298 63.546000 Cu 0.5669 0.779869 1 159 63.546 1.53937e-05 -3.28309 63.546000 Cu 0.729095 0.786579 4.25656e-17 163 63.546 9.0899e-06 -3.2831 63.546000 Cu 0.647985 0.783215 0.5 165 63.546 2.41939e-05 -3.28308 63.546000 Cu 0.540175 0.820313 1.42094e-16 183 63.546 3.39121e-05 -3.28306 63.546000 Cu 0.553551 0.800094 0.5 184 63.546 3.9802e-05 -3.28298 63.546000 Cu 0.634597 0.803432 1.11481e-17 186 63.546 1.76879e-05 -3.28295 63.546000 Cu 0.702262 0.826996 3.48454e-17 187 63.546 6.19079e-05 -3.28289 63.546000 Cu 0.715661 0.806788 0.5 188 63.546 2.43105e-05 -3.28307 63.546000 Cu 0.621212 0.823659 0.5 189 63.546 1.94364e-05 -3.28294 63.546000 Cu 0.891353 0.793346 1.89965e-16 167 63.546 1.18202e-05 -3.28321 63.546000 Cu 0.810198 0.789949 0.5 169 63.546 3.32069e-05 -3.28319 63.546000 Cu 0.972443 0.796745 0.5 173 63.546 3.40582e-05 -3.28314 63.546000 Cu 0.796812 0.810154 3.48454e-17 190 63.546 3.23383e-05 -3.28315 63.546000 Cu 0.877957 0.81355 0.5 192 63.546 1.58081e-05 -3.28322 63.546000 Cu 0.783362 0.830343 0.5 193 63.546 0.000104109 -3.28291 63.546000 Cu 0.959119 0.816961 1.92678e-16 194 63.546 8.50393e-05 -3.28315 63.546000 Cu 0.0269568 0.84056 5.54426e-18 195 63.546 0.000246638 -3.28338 63.546000 Cu 0.188947 0.847242 1.61857e-17 199 63.546 0.000147942 -3.28283 63.546000 Cu 0.107999 0.843924 0.5 201 63.546 8.50825e-05 -3.28314 63.546000 Cu 0.0136126 0.860778 0.5 220 63.546 0.000672208 -3.28357 63.546000 Cu 0.0947906 0.864191 1.65314e-16 222 63.546 0.000769133 -3.28339 63.546000 Cu 0.162699 0.887852 1 223 63.546 0.00209639 -3.28322 63.546000 Cu 0.175709 0.867517 0.5 224 63.546 0.0001839 -3.28285 63.546000 Cu 0.0816036 0.884415 0.5 225 63.546 0.00236444 -3.28365 63.546000 Cu 0.000119657 0.88091 2.93309e-17 219 63.546 0.000542141 -3.2834 63.546000 Cu 0.269888 0.850568 0.5 203 63.546 0.00031764 -3.28269 63.546000 Cu 0.350986 0.853924 3.48454e-17 204 63.546 0.00020594 -3.28285 63.546000 Cu 0.364539 0.833752 0.5 205 63.546 3.38331e-05 -3.28313 63.546000 Cu 0.445707 0.837152 4.67089e-17 206 63.546 9.08623e-05 -3.28335 63.546000 Cu 0.432255 0.857339 0.5 209 63.546 0.000141502 -3.28328 63.546000 Cu 0.256505 0.8708 8.25975e-17 226 63.546 0.000697988 -3.28242 63.546000 Cu 0.337408 0.874095 0.5 229 63.546 0.00122002 -3.28247 63.546000 Cu 0.418638 0.877468 1.77953e-17 230 63.546 0.000489823 -3.28285 63.546000 Cu 0.50014 0.880917 0.5 232 63.546 0.000569068 -3.28337 63.546000 Cu 0.513574 0.860777 3.48454e-17 207 63.546 0.000669321 -3.28355 63.546000 Cu 0.526868 0.840549 0.5 208 63.546 0.000170854 -3.28339 63.546000 Cu 0.607898 0.843901 1.46923e-16 210 63.546 7.5103e-05 -3.28309 63.546000 Cu 0.675665 0.867478 3.48454e-17 211 63.546 0.000222788 -3.28287 63.546000 Cu 0.688879 0.847212 0.5 212 63.546 0.000194513 -3.28272 63.546000 Cu 0.594747 0.864168 0.5 213 63.546 0.000641481 -3.28338 63.546000 Cu 0.581611 0.884404 2.34379e-16 234 63.546 0.00240049 -3.28367 63.546000 Cu 0.662674 0.887825 0.5 236 63.546 0.00196364 -3.28324 63.546000 Cu 0.864534 0.83374 1 191 63.546 4.65262e-05 -3.28305 63.546000 Cu 0.945757 0.83715 0.5 197 63.546 0.000113934 -3.28327 63.546000 Cu 0.769857 0.850533 3.48454e-17 214 63.546 0.000377273 -3.28258 63.546000 Cu 0.837379 0.874057 1 215 63.546 0.0013536 -3.28254 63.546000 Cu 0.850992 0.853893 0.5 216 63.546 0.000244229 -3.28279 63.546000 Cu 0.756467 0.870756 0.5 217 63.546 0.000901546 -3.28248 63.546000 Cu 0.932276 0.85732 8.42965e-17 218 63.546 0.000117624 -3.28326 63.546000 Cu 0.918611 0.877443 0.5 221 63.546 0.000545398 -3.28291 63.546000 Cu 0.243321 0.891135 0.5 228 63.546 0.000709856 -3.28254 63.546000 Cu 0.0681289 0.904527 2.68419e-16 246 63.546 0.00277572 -3.28271 63.546000 Cu 0.135754 0.92831 1.67222e-17 247 63.546 0.00993393 -3.28255 63.546000 Cu 0.149647 0.908166 0.5 248 63.546 0.00860204 -3.28361 63.546000 Cu 0.0538897 0.924466 0.5 249 63.546 0.00438731 -3.28021 63.546000 Cu 0.230509 0.91162 1 250 63.546 0.00633544 -3.28319 63.546000 Cu 0.217895 0.932049 0.5 253 63.546 0.030952 -3.28376 63.546000 Cu 0.0384999 0.944422 5.14781e-17 270 63.546 0.0385037 -3.27815 63.546000 Cu 0.323938 0.894331 1 227 63.546 0.00312386 -3.2822 63.546000 Cu 0.486419 0.900951 1.40782e-16 231 63.546 0.00126687 -3.28213 63.546000 Cu 0.404908 0.897568 0.5 233 63.546 0.00375802 -3.28206 63.546000 Cu 0.299158 0.935336 3.48454e-17 251 63.546 0.0155026 -3.28172 63.546000 Cu 0.310991 0.914713 0.5 252 63.546 0.00322535 -3.282 63.546000 Cu 0.391586 0.917731 5.96157e-20 254 63.546 0.0109127 -3.28112 63.546000 Cu 0.458704 0.941141 1.42929e-16 255 63.546 0.0503938 -3.28028 63.546000 Cu 0.4726 0.920921 0.5 256 63.546 0.0128694 -3.28029 63.546000 Cu 0.379281 0.938139 0.5 257 63.546 0.0255889 -3.28106 63.546000 Cu 0.649639 0.90815 1.55835e-16 235 63.546 0.00822215 -3.28365 63.546000 Cu 0.568168 0.904529 0.5 237 63.546 0.00274628 -3.2828 63.546000 Cu 0.743267 0.891099 3.60675e-17 238 63.546 0.000708139 -3.28255 63.546000 Cu 0.730457 0.911588 0.5 241 63.546 0.00587174 -3.28319 63.546000 Cu 0.553961 0.924489 2.97482e-17 258 63.546 0.00416218 -3.28027 63.546000 Cu 0.635776 0.928314 0.5 260 63.546 0.0101294 -3.28263 63.546000 Cu 0.717867 0.932031 1.80635e-17 262 63.546 0.0306596 -3.28385 63.546000 Cu 0.810905 0.914671 3.36232e-17 239 63.546 0.00356064 -3.28197 63.546000 Cu 0.823866 0.894296 0.5 240 63.546 0.0033378 -3.28218 63.546000 Cu 0.904833 0.89754 1.89846e-16 242 63.546 0.0039315 -3.28201 63.546000 Cu 0.972504 0.920885 2.37062e-16 243 63.546 0.013579 -3.28019 63.546000 Cu 0.986355 0.900935 0.5 244 63.546 0.0013046 -3.28203 63.546000 Cu 0.891485 0.917689 0.5 245 63.546 0.0117161 -3.28106 63.546000 Cu 0.799089 0.935299 0.5 264 63.546 0.0149573 -3.28172 63.546000 Cu 0.879188 0.938096 1.16638e-16 266 63.546 0.0260232 -3.2811 63.546000 Cu 0.958607 0.9411 0.5 268 63.546 0.0512399 -3.28031 63.546000 Cu 0.104871 0.967661 2.12053e-16 271 63.546 0.111792 -3.2687 63.546000 Cu 0.120416 0.948184 0.5 272 63.546 0.0190457 -3.27955 63.546000 Cu 0.0220714 0.964786 0.5 273 63.546 0.180696 -3.27014 63.546000 Cu 0.204645 0.952054 3.69319e-17 274 63.546 0.0415955 -3.27975 63.546000 Cu 0.19058 0.971339 0.5 277 63.546 0.0270398 -3.28035 63.546000 Cu 0.00838051 0.985698 2.77332e-16 293 63.546 0.378857 -3.2748 63.546000 Cu 0.09088 0.986668 0.5 294 63.546 0.496366 -3.24729 63.546000 Cu 0.178809 0.989912 3.50212e-16 295 63.546 3.83349 -3.16512 63.546000 Cu 0.277682 0.975485 1 275 63.546 0.732937 -3.19873 63.546000 Cu 0.28858 0.956026 0.5 276 63.546 0.140554 -3.27753 63.546000 Cu 0.368705 0.959215 1.85703e-17 278 63.546 0.110559 -3.27363 63.546000 Cu 0.430143 0.984606 1.19082e-16 279 63.546 0.371995 -3.21461 63.546000 Cu 0.444678 0.962232 0.5 280 63.546 0.073711 -3.26043 63.546000 Cu 0.357894 0.981323 0.5 281 63.546 0.800103 -3.16685 63.546000 Cu 0.262834 0.9937 0.5 296 63.546 9.36771 -2.97962 63.546000 Cu 0.620483 0.948199 7.6308e-17 259 63.546 0.0190595 -3.27959 63.546000 Cu 0.538593 0.944455 0.5 261 63.546 0.0375993 -3.27809 63.546000 Cu 0.704686 0.952045 0.5 265 63.546 0.0413969 -3.27986 63.546000 Cu 0.522148 0.964829 6.05099e-18 282 63.546 0.178746 -3.27 63.546000 Cu 0.590983 0.986698 1 283 63.546 0.492685 -3.24713 63.546000 Cu 0.604965 0.967692 0.5 284 63.546 0.110298 -3.26867 63.546000 Cu 0.508439 0.985735 0.5 285 63.546 0.377708 -3.27472 63.546000 Cu 0.690664 0.971351 1.93423e-16 286 63.546 0.0272252 -3.28061 63.546000 Cu 0.678935 0.989942 0.5 289 63.546 3.83937 -3.16557 63.546000 Cu 0.788571 0.955996 7.04061e-17 263 63.546 0.138559 -3.2776 63.546000 Cu 0.944628 0.962186 7.10022e-17 267 63.546 0.0748973 -3.26041 63.546000 Cu 0.868666 0.959174 0.5 269 63.546 0.109872 -3.27357 63.546000 Cu 0.762932 0.9937 3.00463e-17 287 63.546 9.37445 -2.97994 63.546000 Cu 0.777739 0.975477 0.5 288 63.546 0.732071 -3.19924 63.546000 Cu 0.857922 0.981291 8.46542e-17 290 63.546 0.798108 -3.16642 63.546000 Cu 0.930131 0.984569 0.5 291 63.546 0.371163 -3.21442