Number of particles = 592 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.0557 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 87.923 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61654 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 0.0858275 0.00667271 1.20516e-16 304 63.546 0.591362 -3.52278 63.546000 Cu 0.00480055 0.00667654 0.5 305 63.546 0.37528 -3.53186 63.546000 Cu 0.0108994 0.0276751 0 315 63.546 0.212266 -3.52017 63.546000 Cu 0.0915491 0.0267903 0.5 317 63.546 0.413549 -3.49954 63.546000 Cu 0.165014 0.00666232 0.5 306 63.546 6.30879 -3.41472 63.546000 Cu 0.17869 0.0244035 1.86949e-16 319 63.546 4.35152 -3.41552 63.546000 Cu 0.260646 0.0200048 0.5 321 63.546 9.06875 -3.32661 63.546000 Cu 0.337902 0.00666392 1.33586e-16 323 63.546 7.28325 -3.28925 63.546000 Cu 0.42244 0.00666777 0.5 325 63.546 1.20484 -3.48694 63.546000 Cu 0.358665 0.0318677 0.5 326 63.546 0.90664 -3.42499 63.546000 Cu 0.431962 0.0286282 1 324 63.546 0.296121 -3.47772 63.546000 Cu 0.504801 0.00667654 1.53672e-16 327 63.546 0.37528 -3.53186 63.546000 Cu 0.510899 0.0276751 0.5 330 63.546 0.212266 -3.52017 63.546000 Cu 0.665014 0.00666232 2.39832e-19 299 63.546 6.30879 -3.41472 63.546000 Cu 0.67869 0.0244035 0.5 301 63.546 4.35152 -3.41552 63.546000 Cu 0.591549 0.0267903 1.75797e-16 328 63.546 0.413549 -3.49954 63.546000 Cu 0.585828 0.00667271 0.5 329 63.546 0.591362 -3.52278 63.546000 Cu 0.760646 0.0200048 1 300 63.546 9.06875 -3.32661 63.546000 Cu 0.837902 0.00666392 0.5 303 63.546 7.28325 -3.28925 63.546000 Cu 0.92244 0.00666777 1.98461e-17 302 63.546 1.20484 -3.48694 63.546000 Cu 0.858665 0.0318677 8.27421e-17 311 63.546 0.90664 -3.42499 63.546000 Cu 0.931962 0.0286282 0.5 313 63.546 0.296121 -3.47772 63.546000 Cu 0.106653 0.0458197 2.39832e-19 316 63.546 0.0791731 -3.52286 63.546000 Cu 0.023038 0.0485865 0.5 318 63.546 0.196019 -3.51632 63.546000 Cu 0.0392858 0.0687401 5.9958e-20 339 63.546 0.0297538 -3.53689 63.546000 Cu 0.121046 0.0654152 0.5 341 63.546 0.0282973 -3.53236 63.546000 Cu 0.278136 0.0377544 9.43739e-17 320 63.546 0.730137 -3.43953 63.546000 Cu 0.191046 0.0429441 0.5 322 63.546 0.115662 -3.51313 63.546000 Cu 0.205818 0.0617126 1.79874e-19 343 63.546 0.0446726 -3.52602 63.546000 Cu 0.288669 0.0576672 0.5 345 63.546 0.105362 -3.52368 63.546000 Cu 0.369182 0.0538234 9.33546e-17 347 63.546 0.106438 -3.52065 63.546000 Cu 0.445611 0.0509322 0.5 349 63.546 0.0658542 -3.52217 63.546000 Cu 0.523038 0.0485865 2.39832e-19 351 63.546 0.196019 -3.51632 63.546000 Cu 0.539286 0.0687401 0.5 354 63.546 0.0297538 -3.53689 63.546000 Cu 0.691046 0.0429441 1 307 63.546 0.115662 -3.51313 63.546000 Cu 0.705818 0.0617126 0.5 310 63.546 0.0446726 -3.52602 63.546000 Cu 0.621046 0.0654152 1.73878e-17 352 63.546 0.0282973 -3.53236 63.546000 Cu 0.606653 0.0458197 0.5 353 63.546 0.0791731 -3.52286 63.546000 Cu 0.788669 0.0576672 3.46557e-17 308 63.546 0.105362 -3.52368 63.546000 Cu 0.778136 0.0377544 0.5 309 63.546 0.730137 -3.43953 63.546000 Cu 0.945611 0.0509322 1 312 63.546 0.0658542 -3.52217 63.546000 Cu 0.869182 0.0538234 0.5 314 63.546 0.106438 -3.52065 63.546000 Cu 0.136361 0.0850883 2.31438e-17 340 63.546 0.00984541 -3.53839 63.546000 Cu 0.0543884 0.0887906 0.5 342 63.546 0.00407758 -3.53896 63.546000 Cu 0.218469 0.0814878 0.5 346 63.546 0.0185028 -3.5374 63.546000 Cu 0.231388 0.101698 1 369 63.546 0.00487377 -3.53956 63.546000 Cu 0.300138 0.0779976 1 344 63.546 0.0186695 -3.53729 63.546000 Cu 0.380123 0.0748574 0.5 350 63.546 0.0135181 -3.53747 63.546000 Cu 0.312084 0.0984542 0.5 371 63.546 0.00212282 -3.5398 63.546000 Cu 0.39253 0.095418 1 373 63.546 0.00885955 -3.5392 63.546000 Cu 0.459219 0.0720276 1 348 63.546 0.0497427 -3.53504 63.546000 Cu 0.473308 0.0922254 0.5 375 63.546 0.0103827 -3.53916 63.546000 Cu 0.554388 0.0887906 3.46557e-17 377 63.546 0.00407758 -3.53896 63.546000 Cu 0.636361 0.0850883 0.5 379 63.546 0.00984541 -3.53839 63.546000 Cu 0.718469 0.0814878 2.06855e-17 331 63.546 0.0185028 -3.5374 63.546000 Cu 0.812084 0.0984542 6.63136e-17 332 63.546 0.00212282 -3.5398 63.546000 Cu 0.800138 0.0779976 0.5 333 63.546 0.0186695 -3.53729 63.546000 Cu 0.731388 0.101698 0.5 334 63.546 0.00487377 -3.53956 63.546000 Cu 0.880123 0.0748574 2.78805e-17 335 63.546 0.0135181 -3.53747 63.546000 Cu 0.973308 0.0922254 3.46557e-17 336 63.546 0.0103827 -3.53916 63.546000 Cu 0.959219 0.0720276 0.5 337 63.546 0.0497427 -3.53504 63.546000 Cu 0.89253 0.095418 0.5 338 63.546 0.00885955 -3.5392 63.546000 Cu 0.00104608 0.132322 2.26042e-17 362 63.546 0.000324295 -3.53974 63.546000 Cu 0.0687715 0.108745 7.06905e-17 365 63.546 0.00141972 -3.53957 63.546000 Cu 0.0823889 0.128854 0.5 368 63.546 0.0010373 -3.5398 63.546000 Cu 0.163519 0.125397 5.9958e-20 366 63.546 0.00130134 -3.53986 63.546000 Cu 0.150169 0.10517 0.5 367 63.546 0.00403891 -3.5396 63.546000 Cu 0.244344 0.122049 0.5 372 63.546 0.000590763 -3.53994 63.546000 Cu 0.325014 0.118836 1 370 63.546 0.00181539 -3.53979 63.546000 Cu 0.405963 0.115614 0.5 376 63.546 0.00273435 -3.53961 63.546000 Cu 0.419666 0.13574 1.23334e-16 399 63.546 0.000540639 -3.53973 63.546000 Cu 0.487231 0.112286 2.34436e-17 374 63.546 0.00168181 -3.53952 63.546000 Cu 0.501046 0.132322 0.5 401 63.546 0.000324295 -3.53974 63.546000 Cu 0.568772 0.108745 0.5 380 63.546 0.00141972 -3.53957 63.546000 Cu 0.663519 0.125397 0.5 356 63.546 0.00130134 -3.53986 63.546000 Cu 0.650169 0.10517 1.16139e-16 378 63.546 0.00403891 -3.5396 63.546000 Cu 0.582389 0.128854 1.24113e-17 403 63.546 0.0010373 -3.5398 63.546000 Cu 0.744344 0.122049 3.46557e-17 357 63.546 0.000590763 -3.53994 63.546000 Cu 0.825014 0.118836 0.5 359 63.546 0.00181539 -3.53979 63.546000 Cu 0.905963 0.115614 1 361 63.546 0.00273435 -3.53961 63.546000 Cu 0.987231 0.112286 0.5 363 63.546 0.00168181 -3.53952 63.546000 Cu 0.919666 0.13574 0.5 364 63.546 0.000540639 -3.53973 63.546000 Cu 0.0146177 0.152455 0.5 389 63.546 0.000263951 -3.53988 63.546000 Cu 0.0957612 0.149042 7.31488e-18 391 63.546 0.000330128 -3.53993 63.546000 Cu 0.10911 0.169271 0.5 394 63.546 3.558e-05 -3.53996 63.546000 Cu 0.190115 0.165914 3.46557e-17 392 63.546 8.92111e-05 -3.53996 63.546000 Cu 0.176762 0.145672 0.5 393 63.546 0.000171731 -3.53998 63.546000 Cu 0.257612 0.14236 1.19916e-19 395 63.546 0.000396691 -3.53993 63.546000 Cu 0.271121 0.162578 0.5 398 63.546 0.000160177 -3.53991 63.546000 Cu 0.352214 0.159238 3.10583e-17 396 63.546 0.000123563 -3.53985 63.546000 Cu 0.338548 0.139066 0.5 397 63.546 0.00071621 -3.53982 63.546000 Cu 0.514618 0.152455 1.22674e-16 400 63.546 0.000263951 -3.53988 63.546000 Cu 0.433388 0.155862 0.5 402 63.546 8.59608e-05 -3.53986 63.546000 Cu 0.676762 0.145672 0 355 63.546 0.000171731 -3.53998 63.546000 Cu 0.690115 0.165914 0.5 382 63.546 8.92111e-05 -3.53996 63.546000 Cu 0.595761 0.149042 0.5 404 63.546 0.000330128 -3.53993 63.546000 Cu 0.60911 0.169271 5.9958e-20 427 63.546 3.558e-05 -3.53996 63.546000 Cu 0.838548 0.139066 7.2789e-17 358 63.546 0.00071621 -3.53982 63.546000 Cu 0.757612 0.14236 0.5 360 63.546 0.000396691 -3.53993 63.546000 Cu 0.771121 0.162578 1 383 63.546 0.000160177 -3.53991 63.546000 Cu 0.852214 0.159238 0.5 385 63.546 0.000123563 -3.53985 63.546000 Cu 0.933388 0.155862 3.46557e-17 387 63.546 8.59608e-05 -3.53986 63.546000 Cu 0.0280532 0.172642 1.50854e-16 388 63.546 5.74831e-05 -3.53994 63.546000 Cu 0.0414116 0.192836 0.5 413 63.546 1.03432e-05 -3.53994 63.546000 Cu 0.122527 0.189473 1 415 63.546 2.23948e-05 -3.53994 63.546000 Cu 0.217048 0.206292 1 416 63.546 2.37123e-05 -3.53994 63.546000 Cu 0.203584 0.186109 0.5 417 63.546 1.54982e-05 -3.53993 63.546000 Cu 0.284682 0.182754 6.94913e-17 419 63.546 2.79827e-05 -3.53991 63.546000 Cu 0.379213 0.199569 1.03727e-17 420 63.546 1.937e-05 -3.53994 63.546000 Cu 0.365781 0.17939 0.5 421 63.546 4.41805e-05 -3.53991 63.546000 Cu 0.298132 0.202932 0.5 422 63.546 3.25196e-05 -3.53994 63.546000 Cu 0.528053 0.172642 0.5 425 63.546 5.74831e-05 -3.53994 63.546000 Cu 0.446945 0.176022 9.95303e-17 423 63.546 9.27054e-05 -3.53992 63.546000 Cu 0.541412 0.192836 1 424 63.546 1.03432e-05 -3.53994 63.546000 Cu 0.460315 0.196206 0.5 426 63.546 1.56883e-06 -3.53994 63.546000 Cu 0.703584 0.186109 2.97991e-17 381 63.546 1.54982e-05 -3.53993 63.546000 Cu 0.622527 0.189473 0.5 428 63.546 2.23948e-05 -3.53994 63.546000 Cu 0.784682 0.182754 0.5 386 63.546 2.79827e-05 -3.53991 63.546000 Cu 0.717048 0.206292 0.5 406 63.546 2.37123e-05 -3.53994 63.546000 Cu 0.798132 0.202932 0 407 63.546 3.25196e-05 -3.53994 63.546000 Cu 0.865781 0.17939 1 384 63.546 4.41805e-05 -3.53991 63.546000 Cu 0.946945 0.176022 0.5 390 63.546 9.27054e-05 -3.53992 63.546000 Cu 0.879213 0.199569 0.5 409 63.546 1.937e-05 -3.53994 63.546000 Cu 0.960315 0.196206 1 411 63.546 1.56883e-06 -3.53994 63.546000 Cu 0.0548321 0.213018 1.74238e-16 412 63.546 5.49343e-06 -3.53993 63.546000 Cu 0.135943 0.209649 0.5 418 63.546 1.14985e-05 -3.53993 63.546000 Cu 0.0682255 0.233193 0.5 439 63.546 2.61802e-05 -3.53993 63.546000 Cu 0.14933 0.229833 1 441 63.546 2.52303e-05 -3.53994 63.546000 Cu 0.230411 0.226483 0.5 443 63.546 1.09391e-05 -3.53995 63.546000 Cu 0.311458 0.22313 1 445 63.546 1.43998e-05 -3.53995 63.546000 Cu 0.405941 0.239947 1 446 63.546 1.57943e-05 -3.53992 63.546000 Cu 0.392557 0.219769 0.5 447 63.546 3.02673e-05 -3.53994 63.546000 Cu 0.473674 0.216392 1 449 63.546 1.36511e-05 -3.53993 63.546000 Cu 0.554832 0.213018 0.5 451 63.546 5.49343e-06 -3.53993 63.546000 Cu 0.487091 0.236568 0.5 452 63.546 4.8291e-06 -3.53992 63.546000 Cu 0.568225 0.233193 1 450 63.546 2.61802e-05 -3.53993 63.546000 Cu 0.635943 0.209649 6.08574e-17 453 63.546 1.14985e-05 -3.53993 63.546000 Cu 0.64933 0.229833 0.5 454 63.546 2.52303e-05 -3.53994 63.546000 Cu 0.730411 0.226483 1 405 63.546 1.09391e-05 -3.53995 63.546000 Cu 0.811458 0.22313 0.5 410 63.546 1.43998e-05 -3.53995 63.546000 Cu 0.892557 0.219769 5.9958e-20 408 63.546 3.02673e-05 -3.53994 63.546000 Cu 0.973674 0.216392 0.5 414 63.546 1.36511e-05 -3.53993 63.546000 Cu 0.905941 0.239947 0.5 435 63.546 1.57943e-05 -3.53992 63.546000 Cu 0.987091 0.236568 1.19556e-16 437 63.546 4.8291e-06 -3.53992 63.546000 Cu 0.0815564 0.253378 6.24163e-17 438 63.546 1.73141e-05 -3.53995 63.546000 Cu 0.000486788 0.256743 0.5 440 63.546 3.46144e-05 -3.53994 63.546000 Cu 0.0948783 0.273579 0.5 465 63.546 1.89825e-05 -3.53995 63.546000 Cu 0.243701 0.246675 1 442 63.546 3.92183e-05 -3.53994 63.546000 Cu 0.162631 0.250025 0.5 444 63.546 3.5828e-06 -3.53995 63.546000 Cu 0.175949 0.270214 1 467 63.546 5.43441e-05 -3.53994 63.546000 Cu 0.257087 0.26685 0.5 469 63.546 2.20197e-05 -3.53992 63.546000 Cu 0.324817 0.24332 0.5 448 63.546 5.20145e-05 -3.53993 63.546000 Cu 0.33824 0.263481 1 471 63.546 5.75326e-07 -3.53991 63.546000 Cu 0.419381 0.260113 0.5 473 63.546 2.02825e-05 -3.53992 63.546000 Cu 0.500487 0.256743 8.54402e-17 475 63.546 3.46144e-05 -3.53994 63.546000 Cu 0.662631 0.250025 9.58729e-17 429 63.546 3.5828e-06 -3.53995 63.546000 Cu 0.675949 0.270214 0.5 432 63.546 5.43441e-05 -3.53994 63.546000 Cu 0.594878 0.273579 1 476 63.546 1.89825e-05 -3.53995 63.546000 Cu 0.581556 0.253378 0.5 477 63.546 1.73141e-05 -3.53995 63.546000 Cu 0.757087 0.26685 6.23563e-18 430 63.546 2.20197e-05 -3.53992 63.546000 Cu 0.743701 0.246675 0.5 431 63.546 3.92183e-05 -3.53994 63.546000 Cu 0.824817 0.24332 1.19916e-19 433 63.546 5.20145e-05 -3.53993 63.546000 Cu 0.83824 0.263481 0.5 436 63.546 5.75326e-07 -3.53991 63.546000 Cu 0.919381 0.260113 3.32167e-17 434 63.546 2.02825e-05 -3.53992 63.546000 Cu 0.0138261 0.276935 1 463 63.546 3.15826e-06 -3.53996 63.546000 Cu 0.10826 0.293771 1 464 63.546 6.32692e-05 -3.53993 63.546000 Cu 0.0271606 0.297137 0.5 466 63.546 4.73272e-05 -3.53994 63.546000 Cu 0.270538 0.287016 1 468 63.546 6.93734e-06 -3.53991 63.546000 Cu 0.189396 0.290392 0.5 470 63.546 9.63739e-06 -3.53992 63.546000 Cu 0.283988 0.307186 0.5 493 63.546 6.92976e-05 -3.53993 63.546000 Cu 0.351673 0.283647 0.5 474 63.546 4.7475e-05 -3.53992 63.546000 Cu 0.365045 0.303835 3.46557e-17 495 63.546 2.90737e-05 -3.53995 63.546000 Cu 0.432779 0.280292 1.68482e-17 472 63.546 3.929e-05 -3.53994 63.546000 Cu 0.513826 0.276935 0.5 478 63.546 3.15826e-06 -3.53996 63.546000 Cu 0.446078 0.300488 0.5 497 63.546 6.79461e-06 -3.53995 63.546000 Cu 0.527161 0.297137 1.79874e-19 499 63.546 4.73272e-05 -3.53994 63.546000 Cu 0.689396 0.290392 6.17568e-18 455 63.546 9.63739e-06 -3.53992 63.546000 Cu 0.60826 0.293771 0.5 501 63.546 6.32692e-05 -3.53993 63.546000 Cu 0.783988 0.307186 5.9958e-20 456 63.546 6.92976e-05 -3.53993 63.546000 Cu 0.770538 0.287016 0.5 457 63.546 6.93734e-06 -3.53991 63.546000 Cu 0.851673 0.283647 3.46557e-17 459 63.546 4.7475e-05 -3.53992 63.546000 Cu 0.946078 0.300488 5.00649e-17 460 63.546 6.79461e-06 -3.53995 63.546000 Cu 0.932779 0.280292 0.5 461 63.546 3.929e-05 -3.53994 63.546000 Cu 0.865045 0.303835 0.5 462 63.546 2.90737e-05 -3.53995 63.546000 Cu 0.040508 0.317312 0 487 63.546 6.84338e-05 -3.53991 63.546000 Cu 0.135129 0.334076 1.79874e-19 488 63.546 5.44641e-05 -3.53988 63.546000 Cu 0.121702 0.313931 0.5 489 63.546 1.15764e-05 -3.53989 63.546000 Cu 0.0539342 0.337469 0.5 490 63.546 4.451e-05 -3.5399 63.546000 Cu 0.202879 0.310558 0 491 63.546 3.29905e-05 -3.5399 63.546000 Cu 0.216308 0.33071 0.5 494 63.546 0.000155701 -3.53991 63.546000 Cu 0.297389 0.327378 1 492 63.546 7.7312e-05 -3.53995 63.546000 Cu 0.378375 0.32404 0.5 498 63.546 1.11782e-05 -3.53997 63.546000 Cu 0.391705 0.344254 7.10502e-17 521 63.546 0.000148149 -3.53996 63.546000 Cu 0.459397 0.320684 2.2826e-16 496 63.546 7.19469e-05 -3.53995 63.546000 Cu 0.540508 0.317312 0.5 502 63.546 6.84338e-05 -3.53991 63.546000 Cu 0.472791 0.340874 0.5 523 63.546 0.000131474 -3.53993 63.546000 Cu 0.553934 0.337469 1.19916e-19 525 63.546 4.451e-05 -3.5399 63.546000 Cu 0.702879 0.310558 0.5 458 63.546 3.29905e-05 -3.5399 63.546000 Cu 0.621702 0.313931 4.83262e-17 500 63.546 1.15764e-05 -3.53989 63.546000 Cu 0.635129 0.334076 0.5 527 63.546 5.44641e-05 -3.53988 63.546000 Cu 0.716308 0.33071 3.90926e-17 479 63.546 0.000155701 -3.53991 63.546000 Cu 0.797389 0.327378 0.5 481 63.546 7.7312e-05 -3.53995 63.546000 Cu 0.878375 0.32404 3.46557e-17 483 63.546 1.11782e-05 -3.53997 63.546000 Cu 0.972791 0.340874 1 484 63.546 0.000131474 -3.53993 63.546000 Cu 0.959397 0.320684 0.5 485 63.546 7.19469e-05 -3.53995 63.546000 Cu 0.891705 0.344254 0.5 486 63.546 0.000148149 -3.53996 63.546000 Cu 0.0674749 0.357617 1.43899e-17 513 63.546 7.46219e-05 -3.53986 63.546000 Cu 0.0810787 0.377733 0.5 516 63.546 0.000717256 -3.53976 63.546000 Cu 0.162159 0.374414 1 514 63.546 0.00066876 -3.53988 63.546000 Cu 0.148628 0.354223 0.5 515 63.546 0.000339428 -3.53989 63.546000 Cu 0.229661 0.350898 1.1392e-18 517 63.546 0.000169768 -3.53994 63.546000 Cu 0.243017 0.371125 0.5 520 63.546 0.000178168 -3.53996 63.546000 Cu 0.323878 0.367815 5.9958e-20 518 63.546 0.000284995 -3.53997 63.546000 Cu 0.310664 0.347585 0.5 519 63.546 2.31234e-05 -3.53997 63.546000 Cu 0.404956 0.364449 0.5 524 63.546 0.0004407 -3.53989 63.546000 Cu 0.486209 0.361034 5.9958e-20 522 63.546 0.000192271 -3.53984 63.546000 Cu 0.567475 0.357617 0.5 528 63.546 7.46219e-05 -3.53986 63.546000 Cu 0.662159 0.374414 0.5 504 63.546 0.00066876 -3.53988 63.546000 Cu 0.648628 0.354223 1 526 63.546 0.000339428 -3.53989 63.546000 Cu 0.581079 0.377733 7.78255e-17 551 63.546 0.000717256 -3.53976 63.546000 Cu 0.810664 0.347585 5.9958e-20 480 63.546 2.31234e-05 -3.53997 63.546000 Cu 0.729661 0.350898 0.5 482 63.546 0.000169768 -3.53994 63.546000 Cu 0.743017 0.371125 2.57819e-18 505 63.546 0.000178168 -3.53996 63.546000 Cu 0.823878 0.367815 0.5 507 63.546 0.000284995 -3.53997 63.546000 Cu 0.904956 0.364449 1.10143e-16 509 63.546 0.0004407 -3.53989 63.546000 Cu 0.986209 0.361034 0.5 511 63.546 0.000192271 -3.53984 63.546000 Cu 0.013353 0.401166 0.5 537 63.546 0.00195202 -3.53954 63.546000 Cu 0.0946032 0.39786 1 539 63.546 0.0024466 -3.53965 63.546000 Cu 0.17555 0.39465 0.5 541 63.546 0.00126521 -3.53984 63.546000 Cu 0.256261 0.391425 3.46557e-17 543 63.546 0.000631128 -3.53996 63.546000 Cu 0.269234 0.411744 0.5 546 63.546 0.00441273 -3.53956 63.546000 Cu 0.350487 0.40827 6.2836e-17 544 63.546 0.00345007 -3.53963 63.546000 Cu 0.337085 0.388061 0.5 545 63.546 0.00136083 -3.53987 63.546000 Cu 0.418272 0.384601 4.19706e-19 547 63.546 0.000890882 -3.53976 63.546000 Cu 0.513353 0.401166 1 548 63.546 0.00195202 -3.53954 63.546000 Cu 0.499685 0.381137 0.5 549 63.546 0.000212521 -3.5397 63.546000 Cu 0.431859 0.404687 0.5 550 63.546 0.00111387 -3.53959 63.546000 Cu 0.67555 0.39465 1 503 63.546 0.00126521 -3.53984 63.546000 Cu 0.594603 0.39786 0.5 552 63.546 0.0024466 -3.53965 63.546000 Cu 0.837085 0.388061 9.95303e-18 506 63.546 0.00136083 -3.53987 63.546000 Cu 0.756261 0.391425 0.5 508 63.546 0.000631128 -3.53996 63.546000 Cu 0.769234 0.411744 7.43479e-17 531 63.546 0.00441273 -3.53956 63.546000 Cu 0.850487 0.40827 0.5 533 63.546 0.00345007 -3.53963 63.546000 Cu 0.999685 0.381137 3.46557e-17 510 63.546 0.000212521 -3.5397 63.546000 Cu 0.918272 0.384601 0.5 512 63.546 0.000890882 -3.53976 63.546000 Cu 0.931859 0.404687 5.21635e-18 535 63.546 0.00111387 -3.53959 63.546000 Cu 0.0271678 0.421236 2.39832e-17 536 63.546 0.00994837 -3.53921 63.546000 Cu 0.107882 0.418054 0.5 542 63.546 0.00745695 -3.53925 63.546000 Cu 0.041196 0.441441 0.5 561 63.546 0.0473003 -3.53509 63.546000 Cu 0.12027 0.438603 4.19706e-19 563 63.546 0.0139337 -3.53751 63.546000 Cu 0.188415 0.415016 0 540 63.546 0.00233563 -3.53984 63.546000 Cu 0.200347 0.435432 0.5 565 63.546 0.0185134 -3.53723 63.546000 Cu 0.282166 0.431924 8.13031e-17 567 63.546 0.0163046 -3.53732 63.546000 Cu 0.364297 0.428348 0.5 569 63.546 0.00922928 -3.53848 63.546000 Cu 0.379512 0.448036 4.19706e-19 568 63.546 0.0295451 -3.5324 63.546000 Cu 0.446174 0.424656 3.10583e-17 571 63.546 0.00423728 -3.53906 63.546000 Cu 0.541196 0.441441 1.82752e-16 572 63.546 0.0473003 -3.53509 63.546000 Cu 0.527168 0.421236 0.5 573 63.546 0.00994837 -3.53921 63.546000 Cu 0.46119 0.444732 0.5 574 63.546 0.0286321 -3.537 63.546000 Cu 0.700347 0.435432 1 529 63.546 0.0185134 -3.53723 63.546000 Cu 0.688415 0.415016 0.5 530 63.546 0.00233563 -3.53984 63.546000 Cu 0.607882 0.418054 1 575 63.546 0.00745695 -3.53925 63.546000 Cu 0.62027 0.438603 0.5 576 63.546 0.0139337 -3.53751 63.546000 Cu 0.782166 0.431924 0.5 534 63.546 0.0163046 -3.53732 63.546000 Cu 0.864297 0.428348 1.19916e-19 532 63.546 0.00922928 -3.53848 63.546000 Cu 0.946174 0.424656 0.5 538 63.546 0.00423728 -3.53906 63.546000 Cu 0.96119 0.444732 1 559 63.546 0.0286321 -3.537 63.546000 Cu 0.879512 0.448036 0.5 557 63.546 0.0295451 -3.5324 63.546000 Cu 0.0548047 0.462531 1.97861e-17 560 63.546 0.0653657 -3.52229 63.546000 Cu 0.131232 0.45961 0.5 566 63.546 0.10865 -3.52034 63.546000 Cu 0.141716 0.481563 1 583 63.546 0.905807 -3.42368 63.546000 Cu 0.211812 0.455733 7.17697e-17 564 63.546 0.102893 -3.52311 63.546000 Cu 0.222308 0.475636 0.5 585 63.546 0.727199 -3.4385 63.546000 Cu 0.294752 0.451691 0.5 570 63.546 0.042832 -3.52596 63.546000 Cu 0.309362 0.470463 1 587 63.546 0.118628 -3.51312 63.546000 Cu 0.393776 0.467638 0.5 589 63.546 0.0782708 -3.52272 63.546000 Cu 0.554805 0.462531 0.5 298 63.546 0.0653657 -3.52229 63.546000 Cu 0.477411 0.464894 2.09853e-17 591 63.546 0.194516 -3.51662 63.546000 Cu 0.641716 0.481563 0.5 6 63.546 0.905807 -3.42368 63.546000 Cu 0.631232 0.45961 2.39832e-19 15 63.546 0.10865 -3.52034 63.546000 Cu 0.711812 0.455733 0.5 554 63.546 0.102893 -3.52311 63.546000 Cu 0.722308 0.475636 9.12561e-17 553 63.546 0.727199 -3.4385 63.546000 Cu 0.794752 0.451691 1 555 63.546 0.042832 -3.52596 63.546000 Cu 0.809362 0.470463 0.5 558 63.546 0.118628 -3.51312 63.546000 Cu 0.893776 0.467638 1.18597e-16 556 63.546 0.0782708 -3.52272 63.546000 Cu 0.977411 0.464894 0.5 562 63.546 0.194516 -3.51662 63.546000 Cu 0.0777975 0.506773 1.01329e-16 3 63.546 1.21338 -3.48716 63.546000 Cu 0.0684137 0.48483 0.5 582 63.546 0.299329 -3.4786 63.546000 Cu 0.239611 0.493382 1 584 63.546 9.06829 -3.32584 63.546000 Cu 0.162362 0.506752 0.5 586 63.546 7.30732 -3.29014 63.546000 Cu 0.335147 0.506752 3.95723e-18 8 63.546 6.31976 -3.41413 63.546000 Cu 0.414332 0.506756 0.5 10 63.546 0.59055 -3.52252 63.546000 Cu 0.408796 0.486671 1.26391e-16 588 63.546 0.409563 -3.49941 63.546000 Cu 0.321626 0.489013 0.5 590 63.546 4.33323 -3.41537 63.546000 Cu 0.495467 0.506775 1.06126e-16 11 63.546 0.383999 -3.53187 63.546000 Cu 0.489508 0.485794 0.5 293 63.546 0.216996 -3.52065 63.546000 Cu 0.568414 0.48483 2.21185e-16 592 63.546 0.299329 -3.4786 63.546000 Cu 0.577798 0.506773 0.5 13 63.546 1.21338 -3.48716 63.546000 Cu 0.662362 0.506752 1 577 63.546 7.30732 -3.29014 63.546000 Cu 0.835147 0.506752 0.5 2 63.546 6.31976 -3.41413 63.546000 Cu 0.739611 0.493382 0.5 578 63.546 9.06829 -3.32584 63.546000 Cu 0.821626 0.489013 9.62926e-17 579 63.546 4.33323 -3.41537 63.546000 Cu 0.914332 0.506756 3.46557e-17 1 63.546 0.59055 -3.52252 63.546000 Cu 0.995467 0.506775 0.5 4 63.546 0.383999 -3.53187 63.546000 Cu 0.908796 0.486671 0.5 580 63.546 0.409563 -3.49941 63.546000 Cu 0.989508 0.485794 5.52213e-17 581 63.546 0.216996 -3.52065 63.546000 Cu 0.0546256 0.551009 1.82572e-16 24 63.546 0.0651235 -3.52263 63.546000 Cu 0.0682722 0.528741 0.5 25 63.546 0.29126 -3.47819 63.546000 Cu 0.141576 0.531952 7.96842e-17 27 63.546 0.914181 -3.42378 63.546000 Cu 0.239511 0.520132 1.7202e-16 5 63.546 9.076 -3.32674 63.546000 Cu 0.222115 0.537861 0.5 29 63.546 0.735843 -3.43898 63.546000 Cu 0.321544 0.524489 0.5 7 63.546 4.33367 -3.41523 63.546000 Cu 0.408692 0.526851 2.39832e-19 9 63.546 0.409239 -3.49918 63.546000 Cu 0.309203 0.543027 3.90926e-17 31 63.546 0.115672 -3.51283 63.546000 Cu 0.393614 0.545876 0.5 34 63.546 0.0786887 -3.52265 63.546000 Cu 0.568272 0.528741 1 12 63.546 0.29126 -3.47819 63.546000 Cu 0.489333 0.527743 0.5 14 63.546 0.211715 -3.52058 63.546000 Cu 0.477218 0.54863 1.34186e-16 35 63.546 0.192345 -3.51669 63.546000 Cu 0.554626 0.551009 0.5 37 63.546 0.0651235 -3.52263 63.546000 Cu 0.641576 0.531952 0.5 18 63.546 0.914181 -3.42378 63.546000 Cu 0.739511 0.520132 0.5 17 63.546 9.076 -3.32674 63.546000 Cu 0.722115 0.537861 1 16 63.546 0.735843 -3.43898 63.546000 Cu 0.821544 0.524489 2.17648e-17 19 63.546 4.33367 -3.41523 63.546000 Cu 0.809203 0.543027 0.5 22 63.546 0.115672 -3.51283 63.546000 Cu 0.893614 0.545876 2.69211e-17 20 63.546 0.0786887 -3.52265 63.546000 Cu 0.908692 0.526851 0.5 21 63.546 0.409239 -3.49918 63.546000 Cu 0.989333 0.527743 3.62146e-17 23 63.546 0.211715 -3.52058 63.546000 Cu 0.977218 0.54863 0.5 26 63.546 0.192345 -3.51669 63.546000 Cu 0.13106 0.553912 0.5 30 63.546 0.107057 -3.52071 63.546000 Cu 0.0410279 0.572083 0.5 49 63.546 0.0495653 -3.53516 63.546000 Cu 0.120133 0.574919 2.5662e-17 51 63.546 0.0135908 -3.53753 63.546000 Cu 0.211601 0.557763 1 28 63.546 0.104816 -3.52361 63.546000 Cu 0.200158 0.57807 0.5 53 63.546 0.0177689 -3.53735 63.546000 Cu 0.281857 0.581539 4.19706e-19 55 63.546 0.018398 -3.53747 63.546000 Cu 0.294489 0.561782 0.5 32 63.546 0.0439286 -3.52599 63.546000 Cu 0.379253 0.565466 1.20576e-16 33 63.546 0.0286909 -3.53222 63.546000 Cu 0.363957 0.585122 0.5 58 63.546 0.0102517 -3.53838 63.546000 Cu 0.541028 0.572083 3.46557e-17 36 63.546 0.0495653 -3.53516 63.546000 Cu 0.460972 0.568777 0.5 38 63.546 0.028939 -3.53693 63.546000 Cu 0.63106 0.553912 1.73878e-18 39 63.546 0.107057 -3.52071 63.546000 Cu 0.700158 0.57807 4.81463e-17 40 63.546 0.0177689 -3.53735 63.546000 Cu 0.711601 0.557763 0.5 41 63.546 0.104816 -3.52361 63.546000 Cu 0.620133 0.574919 0.5 42 63.546 0.0135908 -3.53753 63.546000 Cu 0.794489 0.561782 1 43 63.546 0.0439286 -3.52599 63.546000 Cu 0.781857 0.581539 0.5 46 63.546 0.018398 -3.53747 63.546000 Cu 0.863957 0.585122 3.46557e-17 44 63.546 0.0102517 -3.53838 63.546000 Cu 0.879253 0.565466 0.5 45 63.546 0.0286909 -3.53222 63.546000 Cu 0.960972 0.568777 1.65484e-17 47 63.546 0.028939 -3.53693 63.546000 Cu 0.0269958 0.592261 1 48 63.546 0.0104884 -3.53915 63.546000 Cu 0.107762 0.595457 0.5 54 63.546 0.00834756 -3.53924 63.546000 Cu 0.0131963 0.612301 0.5 73 63.546 0.00171841 -3.53949 63.546000 Cu 0.094481 0.61563 1.96123e-16 75 63.546 0.0025932 -3.53962 63.546000 Cu 0.188272 0.598503 1 52 63.546 0.00177414 -3.53985 63.546000 Cu 0.269053 0.601741 0.5 56 63.546 0.00425727 -3.5396 63.546000 Cu 0.175486 0.618856 0.5 77 63.546 0.00181158 -3.53984 63.546000 Cu 0.350281 0.605186 1 57 63.546 0.00422575 -3.5396 63.546000 Cu 0.431662 0.608753 0.5 62 63.546 0.00149324 -3.53952 63.546000 Cu 0.445929 0.588815 1.91266e-17 59 63.546 0.00394926 -3.53892 63.546000 Cu 0.513196 0.612301 8.83182e-17 60 63.546 0.00171841 -3.53949 63.546000 Cu 0.526996 0.592261 0.5 61 63.546 0.0104884 -3.53915 63.546000 Cu 0.607762 0.595457 1 63 63.546 0.00834756 -3.53924 63.546000 Cu 0.675486 0.618856 0 64 63.546 0.00181158 -3.53984 63.546000 Cu 0.688272 0.598503 0.5 65 63.546 0.00177414 -3.53985 63.546000 Cu 0.594481 0.61563 0.5 66 63.546 0.0025932 -3.53962 63.546000 Cu 0.769053 0.601741 2.03857e-17 67 63.546 0.00425727 -3.5396 63.546000 Cu 0.850281 0.605186 0.5 69 63.546 0.00422575 -3.5396 63.546000 Cu 0.945929 0.588815 0.5 50 63.546 0.00394926 -3.53892 63.546000 Cu 0.931662 0.608753 3.46557e-17 71 63.546 0.00149324 -3.53952 63.546000 Cu 0.0809012 0.635736 0.5 78 63.546 0.000537696 -3.53971 63.546000 Cu 0.162083 0.639057 4.83262e-17 76 63.546 0.000750023 -3.53982 63.546000 Cu 0.25625 0.622067 2.78205e-17 79 63.546 0.000560188 -3.53997 63.546000 Cu 0.243052 0.642353 0.5 81 63.546 0.000422866 -3.53994 63.546000 Cu 0.323914 0.645656 1.52233e-16 80 63.546 0.000166888 -3.53998 63.546000 Cu 0.33707 0.625399 0.5 82 63.546 0.00125422 -3.53988 63.546000 Cu 0.418185 0.628845 4.92255e-17 83 63.546 0.00105648 -3.53978 63.546000 Cu 0.404847 0.649021 0.5 86 63.546 0.0004195 -3.53993 63.546000 Cu 0.486 0.652425 2.68612e-16 84 63.546 0.00030674 -3.53986 63.546000 Cu 0.499515 0.632318 0.5 85 63.546 0.000275327 -3.5397 63.546000 Cu 0.580901 0.635736 1 87 63.546 0.000537696 -3.53971 63.546000 Cu 0.662083 0.639057 0.5 89 63.546 0.000750023 -3.53982 63.546000 Cu 0.83707 0.625399 5.93584e-18 68 63.546 0.00125422 -3.53988 63.546000 Cu 0.75625 0.622067 0.5 70 63.546 0.000560188 -3.53997 63.546000 Cu 0.743052 0.642353 8.47207e-17 91 63.546 0.000422866 -3.53994 63.546000 Cu 0.823914 0.645656 0.5 93 63.546 0.000166888 -3.53998 63.546000 Cu 0.999515 0.632318 8.568e-17 72 63.546 0.000275327 -3.5397 63.546000 Cu 0.918185 0.628845 0.5 74 63.546 0.00105648 -3.53978 63.546000 Cu 0.904847 0.649021 8.47806e-17 95 63.546 0.0004195 -3.53993 63.546000 Cu 0.986 0.652425 0.5 97 63.546 0.00030674 -3.53986 63.546000 Cu 0.067266 0.655826 1 99 63.546 7.85687e-05 -3.53981 63.546000 Cu 0.134972 0.679339 5.51614e-17 100 63.546 5.52805e-05 -3.53989 63.546000 Cu 0.0538114 0.675955 0.5 102 63.546 0.000107729 -3.53989 63.546000 Cu 0.148506 0.659205 0.5 101 63.546 0.000151473 -3.53984 63.546000 Cu 0.229601 0.662554 3.83731e-18 103 63.546 0.00019694 -3.53991 63.546000 Cu 0.216059 0.682723 0.5 106 63.546 3.17027e-05 -3.53991 63.546000 Cu 0.297127 0.686082 6.16968e-17 104 63.546 5.24112e-05 -3.53991 63.546000 Cu 0.310558 0.665896 0.5 105 63.546 9.89259e-05 -3.53996 63.546000 Cu 0.391549 0.669236 5.07844e-17 107 63.546 5.712e-05 -3.53996 63.546000 Cu 0.378203 0.689427 0.5 110 63.546 5.64912e-05 -3.53992 63.546000 Cu 0.567266 0.655826 0.5 90 63.546 7.85687e-05 -3.53981 63.546000 Cu 0.472617 0.672584 0.5 109 63.546 0.00012185 -3.53992 63.546000 Cu 0.553811 0.675955 1.52173e-16 111 63.546 0.000107729 -3.53989 63.546000 Cu 0.648506 0.659205 1.86649e-16 88 63.546 0.000151473 -3.53984 63.546000 Cu 0.634972 0.679339 0.5 113 63.546 5.52805e-05 -3.53989 63.546000 Cu 0.716059 0.682723 8.34016e-17 115 63.546 3.17027e-05 -3.53991 63.546000 Cu 0.810558 0.665896 5.9958e-20 92 63.546 9.89259e-05 -3.53996 63.546000 Cu 0.729601 0.662554 0.5 94 63.546 0.00019694 -3.53991 63.546000 Cu 0.797127 0.686082 0.5 117 63.546 5.24112e-05 -3.53991 63.546000 Cu 0.972617 0.672584 3.39962e-17 96 63.546 0.00012185 -3.53992 63.546000 Cu 0.891549 0.669236 0.5 98 63.546 5.712e-05 -3.53996 63.546000 Cu 0.878203 0.689427 5.9958e-20 119 63.546 5.64912e-05 -3.53992 63.546000 Cu 0.0403753 0.696128 0 123 63.546 8.31496e-05 -3.53994 63.546000 Cu 0.107838 0.719695 7.68662e-17 124 63.546 1.87623e-05 -3.53992 63.546000 Cu 0.121436 0.699509 0.5 125 63.546 1.65903e-05 -3.53993 63.546000 Cu 0.0267895 0.716317 0.5 126 63.546 1.55979e-05 -3.53992 63.546000 Cu 0.2025 0.702891 3.39962e-17 127 63.546 1.41185e-05 -3.53991 63.546000 Cu 0.283611 0.706249 0.5 129 63.546 1.5926e-05 -3.5399 63.546000 Cu 0.18895 0.723065 0.5 130 63.546 1.14359e-05 -3.53991 63.546000 Cu 0.364708 0.709595 1.19916e-19 131 63.546 5.88252e-05 -3.53989 63.546000 Cu 0.459324 0.692765 5.9958e-20 108 63.546 0.000151817 -3.53993 63.546000 Cu 0.540375 0.696128 0.5 114 63.546 8.31496e-05 -3.53994 63.546000 Cu 0.44575 0.712947 0.5 133 63.546 3.93555e-05 -3.53991 63.546000 Cu 0.52679 0.716317 3.59748e-19 135 63.546 1.55979e-05 -3.53992 63.546000 Cu 0.621436 0.699509 1 112 63.546 1.65903e-05 -3.53993 63.546000 Cu 0.7025 0.702891 0.5 118 63.546 1.41185e-05 -3.53991 63.546000 Cu 0.607838 0.719695 0.5 137 63.546 1.87623e-05 -3.53992 63.546000 Cu 0.68895 0.723065 1 139 63.546 1.14359e-05 -3.53991 63.546000 Cu 0.783611 0.706249 2.9979e-19 116 63.546 1.5926e-05 -3.5399 63.546000 Cu 0.94575 0.712947 2.9979e-19 120 63.546 3.93555e-05 -3.53991 63.546000 Cu 0.959324 0.692765 0.5 121 63.546 0.000151817 -3.53993 63.546000 Cu 0.864708 0.709595 0.5 122 63.546 5.88252e-05 -3.53989 63.546000 Cu 0.0131135 0.736491 1.21955e-16 147 63.546 5.368e-05 -3.5399 63.546000 Cu 0.0942416 0.739861 0.5 149 63.546 3.24158e-06 -3.53989 63.546000 Cu 0.270029 0.726425 1 128 63.546 1.13138e-05 -3.53991 63.546000 Cu 0.175353 0.743236 5.9958e-19 151 63.546 8.34505e-06 -3.5399 63.546000 Cu 0.256433 0.746605 0.5 153 63.546 1.44814e-05 -3.53991 63.546000 Cu 0.351062 0.729777 0.5 134 63.546 5.6267e-06 -3.53991 63.546000 Cu 0.337458 0.749966 4.19706e-19 156 63.546 2.25188e-05 -3.53992 63.546000 Cu 0.418502 0.753314 0.5 158 63.546 1.87986e-05 -3.53992 63.546000 Cu 0.432069 0.733131 1.37244e-16 132 63.546 3.35325e-05 -3.53991 63.546000 Cu 0.513113 0.736491 0.5 138 63.546 5.368e-05 -3.5399 63.546000 Cu 0.499575 0.756665 2.60398e-16 159 63.546 2.00943e-05 -3.53992 63.546000 Cu 0.594242 0.739861 3.59748e-19 136 63.546 3.24158e-06 -3.53989 63.546000 Cu 0.675353 0.743236 0.5 142 63.546 8.34505e-06 -3.5399 63.546000 Cu 0.756433 0.746605 3.46557e-17 140 63.546 1.44814e-05 -3.53991 63.546000 Cu 0.770029 0.726425 0.5 141 63.546 1.13138e-05 -3.53991 63.546000 Cu 0.851062 0.729777 1.79874e-19 143 63.546 5.6267e-06 -3.53991 63.546000 Cu 0.837458 0.749966 0.5 146 63.546 2.25188e-05 -3.53992 63.546000 Cu 0.918502 0.753314 3.78335e-17 144 63.546 1.87986e-05 -3.53992 63.546000 Cu 0.932069 0.733131 0.5 145 63.546 3.35325e-05 -3.53991 63.546000 Cu 0.999575 0.756665 0.5 150 63.546 2.00943e-05 -3.53992 63.546000 Cu 0.0806495 0.760025 2.18247e-17 148 63.546 3.78696e-05 -3.53991 63.546000 Cu 0.0671154 0.780211 0.5 173 63.546 1.00771e-05 -3.53993 63.546000 Cu 0.14816 0.783571 0 175 63.546 3.36527e-05 -3.53992 63.546000 Cu 0.242815 0.766779 1 152 63.546 1.94039e-05 -3.53991 63.546000 Cu 0.161739 0.763401 0.5 154 63.546 5.90543e-06 -3.53991 63.546000 Cu 0.229269 0.786942 0.5 177 63.546 3.70609e-06 -3.5399 63.546000 Cu 0.323925 0.770144 0.5 155 63.546 1.68348e-05 -3.53991 63.546000 Cu 0.405016 0.773502 3.19576e-17 157 63.546 1.03929e-05 -3.53993 63.546000 Cu 0.310386 0.790316 6.7153e-18 179 63.546 8.22469e-06 -3.53991 63.546000 Cu 0.567115 0.780211 1.17338e-16 160 63.546 1.00771e-05 -3.53993 63.546000 Cu 0.48608 0.776852 0.5 162 63.546 5.97817e-06 -3.53993 63.546000 Cu 0.580649 0.760025 0.5 161 63.546 3.78696e-05 -3.53991 63.546000 Cu 0.661739 0.763401 1.8515e-16 163 63.546 5.90543e-06 -3.53991 63.546000 Cu 0.64816 0.783571 0.5 166 63.546 3.36527e-05 -3.53992 63.546000 Cu 0.729269 0.786942 1 164 63.546 3.70609e-06 -3.5399 63.546000 Cu 0.742815 0.766779 0.5 165 63.546 1.94039e-05 -3.53991 63.546000 Cu 0.823925 0.770144 3.46557e-17 167 63.546 1.68348e-05 -3.53991 63.546000 Cu 0.810386 0.790316 0.5 170 63.546 8.22469e-06 -3.53991 63.546000 Cu 0.905016 0.773502 0.5 169 63.546 1.03929e-05 -3.53993 63.546000 Cu 0.98608 0.776852 1.4318e-16 171 63.546 5.97817e-06 -3.53993 63.546000 Cu 0.0536146 0.800398 1.11762e-16 172 63.546 1.65897e-06 -3.53993 63.546000 Cu 0.134679 0.803748 0.5 178 63.546 1.38992e-05 -3.53993 63.546000 Cu 0.0401464 0.820584 0.5 197 63.546 2.04786e-05 -3.53994 63.546000 Cu 0.121173 0.823938 1.31908e-17 199 63.546 1.94136e-05 -3.53995 63.546000 Cu 0.215739 0.807105 3.46557e-17 176 63.546 2.70365e-05 -3.53991 63.546000 Cu 0.202192 0.827283 0.5 201 63.546 7.81214e-05 -3.53993 63.546000 Cu 0.296814 0.810478 0.5 180 63.546 7.28939e-06 -3.5399 63.546000 Cu 0.377924 0.813853 5.86389e-17 181 63.546 1.86422e-05 -3.5399 63.546000 Cu 0.391491 0.793686 0.5 182 63.546 2.71386e-05 -3.53992 63.546000 Cu 0.472553 0.797048 1.09543e-16 183 63.546 2.20952e-05 -3.53993 63.546000 Cu 0.540146 0.820584 3.23773e-17 184 63.546 2.04786e-05 -3.53994 63.546000 Cu 0.553615 0.800398 0.5 185 63.546 1.65897e-06 -3.53993 63.546000 Cu 0.459055 0.817224 0.5 186 63.546 3.38556e-05 -3.53992 63.546000 Cu 0.634679 0.803748 9.10163e-17 187 63.546 1.38992e-05 -3.53993 63.546000 Cu 0.621173 0.823938 0.5 190 63.546 1.94136e-05 -3.53995 63.546000 Cu 0.702192 0.827283 7.147e-17 188 63.546 7.81214e-05 -3.53993 63.546000 Cu 0.715739 0.807105 0.5 189 63.546 2.70365e-05 -3.53991 63.546000 Cu 0.796814 0.810478 3.46557e-17 191 63.546 7.28939e-06 -3.5399 63.546000 Cu 0.891491 0.793686 3.46557e-17 168 63.546 2.71386e-05 -3.53992 63.546000 Cu 0.972553 0.797048 0.5 174 63.546 2.20952e-05 -3.53993 63.546000 Cu 0.877924 0.813853 0.5 193 63.546 1.86422e-05 -3.5399 63.546000 Cu 0.959055 0.817224 0 195 63.546 3.38556e-05 -3.53992 63.546000 Cu 0.0266837 0.840775 5.70201e-17 196 63.546 0.000117394 -3.53993 63.546000 Cu 0.107766 0.844144 0.5 202 63.546 8.69244e-05 -3.53996 63.546000 Cu 0.0133008 0.86094 0.5 221 63.546 0.000255045 -3.53985 63.546000 Cu 0.188778 0.847487 5.9958e-20 200 63.546 7.53119e-05 -3.53996 63.546000 Cu 0.283256 0.830634 1 203 63.546 8.06662e-05 -3.53989 63.546000 Cu 0.269783 0.850808 0.5 204 63.546 0.000203748 -3.53992 63.546000 Cu 0.350831 0.854147 1 205 63.546 0.000223087 -3.53987 63.546000 Cu 0.364396 0.834 0.5 206 63.546 1.96152e-05 -3.53988 63.546000 Cu 0.432036 0.857526 0.5 210 63.546 7.42138e-05 -3.53984 63.546000 Cu 0.445557 0.837386 3.46557e-17 207 63.546 4.04019e-05 -3.5399 63.546000 Cu 0.513301 0.86094 1.41861e-16 208 63.546 0.000255045 -3.53985 63.546000 Cu 0.526684 0.840775 0.5 209 63.546 0.000117394 -3.53993 63.546000 Cu 0.607766 0.844144 1.51634e-16 211 63.546 8.69244e-05 -3.53996 63.546000 Cu 0.688778 0.847487 0.5 213 63.546 7.53119e-05 -3.53996 63.546000 Cu 0.783256 0.830634 0.5 194 63.546 8.06662e-05 -3.53989 63.546000 Cu 0.769783 0.850808 1 215 63.546 0.000203748 -3.53992 63.546000 Cu 0.850831 0.854147 0.5 217 63.546 0.000223087 -3.53987 63.546000 Cu 0.864396 0.834 1.25912e-17 192 63.546 1.96152e-05 -3.53988 63.546000 Cu 0.945557 0.837386 0.5 198 63.546 4.04019e-05 -3.5399 63.546000 Cu 0.932036 0.857526 5.60008e-17 219 63.546 7.42138e-05 -3.53984 63.546000 Cu 0.0945143 0.864344 5.25832e-17 223 63.546 0.00037856 -3.5399 63.546000 Cu 0.081251 0.884507 0.5 226 63.546 0.000979856 -3.53973 63.546000 Cu 0.162444 0.887967 7.50075e-17 224 63.546 0.00140757 -3.53983 63.546000 Cu 0.175547 0.867719 0.5 225 63.546 0.000235588 -3.53997 63.546000 Cu 0.256414 0.871028 1.0007e-16 227 63.546 0.000280388 -3.53996 63.546000 Cu 0.243301 0.891317 0.5 229 63.546 0.000579021 -3.53996 63.546000 Cu 0.324016 0.894538 1 228 63.546 0.00143292 -3.53986 63.546000 Cu 0.337336 0.874313 0.5 230 63.546 0.000761133 -3.53986 63.546000 Cu 0.41845 0.877631 1 231 63.546 0.000685806 -3.53974 63.546000 Cu 0.499855 0.881038 0.5 233 63.546 0.000242201 -3.53968 63.546000 Cu 0.675547 0.867719 1.19916e-19 212 63.546 0.000235588 -3.53997 63.546000 Cu 0.594514 0.864344 0.5 214 63.546 0.00037856 -3.5399 63.546000 Cu 0.581251 0.884507 1 235 63.546 0.000979856 -3.53973 63.546000 Cu 0.662444 0.887967 0.5 237 63.546 0.00140757 -3.53983 63.546000 Cu 0.837336 0.874313 9.30548e-17 216 63.546 0.000761133 -3.53986 63.546000 Cu 0.756414 0.871028 0.5 218 63.546 0.000280388 -3.53996 63.546000 Cu 0.743301 0.891317 2.26641e-17 239 63.546 0.000579021 -3.53996 63.546000 Cu 0.824016 0.894538 0.5 241 63.546 0.00143292 -3.53986 63.546000 Cu 0.999855 0.881038 1.43959e-16 220 63.546 0.000242201 -3.53968 63.546000 Cu 0.91845 0.877631 0.5 222 63.546 0.000685806 -3.53974 63.546000 Cu 0.0677679 0.904584 9.65324e-17 247 63.546 0.00121694 -3.53949 63.546000 Cu 0.135538 0.928224 6.13371e-17 248 63.546 0.0090339 -3.53835 63.546000 Cu 0.0535461 0.924524 0.5 250 63.546 0.00468287 -3.53902 63.546000 Cu 0.149217 0.908169 0.5 249 63.546 0.00402397 -3.53954 63.546000 Cu 0.230479 0.911638 5.9958e-20 251 63.546 0.0046126 -3.5395 63.546000 Cu 0.404937 0.897742 0.5 234 63.546 0.00291245 -3.53964 63.546000 Cu 0.311246 0.914904 0.5 253 63.546 0.0024346 -3.5398 63.546000 Cu 0.391768 0.917938 6.16368e-17 255 63.546 0.00779133 -3.5393 63.546000 Cu 0.486198 0.901058 3.46557e-17 232 63.546 0.00189464 -3.53949 63.546000 Cu 0.567768 0.904584 0.5 238 63.546 0.00121694 -3.53949 63.546000 Cu 0.47248 0.921107 0.5 257 63.546 0.0108419 -3.53922 63.546000 Cu 0.553546 0.924524 1.0067e-16 259 63.546 0.00468287 -3.53902 63.546000 Cu 0.649217 0.908169 9.50335e-17 236 63.546 0.00402397 -3.53954 63.546000 Cu 0.635538 0.928224 0.5 261 63.546 0.0090339 -3.53835 63.546000 Cu 0.811246 0.914904 1.19916e-19 240 63.546 0.0024346 -3.5398 63.546000 Cu 0.730479 0.911638 0.5 242 63.546 0.0046126 -3.5395 63.546000 Cu 0.904937 0.897742 5.09044e-17 243 63.546 0.00291245 -3.53964 63.546000 Cu 0.97248 0.921107 3.46557e-17 244 63.546 0.0108419 -3.53922 63.546000 Cu 0.986198 0.901058 0.5 245 63.546 0.00189464 -3.53949 63.546000 Cu 0.891768 0.917938 0.5 246 63.546 0.00779133 -3.5393 63.546000 Cu 0.0386576 0.944589 1 271 63.546 0.0301159 -3.53718 63.546000 Cu 0.120402 0.947894 0.5 273 63.546 0.0289403 -3.53266 63.546000 Cu 0.0226128 0.964771 0.5 274 63.546 0.192958 -3.5171 63.546000 Cu 0.217692 0.931822 0.5 254 63.546 0.0174849 -3.53724 63.546000 Cu 0.205159 0.951583 2.9979e-19 275 63.546 0.0427558 -3.52566 63.546000 Cu 0.28813 0.955631 0.5 277 63.546 0.103654 -3.52282 63.546000 Cu 0.299466 0.935336 1.86469e-17 252 63.546 0.0192963 -3.53698 63.546000 Cu 0.379541 0.938488 0.5 258 63.546 0.0137712 -3.53743 63.546000 Cu 0.368788 0.959509 1 279 63.546 0.110158 -3.52022 63.546000 Cu 0.458645 0.941315 3.2797e-17 256 63.546 0.0481366 -3.53531 63.546000 Cu 0.538658 0.944589 0.5 262 63.546 0.0301159 -3.53718 63.546000 Cu 0.445264 0.962412 0.5 281 63.546 0.0633789 -3.52247 63.546000 Cu 0.522613 0.964771 4.23903e-17 283 63.546 0.192958 -3.5171 63.546000 Cu 0.620402 0.947894 7.65664e-17 260 63.546 0.0289403 -3.53266 63.546000 Cu 0.705159 0.951583 0.5 266 63.546 0.0427558 -3.52566 63.546000 Cu 0.717692 0.931822 1 263 63.546 0.0174849 -3.53724 63.546000 Cu 0.78813 0.955631 9.04167e-17 264 63.546 0.103654 -3.52282 63.546000 Cu 0.799466 0.935336 0.5 265 63.546 0.0192963 -3.53698 63.546000 Cu 0.879541 0.938488 1 267 63.546 0.0137712 -3.53743 63.546000 Cu 0.945264 0.962412 7.19496e-17 268 63.546 0.0633789 -3.52247 63.546000 Cu 0.958645 0.941315 0.5 269 63.546 0.0481366 -3.53531 63.546000 Cu 0.868788 0.959509 0.5 270 63.546 0.110158 -3.52022 63.546000 Cu 0.106162 0.967505 1.19916e-19 272 63.546 0.0806379 -3.52331 63.546000 Cu 0.0106816 0.985686 2.20645e-17 294 63.546 0.211163 -3.52116 63.546000 Cu 0.0913055 0.986554 0.5 295 63.546 0.409465 -3.50074 63.546000 Cu 0.277729 0.975532 1 276 63.546 0.729341 -3.43733 63.546000 Cu 0.190597 0.970351 0.5 278 63.546 0.117799 -3.51298 63.546000 Cu 0.178389 0.98889 1 296 63.546 4.33272 -3.41617 63.546000 Cu 0.260448 0.993268 0.5 297 63.546 9.06853 -3.32413 63.546000 Cu 0.358402 0.981447 0.5 282 63.546 0.910174 -3.42344 63.546000 Cu 0.431723 0.984719 3.59748e-19 280 63.546 0.299499 -3.47887 63.546000 Cu 0.510682 0.985686 0.5 286 63.546 0.211163 -3.52116 63.546000 Cu 0.591306 0.986554 9.62926e-17 284 63.546 0.409465 -3.50074 63.546000 Cu 0.606162 0.967505 0.5 285 63.546 0.0806379 -3.52331 63.546000 Cu 0.690597 0.970351 1 287 63.546 0.117799 -3.51298 63.546000 Cu 0.678389 0.98889 0.5 290 63.546 4.33272 -3.41617 63.546000 Cu 0.760448 0.993268 9.11362e-18 288 63.546 9.06853 -3.32413 63.546000 Cu 0.777729 0.975532 0.5 289 63.546 0.729341 -3.43733 63.546000 Cu 0.858402 0.981447 3.50754e-17 291 63.546 0.910174 -3.42344 63.546000 Cu 0.931723 0.984719 0.5 292 63.546 0.299499 -3.47887