Number of particles = 588 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.013 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 88.2143 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60633 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 0.0405608 0.0130319 7.04697e-17 317 63.546 8.45343 -3.55521 63.546000 Cu 0.137607 0.0339564 4.81022e-19 318 63.546 0.476627 -3.47645 63.546000 Cu 0.123449 0.0115152 0.5 319 63.546 2.77854 -3.5299 63.546000 Cu 0.065371 0.038696 0.5 320 63.546 0.809683 -3.43722 63.546000 Cu 0.21034 0.0116955 4.81022e-19 321 63.546 0.562055 -3.52673 63.546000 Cu 0.216493 0.0328084 0.5 324 63.546 0.321212 -3.52038 63.546000 Cu 0.298804 0.0320888 1 322 63.546 0.38445 -3.50934 63.546000 Cu 0.293651 0.0117818 0.5 323 63.546 0.694964 -3.50371 63.546000 Cu 0.374061 0.0118536 1.29876e-17 325 63.546 6.64348 -3.2243 63.546000 Cu 0.387807 0.0297193 0.5 328 63.546 4.13271 -3.46507 63.546000 Cu 0.540561 0.0130319 0.5 299 63.546 8.45343 -3.55521 63.546000 Cu 0.565371 0.038696 4.81022e-17 305 63.546 0.809683 -3.43722 63.546000 Cu 0.470041 0.025597 4.90642e-17 326 63.546 8.97931 -3.31371 63.546000 Cu 0.484967 0.044518 0.5 351 63.546 0.763246 -3.46143 63.546000 Cu 0.623449 0.0115152 0 298 63.546 2.77854 -3.5299 63.546000 Cu 0.793651 0.0117818 0 300 63.546 0.694964 -3.50371 63.546000 Cu 0.71034 0.0116955 0.5 301 63.546 0.562055 -3.52673 63.546000 Cu 0.637607 0.0339564 0.5 307 63.546 0.476627 -3.47645 63.546000 Cu 0.716493 0.0328084 4.56971e-17 309 63.546 0.321212 -3.52038 63.546000 Cu 0.798804 0.0320888 0.5 311 63.546 0.38445 -3.50934 63.546000 Cu 0.874061 0.0118536 0.5 303 63.546 6.64348 -3.2243 63.546000 Cu 0.887807 0.0297193 1 313 63.546 4.13271 -3.46507 63.546000 Cu 0.984967 0.044518 1 314 63.546 0.763246 -3.46143 63.546000 Cu 0.970041 0.025597 0.5 315 63.546 8.97931 -3.31371 63.546000 Cu 0.0771874 0.0604113 1.2218e-16 341 63.546 0.151451 -3.51483 63.546000 Cu 0.167714 0.07827 0 342 63.546 0.0359058 -3.5203 63.546000 Cu 0.154052 0.057069 0.5 343 63.546 0.0860068 -3.50463 63.546000 Cu 0.0881016 0.0813548 0.5 344 63.546 0.0147116 -3.53319 63.546000 Cu 0.0073667 0.0844934 0 338 63.546 0.015051 -3.54232 63.546000 Cu 0.230805 0.0542213 1.22901e-16 345 63.546 0.154741 -3.52293 63.546000 Cu 0.327938 0.0715996 7.93686e-17 346 63.546 0.0351655 -3.53854 63.546000 Cu 0.313107 0.0516032 0.5 347 63.546 0.109784 -3.54302 63.546000 Cu 0.247295 0.0749684 0.5 348 63.546 0.0247009 -3.53244 63.546000 Cu 0.397801 0.0488897 2.81398e-17 349 63.546 0.0864291 -3.51702 63.546000 Cu 0.411927 0.0680609 0.5 352 63.546 0.0241014 -3.54035 63.546000 Cu 0.425298 0.0879136 3.07854e-17 375 63.546 0.0165957 -3.54516 63.546000 Cu 0.577187 0.0604113 0.5 308 63.546 0.151451 -3.51483 63.546000 Cu 0.588102 0.0813548 0 329 63.546 0.0147116 -3.53319 63.546000 Cu 0.495904 0.0642841 1 350 63.546 0.0797439 -3.5423 63.546000 Cu 0.507367 0.0844934 0.5 377 63.546 0.015051 -3.54232 63.546000 Cu 0.654052 0.057069 9.16346e-17 306 63.546 0.0860068 -3.50463 63.546000 Cu 0.730805 0.0542213 0.5 312 63.546 0.154741 -3.52293 63.546000 Cu 0.667714 0.07827 0.5 331 63.546 0.0359058 -3.5203 63.546000 Cu 0.747295 0.0749684 2.1646e-17 333 63.546 0.0247009 -3.53244 63.546000 Cu 0.813107 0.0516032 3.46336e-17 310 63.546 0.109784 -3.54302 63.546000 Cu 0.897801 0.0488897 0.5 316 63.546 0.0864291 -3.51702 63.546000 Cu 0.827938 0.0715996 0.5 335 63.546 0.0351655 -3.53854 63.546000 Cu 0.911927 0.0680609 1 337 63.546 0.0241014 -3.54035 63.546000 Cu 0.995904 0.0642841 0.5 339 63.546 0.0797439 -3.5423 63.546000 Cu 0.925298 0.0879136 0.5 340 63.546 0.0165957 -3.54516 63.546000 Cu 0.0326151 0.125311 1 364 63.546 0.000741535 -3.5389 63.546000 Cu 0.100313 0.101817 0 367 63.546 0.00362694 -3.53521 63.546000 Cu 0.194726 0.118798 1.16167e-16 368 63.546 0.00154126 -3.53821 63.546000 Cu 0.181207 0.0986352 0.5 369 63.546 0.00714468 -3.53276 63.546000 Cu 0.113524 0.122096 0.5 370 63.546 0.00181293 -3.53875 63.546000 Cu 0.0195141 0.104915 0.5 365 63.546 0.00218801 -3.54023 63.546000 Cu 0.262099 0.0952427 1.46712e-17 371 63.546 0.00575322 -3.53224 63.546000 Cu 0.357535 0.111735 1.41901e-17 372 63.546 0.00231455 -3.54106 63.546000 Cu 0.343406 0.0915965 0.5 373 63.546 0.0038666 -3.5407 63.546000 Cu 0.27615 0.115336 0.5 374 63.546 0.000762414 -3.53899 63.546000 Cu 0.289833 0.135465 9.16346e-17 397 63.546 0.000546421 -3.54094 63.546000 Cu 0.371032 0.131988 0.5 399 63.546 0.00114445 -3.54071 63.546000 Cu 0.532615 0.125311 0.5 354 63.546 0.000741535 -3.5389 63.546000 Cu 0.519514 0.104915 7.07102e-17 376 63.546 0.00218801 -3.54023 63.546000 Cu 0.438661 0.108192 0.5 378 63.546 0.00497832 -3.54256 63.546000 Cu 0.451883 0.12858 1 401 63.546 0.000738402 -3.53979 63.546000 Cu 0.600313 0.101817 0.5 332 63.546 0.00362694 -3.53521 63.546000 Cu 0.613524 0.122096 1.99624e-17 355 63.546 0.00181293 -3.53875 63.546000 Cu 0.681207 0.0986352 1.86636e-16 330 63.546 0.00714468 -3.53276 63.546000 Cu 0.762099 0.0952427 0.5 336 63.546 0.00575322 -3.53224 63.546000 Cu 0.694726 0.118798 0.5 357 63.546 0.00154126 -3.53821 63.546000 Cu 0.77615 0.115336 0 359 63.546 0.000762414 -3.53899 63.546000 Cu 0.789833 0.135465 0.5 362 63.546 0.000546421 -3.54094 63.546000 Cu 0.843406 0.0915965 0 334 63.546 0.0038666 -3.5407 63.546000 Cu 0.871032 0.131988 2.40511e-19 360 63.546 0.00114445 -3.54071 63.546000 Cu 0.857535 0.111735 0.5 361 63.546 0.00231455 -3.54106 63.546000 Cu 0.938661 0.108192 2.40511e-19 363 63.546 0.00497832 -3.54256 63.546000 Cu 0.951883 0.12858 0.5 366 63.546 0.000738402 -3.53979 63.546000 Cu 0.0596617 0.165893 8.36978e-17 390 63.546 0.000364706 -3.53943 63.546000 Cu 0.0461145 0.145634 0.5 391 63.546 0.000477699 -3.53896 63.546000 Cu 0.127119 0.142315 2.09244e-17 393 63.546 0.000735514 -3.53957 63.546000 Cu 0.140813 0.162511 0.5 396 63.546 0.0001269 -3.54014 63.546000 Cu 0.222066 0.159086 0 394 63.546 9.90067e-05 -3.54075 63.546000 Cu 0.208422 0.138926 0.5 395 63.546 0.000174918 -3.54034 63.546000 Cu 0.384412 0.152267 0 398 63.546 0.000364127 -3.53998 63.546000 Cu 0.303315 0.155669 0.5 400 63.546 0.000317396 -3.54083 63.546000 Cu 0.235618 0.179292 0.5 419 63.546 0.00014566 -3.54028 63.546000 Cu 0.316761 0.175906 2.40511e-19 421 63.546 0.000169286 -3.54013 63.546000 Cu 0.397753 0.17255 0.5 423 63.546 5.19442e-05 -3.53955 63.546000 Cu 0.546114 0.145634 1.10635e-17 353 63.546 0.000477699 -3.53896 63.546000 Cu 0.559662 0.165893 0.5 380 63.546 0.000364706 -3.53943 63.546000 Cu 0.465288 0.148925 0.5 402 63.546 0.000112518 -3.53901 63.546000 Cu 0.478697 0.169224 1.22661e-16 425 63.546 0.000100397 -3.53905 63.546000 Cu 0.708422 0.138926 1.34686e-17 356 63.546 0.000174918 -3.54034 63.546000 Cu 0.627119 0.142315 0.5 358 63.546 0.000735514 -3.53957 63.546000 Cu 0.640813 0.162511 5.09883e-17 381 63.546 0.0001269 -3.54014 63.546000 Cu 0.735618 0.179292 1.29635e-16 382 63.546 0.00014566 -3.54028 63.546000 Cu 0.722066 0.159086 0.5 383 63.546 9.90067e-05 -3.54075 63.546000 Cu 0.803315 0.155669 2.64562e-17 385 63.546 0.000317396 -3.54083 63.546000 Cu 0.816761 0.175906 0.5 388 63.546 0.000169286 -3.54013 63.546000 Cu 0.897753 0.17255 4.81022e-19 386 63.546 5.19442e-05 -3.53955 63.546000 Cu 0.884412 0.152267 0.5 387 63.546 0.000364127 -3.53998 63.546000 Cu 0.965288 0.148925 1.2242e-16 389 63.546 0.000112518 -3.53901 63.546000 Cu 0.978697 0.169224 0.5 392 63.546 0.000100397 -3.53905 63.546000 Cu 0.0868479 0.206317 3.12664e-18 414 63.546 8.46881e-06 -3.53996 63.546000 Cu 0.0732291 0.186116 0.5 415 63.546 0.000163435 -3.53987 63.546000 Cu 0.154417 0.182702 1.2242e-16 417 63.546 1.24494e-05 -3.5402 63.546000 Cu 0.167993 0.202908 0.5 420 63.546 0.000111844 -3.54012 63.546000 Cu 0.100464 0.226521 0.5 441 63.546 5.99974e-05 -3.54015 63.546000 Cu 0.181561 0.223144 1 443 63.546 6.93267e-05 -3.54004 63.546000 Cu 0.0057084 0.209709 0.5 416 63.546 8.95156e-05 -3.5399 63.546000 Cu 0.249086 0.199523 7.21533e-19 418 63.546 0.000103596 -3.54012 63.546000 Cu 0.330098 0.196163 0.5 424 63.546 3.4163e-05 -3.54009 63.546000 Cu 0.262531 0.219783 0.5 445 63.546 2.71993e-05 -3.53998 63.546000 Cu 0.343567 0.216422 4.81022e-19 447 63.546 2.79643e-05 -3.54008 63.546000 Cu 0.411132 0.192816 1 422 63.546 3.56812e-05 -3.5397 63.546000 Cu 0.424585 0.21307 0.5 449 63.546 0.000106531 -3.53995 63.546000 Cu 0.573229 0.186116 2.40511e-19 379 63.546 0.000163435 -3.53987 63.546000 Cu 0.586848 0.206317 0.5 404 63.546 8.46881e-06 -3.53996 63.546000 Cu 0.492121 0.18948 0.5 426 63.546 0.000195397 -3.53953 63.546000 Cu 0.505708 0.209709 0 451 63.546 8.95156e-05 -3.5399 63.546000 Cu 0.600464 0.226521 0 403 63.546 5.99974e-05 -3.54015 63.546000 Cu 0.654417 0.182702 0.5 384 63.546 1.24494e-05 -3.5402 63.546000 Cu 0.667993 0.202908 1.2218e-16 405 63.546 0.000111844 -3.54012 63.546000 Cu 0.762531 0.219783 1.2242e-16 406 63.546 2.71993e-05 -3.53998 63.546000 Cu 0.749086 0.199523 0.5 407 63.546 0.000103596 -3.54012 63.546000 Cu 0.681561 0.223144 0.5 408 63.546 6.93267e-05 -3.54004 63.546000 Cu 0.830098 0.196163 9.62043e-19 409 63.546 3.4163e-05 -3.54009 63.546000 Cu 0.924585 0.21307 2.09244e-17 410 63.546 0.000106531 -3.53995 63.546000 Cu 0.911132 0.192816 0.5 411 63.546 3.56812e-05 -3.5397 63.546000 Cu 0.843567 0.216422 0.5 412 63.546 2.79643e-05 -3.54008 63.546000 Cu 0.992121 0.18948 7.38368e-17 413 63.546 0.000195397 -3.53953 63.546000 Cu 0.114007 0.246753 1 440 63.546 2.82324e-05 -3.54011 63.546000 Cu 0.0329267 0.250129 0.5 442 63.546 2.92272e-05 -3.54013 63.546000 Cu 0.195055 0.243387 0.5 446 63.546 5.14417e-06 -3.53986 63.546000 Cu 0.0464905 0.270359 9.33182e-17 465 63.546 4.22831e-05 -3.53987 63.546000 Cu 0.127504 0.266989 0.5 467 63.546 3.99999e-06 -3.53987 63.546000 Cu 0.0193283 0.229918 1.20255e-17 439 63.546 1.03731e-05 -3.5401 63.546000 Cu 0.208543 0.263627 6.25328e-18 469 63.546 1.96509e-05 -3.54009 63.546000 Cu 0.276088 0.240029 2.40511e-19 444 63.546 1.54553e-05 -3.53979 63.546000 Cu 0.357114 0.236666 0.5 450 63.546 2.80782e-05 -3.53988 63.546000 Cu 0.289613 0.260262 0.5 471 63.546 2.03052e-05 -3.5399 63.546000 Cu 0.370721 0.256891 1.94814e-17 473 63.546 1.14455e-05 -3.53993 63.546000 Cu 0.532927 0.250129 2.50372e-16 427 63.546 2.92272e-05 -3.54013 63.546000 Cu 0.54649 0.270359 0.5 430 63.546 4.22831e-05 -3.53987 63.546000 Cu 0.438182 0.233295 0 448 63.546 3.20625e-05 -3.54001 63.546000 Cu 0.519328 0.229918 0.5 452 63.546 1.03731e-05 -3.5401 63.546000 Cu 0.45183 0.253521 0.5 475 63.546 2.89513e-05 -3.54015 63.546000 Cu 0.614007 0.246753 0.5 429 63.546 2.82324e-05 -3.54011 63.546000 Cu 0.627504 0.266989 2.10206e-16 428 63.546 3.99999e-06 -3.53987 63.546000 Cu 0.695055 0.243387 1.80383e-16 431 63.546 5.14417e-06 -3.53986 63.546000 Cu 0.789613 0.260262 1.06787e-16 432 63.546 2.03052e-05 -3.5399 63.546000 Cu 0.776088 0.240029 0.5 433 63.546 1.54553e-05 -3.53979 63.546000 Cu 0.708543 0.263627 0.5 434 63.546 1.96509e-05 -3.54009 63.546000 Cu 0.857114 0.236666 1.22661e-16 435 63.546 2.80782e-05 -3.53988 63.546000 Cu 0.95183 0.253521 1.22661e-16 436 63.546 2.89513e-05 -3.54015 63.546000 Cu 0.938182 0.233295 0.5 437 63.546 3.20625e-05 -3.54001 63.546000 Cu 0.870721 0.256891 0.5 438 63.546 1.14455e-05 -3.53993 63.546000 Cu 0.141028 0.287226 7.21533e-19 466 63.546 1.81221e-05 -3.53977 63.546000 Cu 0.0599542 0.290582 0.5 468 63.546 8.34006e-06 -3.53986 63.546000 Cu 0.0734223 0.310812 1 489 63.546 1.31207e-05 -3.54011 63.546000 Cu 0.154496 0.307447 0.5 491 63.546 9.74845e-06 -3.54005 63.546000 Cu 0.222119 0.283857 0.5 472 63.546 2.57101e-05 -3.53997 63.546000 Cu 0.30319 0.280479 2.40511e-19 470 63.546 1.10473e-05 -3.53973 63.546000 Cu 0.384269 0.277109 0.5 476 63.546 6.69148e-06 -3.53961 63.546000 Cu 0.235595 0.304079 6.78241e-17 493 63.546 1.02221e-05 -3.54017 63.546000 Cu 0.316697 0.300701 0.5 495 63.546 1.53002e-05 -3.53996 63.546000 Cu 0.397784 0.297322 1 497 63.546 1.90099e-05 -3.53992 63.546000 Cu 0.41121 0.317551 0.5 500 63.546 5.57833e-06 -3.54021 63.546000 Cu 0.559954 0.290582 1.73408e-16 453 63.546 8.34006e-06 -3.53986 63.546000 Cu 0.573422 0.310812 0.5 456 63.546 1.31207e-05 -3.54011 63.546000 Cu 0.465381 0.27373 2.98233e-17 474 63.546 1.76827e-05 -3.5399 63.546000 Cu 0.49234 0.314176 2.40511e-19 498 63.546 2.42061e-05 -3.54034 63.546000 Cu 0.478851 0.293952 0.5 499 63.546 4.21082e-06 -3.54017 63.546000 Cu 0.654496 0.307447 1.46712e-17 454 63.546 9.74845e-06 -3.54005 63.546000 Cu 0.641028 0.287226 0.5 455 63.546 1.81221e-05 -3.53977 63.546000 Cu 0.722119 0.283857 1.57054e-16 457 63.546 2.57101e-05 -3.53997 63.546000 Cu 0.735595 0.304079 0.5 460 63.546 1.02221e-05 -3.54017 63.546000 Cu 0.816697 0.300701 0 458 63.546 1.53002e-05 -3.53996 63.546000 Cu 0.80319 0.280479 0.5 459 63.546 1.10473e-05 -3.53973 63.546000 Cu 0.884269 0.277109 1.21939e-16 461 63.546 6.69148e-06 -3.53961 63.546000 Cu 0.978851 0.293952 1.22661e-16 462 63.546 4.21082e-06 -3.54017 63.546000 Cu 0.965381 0.27373 0.5 463 63.546 1.76827e-05 -3.5399 63.546000 Cu 0.897784 0.297322 0.5 464 63.546 1.90099e-05 -3.53992 63.546000 Cu 0.91121 0.317551 1 485 63.546 5.57833e-06 -3.54021 63.546000 Cu 0.99234 0.314176 0.5 487 63.546 2.42061e-05 -3.54034 63.546000 Cu 0.167906 0.327684 9.62043e-19 490 63.546 5.07139e-05 -3.53975 63.546000 Cu 0.0868335 0.331041 0.5 492 63.546 3.65605e-05 -3.53967 63.546000 Cu 0.100118 0.351261 7.21533e-19 515 63.546 1.51523e-05 -3.53944 63.546000 Cu 0.181221 0.347891 0.5 517 63.546 3.17215e-05 -3.53982 63.546000 Cu 0.00571385 0.334399 4.81022e-19 486 63.546 1.3174e-05 -3.53986 63.546000 Cu 0.0190312 0.354621 0.5 513 63.546 1.89632e-05 -3.5394 63.546000 Cu 0.330128 0.320926 8.46598e-17 494 63.546 6.14355e-06 -3.54009 63.546000 Cu 0.24901 0.324303 0.5 496 63.546 8.41602e-06 -3.54023 63.546000 Cu 0.262411 0.344523 2.06839e-17 519 63.546 7.21211e-05 -3.54024 63.546000 Cu 0.356868 0.361355 1.30838e-16 520 63.546 4.40617e-05 -3.54007 63.546000 Cu 0.343518 0.341147 0.5 521 63.546 2.43143e-05 -3.53988 63.546000 Cu 0.42463 0.337769 8.53814e-17 523 63.546 1.27589e-05 -3.53968 63.546000 Cu 0.586833 0.331041 6.20518e-17 477 63.546 3.65605e-05 -3.53967 63.546000 Cu 0.519031 0.354621 1 524 63.546 1.89632e-05 -3.5394 63.546000 Cu 0.505714 0.334399 0.5 525 63.546 1.3174e-05 -3.53986 63.546000 Cu 0.437993 0.357983 0.5 526 63.546 2.84467e-05 -3.53922 63.546000 Cu 0.600118 0.351261 0.5 480 63.546 1.51523e-05 -3.53944 63.546000 Cu 0.681221 0.347891 2.40511e-19 478 63.546 3.17215e-05 -3.53982 63.546000 Cu 0.667906 0.327684 0.5 479 63.546 5.07139e-05 -3.53975 63.546000 Cu 0.74901 0.324303 2.40511e-19 481 63.546 8.41602e-06 -3.54023 63.546000 Cu 0.762411 0.344523 0.5 484 63.546 7.21211e-05 -3.54024 63.546000 Cu 0.843518 0.341147 1.53927e-17 482 63.546 2.43143e-05 -3.53988 63.546000 Cu 0.830128 0.320926 0.5 483 63.546 6.14355e-06 -3.54009 63.546000 Cu 0.92463 0.337769 0.5 488 63.546 1.27589e-05 -3.53968 63.546000 Cu 0.856868 0.361355 0.5 509 63.546 4.40617e-05 -3.54007 63.546000 Cu 0.937993 0.357983 1.02217e-16 511 63.546 2.84467e-05 -3.53922 63.546000 Cu 0.0323791 0.374855 0 512 63.546 0.00010259 -3.53893 63.546000 Cu 0.194444 0.368124 1 516 63.546 6.76285e-05 -3.54058 63.546000 Cu 0.113359 0.3715 0.5 518 63.546 6.98828e-05 -3.53961 63.546000 Cu 0.0456341 0.395134 0.5 539 63.546 0.00024934 -3.5394 63.546000 Cu 0.126512 0.391773 4.81022e-19 541 63.546 0.00040175 -3.54016 63.546000 Cu 0.220905 0.40853 1 542 63.546 0.00106111 -3.53974 63.546000 Cu 0.207586 0.388348 0.5 543 63.546 0.000435919 -3.54076 63.546000 Cu 0.275629 0.364739 0.5 522 63.546 5.38133e-05 -3.54088 63.546000 Cu 0.288885 0.384931 4.81022e-19 545 63.546 0.000136524 -3.54095 63.546000 Cu 0.383615 0.401721 1 546 63.546 0.000651638 -3.53905 63.546000 Cu 0.370211 0.381547 0.5 547 63.546 0.000134697 -3.53982 63.546000 Cu 0.302314 0.405071 0.5 548 63.546 0.000423467 -3.53906 63.546000 Cu 0.545634 0.395134 0 501 63.546 0.00024934 -3.5394 63.546000 Cu 0.532379 0.374855 0.5 502 63.546 0.00010259 -3.53893 63.546000 Cu 0.451328 0.378198 1 549 63.546 0.000119146 -3.5389 63.546000 Cu 0.464758 0.398431 0.5 550 63.546 0.000769959 -3.53886 63.546000 Cu 0.613359 0.3715 0 503 63.546 6.98828e-05 -3.53961 63.546000 Cu 0.707586 0.388348 0 504 63.546 0.000435919 -3.54076 63.546000 Cu 0.694444 0.368124 0.5 505 63.546 6.76285e-05 -3.54058 63.546000 Cu 0.626512 0.391773 0.5 506 63.546 0.00040175 -3.54016 63.546000 Cu 0.775629 0.364739 7.21533e-19 507 63.546 5.38133e-05 -3.54088 63.546000 Cu 0.788885 0.384931 0.5 510 63.546 0.000136524 -3.54095 63.546000 Cu 0.720905 0.40853 0.5 531 63.546 0.00106111 -3.53974 63.546000 Cu 0.802314 0.405071 0 533 63.546 0.000423467 -3.53906 63.546000 Cu 0.870211 0.381547 2.40511e-19 508 63.546 0.000134697 -3.53982 63.546000 Cu 0.951328 0.378198 0.5 514 63.546 0.000119146 -3.5389 63.546000 Cu 0.883615 0.401721 0.5 535 63.546 0.000651638 -3.53905 63.546000 Cu 0.964758 0.398431 1.07749e-16 537 63.546 0.000769959 -3.53886 63.546000 Cu 0.0587302 0.415504 0 538 63.546 0.00199061 -3.54194 63.546000 Cu 0.1397 0.412053 0.5 544 63.546 0.00206284 -3.54087 63.546000 Cu 0.0719603 0.435841 0.5 563 63.546 0.0127316 -3.54471 63.546000 Cu 0.153455 0.432254 1.2218e-16 565 63.546 0.00486287 -3.54089 63.546000 Cu 0.1688 0.452279 0.5 568 63.546 0.0223596 -3.53966 63.546000 Cu 0.249667 0.448803 0 566 63.546 0.019158 -3.53376 63.546000 Cu 0.234798 0.428625 0.5 567 63.546 0.00317576 -3.53351 63.546000 Cu 0.315908 0.425183 6.97481e-18 569 63.546 0.00413858 -3.5334 63.546000 Cu 0.397015 0.421912 0.5 571 63.546 0.00354456 -3.53557 63.546000 Cu 0.329725 0.445404 0.5 572 63.546 0.0344455 -3.52112 63.546000 Cu 0.409673 0.442273 1 570 63.546 0.0122368 -3.53369 63.546000 Cu 0.57196 0.435841 0 527 63.546 0.0127316 -3.54471 63.546000 Cu 0.55873 0.415504 0.5 528 63.546 0.00199061 -3.54194 63.546000 Cu 0.477941 0.418755 7.26343e-17 573 63.546 0.00115409 -3.54027 63.546000 Cu 0.490351 0.439163 0.5 574 63.546 0.00704769 -3.54196 63.546000 Cu 0.6397 0.412053 1.46712e-17 529 63.546 0.00206284 -3.54087 63.546000 Cu 0.734798 0.428625 4.30514e-17 530 63.546 0.00317576 -3.53351 63.546000 Cu 0.653455 0.432254 0.5 532 63.546 0.00486287 -3.54089 63.546000 Cu 0.6688 0.452279 9.62043e-18 553 63.546 0.0223596 -3.53966 63.546000 Cu 0.749667 0.448803 0.5 555 63.546 0.019158 -3.53376 63.546000 Cu 0.815908 0.425183 0.5 536 63.546 0.00413858 -3.5334 63.546000 Cu 0.897015 0.421912 1.21939e-16 534 63.546 0.00354456 -3.53557 63.546000 Cu 0.977941 0.418755 0.5 540 63.546 0.00115409 -3.54027 63.546000 Cu 0.829725 0.445404 1 557 63.546 0.0344455 -3.52112 63.546000 Cu 0.909673 0.442273 0.5 559 63.546 0.0122368 -3.53369 63.546000 Cu 0.990351 0.439163 0 561 63.546 0.00704769 -3.54196 63.546000 Cu 0.0851819 0.45583 3.07854e-17 562 63.546 0.024024 -3.54104 63.546000 Cu 0.10949 0.49432 4.81022e-19 582 63.546 4.47975 -3.46516 63.546000 Cu 0.0992318 0.475149 0.5 583 63.546 0.060433 -3.52043 63.546000 Cu 0.18391 0.472198 9.69259e-17 585 63.546 0.0893058 -3.54332 63.546000 Cu 0.199615 0.491533 0.5 588 63.546 0.411706 -3.50167 63.546000 Cu 0.00199813 0.459446 0.5 564 63.546 0.0546967 -3.54339 63.546000 Cu 0.0128305 0.479414 0 581 63.546 1.03629 -3.45831 63.546000 Cu 0.0265149 0.498665 0.5 584 63.546 9.43861 -3.33784 63.546000 Cu 0.360993 0.489342 0.5 8 63.546 0.536771 -3.47213 63.546000 Cu 0.343835 0.466418 4.81022e-19 296 63.546 0.0893102 -3.5079 63.546000 Cu 0.281815 0.490565 1 586 63.546 0.26729 -3.51763 63.546000 Cu 0.266797 0.469349 0.5 587 63.546 0.150958 -3.5212 63.546000 Cu 0.42105 0.463084 0.5 10 63.546 0.121297 -3.50953 63.546000 Cu 0.51283 0.479414 0.5 1 63.546 1.03629 -3.45831 63.546000 Cu 0.501998 0.459446 1 2 63.546 0.0546967 -3.54339 63.546000 Cu 0.433138 0.484597 0 288 63.546 1.20762 -3.41331 63.546000 Cu 0.599232 0.475149 1.21939e-16 551 63.546 0.060433 -3.52043 63.546000 Cu 0.585182 0.45583 0.5 552 63.546 0.024024 -3.54104 63.546000 Cu 0.526515 0.498665 1 575 63.546 9.43861 -3.33784 63.546000 Cu 0.60949 0.49432 0.5 576 63.546 4.47975 -3.46516 63.546000 Cu 0.766797 0.469349 0 554 63.546 0.150958 -3.5212 63.546000 Cu 0.68391 0.472198 0.5 556 63.546 0.0893058 -3.54332 63.546000 Cu 0.699615 0.491533 1.46712e-17 577 63.546 0.411706 -3.50167 63.546000 Cu 0.781815 0.490565 0.5 578 63.546 0.26729 -3.51763 63.546000 Cu 0.92105 0.463084 5.65201e-17 558 63.546 0.121297 -3.50953 63.546000 Cu 0.843835 0.466418 0.5 560 63.546 0.0893102 -3.5079 63.546000 Cu 0.860993 0.489342 8.12927e-17 579 63.546 0.536771 -3.47213 63.546000 Cu 0.933138 0.484597 0.5 580 63.546 1.20762 -3.41331 63.546000 Cu 0.126002 0.511905 0.5 4 63.546 6.65117 -3.22509 63.546000 Cu 0.0151096 0.544528 4.81022e-19 20 63.546 0.780735 -3.46105 63.546000 Cu 0.0298981 0.525573 0.5 21 63.546 8.99968 -3.31484 63.546000 Cu 0.112268 0.529735 1.2218e-16 23 63.546 4.14789 -3.46346 63.546000 Cu 0.206476 0.511823 2.40511e-19 3 63.546 0.695576 -3.50431 63.546000 Cu 0.376552 0.511537 0 5 63.546 2.73846 -3.52919 63.546000 Cu 0.289735 0.511724 0.5 6 63.546 0.556635 -3.52688 63.546000 Cu 0.201304 0.532116 0.5 25 63.546 0.384696 -3.50915 63.546000 Cu 0.28361 0.532858 1 27 63.546 0.318969 -3.52031 63.546000 Cu 0.362493 0.533982 0.5 29 63.546 0.481976 -3.47582 63.546000 Cu 0.459422 0.512896 0.5 7 63.546 8.67546 -3.55462 63.546000 Cu 0.529898 0.525573 1.85193e-17 9 63.546 8.99968 -3.31484 63.546000 Cu 0.434694 0.538719 1 31 63.546 0.828055 -3.43528 63.546000 Cu 0.51511 0.544528 0.5 34 63.546 0.780735 -3.46105 63.546000 Cu 0.626002 0.511905 1.21458e-16 11 63.546 6.65117 -3.22509 63.546000 Cu 0.701304 0.532116 0 12 63.546 0.384696 -3.50915 63.546000 Cu 0.706476 0.511823 0.5 13 63.546 0.695576 -3.50431 63.546000 Cu 0.612268 0.529735 0.5 14 63.546 4.14789 -3.46346 63.546000 Cu 0.789735 0.511724 1.09192e-16 15 63.546 0.556635 -3.52688 63.546000 Cu 0.78361 0.532858 0.5 18 63.546 0.318969 -3.52031 63.546000 Cu 0.862493 0.533982 1 16 63.546 0.481976 -3.47582 63.546000 Cu 0.876552 0.511537 0.5 17 63.546 2.73846 -3.52919 63.546000 Cu 0.959422 0.512896 2.3089e-17 19 63.546 8.67546 -3.55462 63.546000 Cu 0.934694 0.538719 0.5 22 63.546 0.828055 -3.43528 63.546000 Cu 0.102276 0.548903 0.5 26 63.546 0.0844965 -3.51746 63.546000 Cu 0.00428123 0.564306 0.5 45 63.546 0.0801331 -3.54188 63.546000 Cu 0.0882357 0.568073 1.22901e-16 47 63.546 0.0249657 -3.53998 63.546000 Cu 0.172261 0.571614 0.5 49 63.546 0.0352167 -3.53848 63.546000 Cu 0.0749528 0.587939 0.5 50 63.546 0.0170574 -3.54516 63.546000 Cu 0.187058 0.551636 4.81022e-19 24 63.546 0.110023 -3.54345 63.546000 Cu 0.346147 0.55712 1 28 63.546 0.0882237 -3.50445 63.546000 Cu 0.269409 0.554266 0.5 30 63.546 0.158808 -3.52324 63.546000 Cu 0.252904 0.575 5.31529e-17 51 63.546 0.024646 -3.53211 63.546000 Cu 0.332516 0.578317 0.5 53 63.546 0.0368237 -3.52037 63.546000 Cu 0.423019 0.560455 0.5 32 63.546 0.150682 -3.51423 63.546000 Cu 0.504281 0.564306 0 33 63.546 0.0801331 -3.54188 63.546000 Cu 0.412194 0.581404 1.0847e-16 55 63.546 0.0147341 -3.53353 63.546000 Cu 0.492929 0.584537 0.5 58 63.546 0.0142792 -3.5425 63.546000 Cu 0.588236 0.568073 0.5 38 63.546 0.0249657 -3.53998 63.546000 Cu 0.574953 0.587939 0 59 63.546 0.0170574 -3.54516 63.546000 Cu 0.602276 0.548903 1 35 63.546 0.0844965 -3.51746 63.546000 Cu 0.672261 0.571614 1.4599e-16 36 63.546 0.0352167 -3.53848 63.546000 Cu 0.687058 0.551636 0.5 37 63.546 0.110023 -3.54345 63.546000 Cu 0.769409 0.554266 1.72446e-16 39 63.546 0.158808 -3.52324 63.546000 Cu 0.752904 0.575 0.5 42 63.546 0.024646 -3.53211 63.546000 Cu 0.992929 0.584537 1 44 63.546 0.0142792 -3.5425 63.546000 Cu 0.832516 0.578317 0 40 63.546 0.0368237 -3.52037 63.546000 Cu 0.846147 0.55712 0.5 41 63.546 0.0882237 -3.50445 63.546000 Cu 0.923019 0.560455 7.09507e-17 43 63.546 0.150682 -3.51423 63.546000 Cu 0.912194 0.581404 0.5 46 63.546 0.0147341 -3.53353 63.546000 Cu 0.1568 0.591609 4.81022e-19 48 63.546 0.0040885 -3.54081 63.546000 Cu 0.0616434 0.608231 4.81022e-19 71 63.546 0.00462966 -3.54227 63.546000 Cu 0.129261 0.63202 1.2242e-16 72 63.546 0.00107105 -3.54073 63.546000 Cu 0.142724 0.61176 0.5 73 63.546 0.00245421 -3.54086 63.546000 Cu 0.048438 0.628625 0.5 74 63.546 0.000598823 -3.53971 63.546000 Cu 0.319055 0.598669 0 52 63.546 0.0069274 -3.53285 63.546000 Cu 0.23812 0.595269 0.5 54 63.546 0.00557727 -3.53242 63.546000 Cu 0.224086 0.615359 0 75 63.546 0.000688602 -3.53899 63.546000 Cu 0.305504 0.618829 0.5 77 63.546 0.00146679 -3.53832 63.546000 Cu 0.210396 0.63549 0.5 78 63.546 0.000676476 -3.54104 63.546000 Cu 0.399968 0.601864 0.5 56 63.546 0.00385381 -3.53538 63.546000 Cu 0.386747 0.622133 1.5056e-16 79 63.546 0.00176743 -3.53879 63.546000 Cu 0.480815 0.604969 1.27952e-16 57 63.546 0.00210957 -3.54022 63.546000 Cu 0.561643 0.608231 0.5 62 63.546 0.00462966 -3.54227 63.546000 Cu 0.467689 0.625352 0.5 82 63.546 0.000844988 -3.5388 63.546000 Cu 0.548438 0.628625 4.06463e-17 83 63.546 0.000598823 -3.53971 63.546000 Cu 0.642724 0.61176 4.81022e-19 60 63.546 0.00245421 -3.54086 63.546000 Cu 0.6568 0.591609 0.5 61 63.546 0.0040885 -3.54081 63.546000 Cu 0.73812 0.595269 2.40511e-19 63 63.546 0.00557727 -3.53242 63.546000 Cu 0.724086 0.615359 0.5 66 63.546 0.000688602 -3.53899 63.546000 Cu 0.629261 0.63202 0.5 85 63.546 0.00107105 -3.54073 63.546000 Cu 0.710396 0.63549 7.21533e-19 87 63.546 0.000676476 -3.54104 63.546000 Cu 0.980815 0.604969 0.5 69 63.546 0.00210957 -3.54022 63.546000 Cu 0.805504 0.618829 6.01277e-18 64 63.546 0.00146679 -3.53832 63.546000 Cu 0.819055 0.598669 0.5 65 63.546 0.0069274 -3.53285 63.546000 Cu 0.899968 0.601864 4.3292e-17 67 63.546 0.00385381 -3.53538 63.546000 Cu 0.967689 0.625352 9.62043e-19 68 63.546 0.000844988 -3.5388 63.546000 Cu 0.886747 0.622133 0.5 70 63.546 0.00176743 -3.53879 63.546000 Cu 0.0349957 0.648968 4.81022e-19 95 63.546 0.0001049 -3.53917 63.546000 Cu 0.102452 0.672587 7.21533e-19 96 63.546 4.81807e-05 -3.53924 63.546000 Cu 0.115847 0.652315 0.5 97 63.546 0.000267072 -3.53993 63.546000 Cu 0.0215067 0.669258 0.5 98 63.546 0.000119103 -3.53906 63.546000 Cu 0.1969 0.655706 1 99 63.546 0.000314541 -3.54075 63.546000 Cu 0.183462 0.675935 0.5 102 63.546 0.000119587 -3.53986 63.546000 Cu 0.291805 0.638954 0 76 63.546 0.000163121 -3.54041 63.546000 Cu 0.373114 0.642342 0.5 81 63.546 0.000672964 -3.5396 63.546000 Cu 0.26458 0.679317 7.21533e-19 100 63.546 0.000133711 -3.54048 63.546000 Cu 0.278132 0.659108 0.5 101 63.546 0.00014991 -3.54074 63.546000 Cu 0.359393 0.662531 4.81022e-19 103 63.546 0.000101131 -3.54016 63.546000 Cu 0.454164 0.645664 1.22661e-16 80 63.546 0.000492686 -3.53918 63.546000 Cu 0.534996 0.648968 0.5 86 63.546 0.0001049 -3.53917 63.546000 Cu 0.440529 0.665919 0.5 105 63.546 0.000304563 -3.53964 63.546000 Cu 0.521507 0.669258 7.21533e-19 107 63.546 0.000119103 -3.53906 63.546000 Cu 0.615847 0.652315 6.95076e-17 84 63.546 0.000267072 -3.53993 63.546000 Cu 0.6969 0.655706 0.5 90 63.546 0.000314541 -3.54075 63.546000 Cu 0.602452 0.672587 0.5 109 63.546 4.81807e-05 -3.53924 63.546000 Cu 0.683462 0.675935 1.23142e-16 111 63.546 0.000119587 -3.53986 63.546000 Cu 0.76458 0.679317 0.5 113 63.546 0.000133711 -3.54048 63.546000 Cu 0.778132 0.659108 7.21533e-19 88 63.546 0.00014991 -3.54074 63.546000 Cu 0.791805 0.638954 0.5 89 63.546 0.000163121 -3.54041 63.546000 Cu 0.873114 0.642342 6.6862e-17 91 63.546 0.000672964 -3.5396 63.546000 Cu 0.940529 0.665919 2.40511e-19 92 63.546 0.000304563 -3.53964 63.546000 Cu 0.954164 0.645664 0.5 93 63.546 0.000492686 -3.53918 63.546000 Cu 0.859393 0.662531 0.5 94 63.546 0.000101131 -3.54016 63.546000 Cu 0.00806003 0.689503 4.81022e-19 119 63.546 0.000163639 -3.53939 63.546000 Cu 0.0755809 0.713086 7.21533e-19 120 63.546 7.47056e-05 -3.53991 63.546000 Cu 0.0890546 0.692837 0.5 121 63.546 2.75101e-05 -3.53967 63.546000 Cu 0.170094 0.696187 9.62043e-19 123 63.546 2.44083e-05 -3.54022 63.546000 Cu 0.156615 0.716436 0.5 126 63.546 2.21164e-05 -3.54004 63.546000 Cu 0.345759 0.682723 0.5 106 63.546 2.53749e-05 -3.54041 63.546000 Cu 0.237657 0.719793 4.81022e-19 124 63.546 1.83812e-05 -3.53986 63.546000 Cu 0.251103 0.699547 0.5 125 63.546 7.81756e-05 -3.54021 63.546000 Cu 0.332234 0.70293 1 127 63.546 5.77142e-05 -3.54004 63.546000 Cu 0.318673 0.723148 0.5 130 63.546 5.79587e-05 -3.53996 63.546000 Cu 0.399774 0.726525 4.81022e-19 128 63.546 5.47007e-05 -3.54005 63.546000 Cu 0.426929 0.686135 1 104 63.546 9.98543e-05 -3.5399 63.546000 Cu 0.50806 0.689503 0.5 110 63.546 0.000163639 -3.53939 63.546000 Cu 0.413368 0.706331 0.5 129 63.546 1.18483e-05 -3.53973 63.546000 Cu 0.494511 0.709718 9.62043e-19 131 63.546 8.09163e-05 -3.53978 63.546000 Cu 0.589055 0.692837 4.81022e-19 108 63.546 2.75101e-05 -3.53967 63.546000 Cu 0.575581 0.713086 0.5 133 63.546 7.47056e-05 -3.53991 63.546000 Cu 0.751103 0.699547 0 112 63.546 7.81756e-05 -3.54021 63.546000 Cu 0.670094 0.696187 0.5 114 63.546 2.44083e-05 -3.54022 63.546000 Cu 0.656615 0.716436 8.03306e-17 135 63.546 2.21164e-05 -3.54004 63.546000 Cu 0.737657 0.719793 0.5 137 63.546 1.83812e-05 -3.53986 63.546000 Cu 0.994511 0.709718 0.5 122 63.546 8.09163e-05 -3.53978 63.546000 Cu 0.845759 0.682723 1.2242e-16 115 63.546 2.53749e-05 -3.54041 63.546000 Cu 0.913368 0.706331 2.446e-16 116 63.546 1.18483e-05 -3.53973 63.546000 Cu 0.926929 0.686135 0.5 117 63.546 9.98543e-05 -3.5399 63.546000 Cu 0.832234 0.70293 0.5 118 63.546 5.77142e-05 -3.54004 63.546000 Cu 0.818673 0.723148 1.39256e-16 139 63.546 5.79587e-05 -3.53996 63.546000 Cu 0.899774 0.726525 0.5 141 63.546 5.47007e-05 -3.54005 63.546000 Cu 0.0484143 0.753515 9.62043e-19 144 63.546 2.38202e-05 -3.54003 63.546000 Cu 0.0620148 0.733302 0.5 145 63.546 3.06199e-05 -3.53993 63.546000 Cu 0.143072 0.736669 9.62043e-19 147 63.546 2.11247e-05 -3.53975 63.546000 Cu 0.129564 0.756884 0.5 150 63.546 3.00191e-05 -3.53972 63.546000 Cu 0.210619 0.76026 2.40511e-19 148 63.546 2.99382e-05 -3.53987 63.546000 Cu 0.224118 0.740023 0.5 149 63.546 7.09036e-06 -3.53981 63.546000 Cu 0.305142 0.743385 8.29762e-17 151 63.546 1.23205e-05 -3.54002 63.546000 Cu 0.372691 0.766979 1.2218e-16 152 63.546 1.53541e-05 -3.5398 63.546000 Cu 0.291661 0.763622 0.5 154 63.546 8.89773e-06 -3.53997 63.546000 Cu 0.386178 0.746752 0.5 153 63.546 5.38829e-05 -3.54026 63.546000 Cu 0.562015 0.733302 2.40511e-19 132 63.546 3.06199e-05 -3.53993 63.546000 Cu 0.480879 0.729926 0.5 134 63.546 1.57521e-05 -3.54006 63.546000 Cu 0.45377 0.770342 0.5 155 63.546 2.56387e-05 -3.53995 63.546000 Cu 0.467286 0.750125 2.06118e-16 156 63.546 3.76156e-05 -3.5402 63.546000 Cu 0.548414 0.753515 0.5 158 63.546 2.38202e-05 -3.54003 63.546000 Cu 0.724118 0.740023 2.40511e-19 136 63.546 7.09036e-06 -3.53981 63.546000 Cu 0.643072 0.736669 0.5 138 63.546 2.11247e-05 -3.53975 63.546000 Cu 0.629564 0.756884 1 159 63.546 3.00191e-05 -3.53972 63.546000 Cu 0.710619 0.76026 0.5 161 63.546 2.99382e-05 -3.53987 63.546000 Cu 0.791661 0.763622 1.22661e-16 163 63.546 8.89773e-06 -3.53997 63.546000 Cu 0.980879 0.729926 1 143 63.546 1.57521e-05 -3.54006 63.546000 Cu 0.886178 0.746752 1.22901e-16 140 63.546 5.38829e-05 -3.54026 63.546000 Cu 0.805142 0.743385 0.5 142 63.546 1.23205e-05 -3.54002 63.546000 Cu 0.967286 0.750125 0.5 146 63.546 3.76156e-05 -3.5402 63.546000 Cu 0.872691 0.766979 0.5 165 63.546 1.53541e-05 -3.5398 63.546000 Cu 0.95377 0.770342 1 167 63.546 2.56387e-05 -3.53995 63.546000 Cu 0.0213738 0.793933 7.26343e-17 168 63.546 9.56914e-06 -3.53997 63.546000 Cu 0.0349007 0.773711 0.5 169 63.546 2.72326e-05 -3.53991 63.546000 Cu 0.115992 0.777096 1.34686e-17 171 63.546 2.49408e-06 -3.53981 63.546000 Cu 0.102431 0.797309 0.5 174 63.546 4.12133e-05 -3.53996 63.546000 Cu 0.00785343 0.814154 0.5 193 63.546 7.6184e-05 -3.54005 63.546000 Cu 0.0889997 0.817521 1.75573e-17 195 63.546 1.32601e-05 -3.54018 63.546000 Cu 0.183566 0.80069 8.8989e-17 172 63.546 1.59977e-05 -3.54003 63.546000 Cu 0.197071 0.780475 0.5 173 63.546 1.46743e-05 -3.53999 63.546000 Cu 0.278164 0.783854 1.2218e-16 175 63.546 4.16136e-05 -3.53988 63.546000 Cu 0.34581 0.807433 0 176 63.546 2.12392e-05 -3.54026 63.546000 Cu 0.359247 0.787207 0.5 177 63.546 9.67116e-07 -3.53971 63.546000 Cu 0.264715 0.804065 0.5 178 63.546 1.5119e-05 -3.54004 63.546000 Cu 0.534901 0.773711 1.21939e-16 157 63.546 2.72326e-05 -3.53991 63.546000 Cu 0.440319 0.790558 0 179 63.546 3.5665e-05 -3.53989 63.546000 Cu 0.426834 0.810798 0.5 180 63.546 8.77113e-06 -3.54019 63.546000 Cu 0.507853 0.814154 0 181 63.546 7.6184e-05 -3.54005 63.546000 Cu 0.521374 0.793933 0.5 182 63.546 9.56914e-06 -3.53997 63.546000 Cu 0.589 0.817521 0.5 186 63.546 1.32601e-05 -3.54018 63.546000 Cu 0.697071 0.780475 0 160 63.546 1.46743e-05 -3.53999 63.546000 Cu 0.615992 0.777096 0.5 162 63.546 2.49408e-06 -3.53981 63.546000 Cu 0.602431 0.797309 0 183 63.546 4.12133e-05 -3.53996 63.546000 Cu 0.683566 0.80069 0.5 185 63.546 1.59977e-05 -3.54003 63.546000 Cu 0.764715 0.804065 7.21533e-19 187 63.546 1.5119e-05 -3.54004 63.546000 Cu 0.778164 0.783854 0.5 166 63.546 4.16136e-05 -3.53988 63.546000 Cu 0.859247 0.787207 9.62043e-19 164 63.546 9.67116e-07 -3.53971 63.546000 Cu 0.940319 0.790558 0.5 170 63.546 3.5665e-05 -3.53989 63.546000 Cu 0.84581 0.807433 0.5 189 63.546 2.12392e-05 -3.54026 63.546000 Cu 0.926834 0.810798 5.53175e-18 191 63.546 8.77113e-06 -3.54019 63.546000 Cu 0.156685 0.841117 2.38106e-17 196 63.546 2.35433e-05 -3.54018 63.546000 Cu 0.170138 0.820896 0.5 197 63.546 1.31156e-05 -3.54015 63.546000 Cu 0.0755701 0.837741 0.5 198 63.546 1.789e-05 -3.54006 63.546000 Cu 0.0621606 0.857963 2.36422e-16 219 63.546 3.41427e-05 -3.53938 63.546000 Cu 0.143301 0.861328 0.5 221 63.546 4.6659e-05 -3.54031 63.546000 Cu 0.251265 0.824285 7.8647e-17 199 63.546 9.03793e-06 -3.54013 63.546000 Cu 0.319002 0.847882 1.2218e-16 200 63.546 4.67565e-05 -3.53977 63.546000 Cu 0.332321 0.827675 0.5 201 63.546 0.000106739 -3.53964 63.546000 Cu 0.237805 0.844503 0.5 202 63.546 8.09634e-05 -3.54031 63.546000 Cu 0.413397 0.831032 0 203 63.546 4.5395e-05 -3.53941 63.546000 Cu 0.400077 0.851246 0.5 204 63.546 3.84336e-05 -3.53923 63.546000 Cu 0.48114 0.854602 2.40511e-19 205 63.546 3.04731e-05 -3.53917 63.546000 Cu 0.494495 0.834381 0.5 206 63.546 6.54889e-06 -3.53967 63.546000 Cu 0.562161 0.857963 0.5 210 63.546 3.41427e-05 -3.53938 63.546000 Cu 0.57557 0.837741 1 207 63.546 1.789e-05 -3.54006 63.546000 Cu 0.670138 0.820896 7.04697e-17 184 63.546 1.31156e-05 -3.54015 63.546000 Cu 0.751265 0.824285 0.5 190 63.546 9.03793e-06 -3.54013 63.546000 Cu 0.643301 0.861328 4.85832e-17 208 63.546 4.6659e-05 -3.54031 63.546000 Cu 0.656685 0.841117 0.5 209 63.546 2.35433e-05 -3.54018 63.546000 Cu 0.737805 0.844503 5.31529e-17 211 63.546 8.09634e-05 -3.54031 63.546000 Cu 0.994495 0.834381 5.31529e-17 192 63.546 6.54889e-06 -3.53967 63.546000 Cu 0.98114 0.854602 0.5 217 63.546 3.04731e-05 -3.53917 63.546000 Cu 0.832321 0.827675 2.40511e-19 188 63.546 0.000106739 -3.53964 63.546000 Cu 0.913397 0.831032 0.5 194 63.546 4.5395e-05 -3.53941 63.546000 Cu 0.819002 0.847882 0.5 213 63.546 4.67565e-05 -3.53977 63.546000 Cu 0.900077 0.851246 1 215 63.546 3.84336e-05 -3.53923 63.546000 Cu 0.1299 0.881531 1.39015e-16 220 63.546 0.000156819 -3.54003 63.546000 Cu 0.0487618 0.878182 0.5 222 63.546 0.000174499 -3.53892 63.546000 Cu 0.0353072 0.898424 2.44119e-16 243 63.546 0.000994503 -3.53869 63.546000 Cu 0.11643 0.901703 0.5 245 63.546 0.000847416 -3.53894 63.546000 Cu 0.19776 0.905043 6.10898e-17 247 63.546 0.000579975 -3.53896 63.546000 Cu 0.224533 0.864717 1.2218e-16 223 63.546 4.79587e-05 -3.54117 63.546000 Cu 0.292573 0.888342 2.44359e-16 224 63.546 0.000529828 -3.54102 63.546000 Cu 0.305755 0.86812 0.5 225 63.546 0.000129708 -3.54083 63.546000 Cu 0.211241 0.884912 0.5 226 63.546 0.000182552 -3.54112 63.546000 Cu 0.373653 0.89178 0.5 229 63.546 0.000586172 -3.54033 63.546000 Cu 0.279221 0.908518 0.5 249 63.546 0.00117454 -3.53969 63.546000 Cu 0.386807 0.871499 0 227 63.546 9.29052e-05 -3.53964 63.546000 Cu 0.454503 0.895137 1.2242e-16 228 63.546 0.000265401 -3.53939 63.546000 Cu 0.467756 0.874841 0.5 230 63.546 0.000150811 -3.53881 63.546000 Cu 0.548762 0.878182 4.81022e-19 231 63.546 0.000174499 -3.53892 63.546000 Cu 0.535307 0.898424 0.5 234 63.546 0.000994503 -3.53869 63.546000 Cu 0.724533 0.864717 0.5 214 63.546 4.79587e-05 -3.54117 63.546000 Cu 0.61643 0.901703 1.22901e-16 232 63.546 0.000847416 -3.53894 63.546000 Cu 0.6299 0.881531 0.5 233 63.546 0.000156819 -3.54003 63.546000 Cu 0.711241 0.884912 4.81022e-19 235 63.546 0.000182552 -3.54112 63.546000 Cu 0.69776 0.905043 0.5 238 63.546 0.000579975 -3.53896 63.546000 Cu 0.779221 0.908518 1.20255e-18 236 63.546 0.00117454 -3.53969 63.546000 Cu 0.792573 0.888342 0.5 237 63.546 0.000529828 -3.54102 63.546000 Cu 0.805755 0.86812 9.62043e-19 212 63.546 0.000129708 -3.54083 63.546000 Cu 0.967756 0.874841 2.45321e-16 216 63.546 0.000150811 -3.53881 63.546000 Cu 0.886807 0.871499 0.5 218 63.546 9.29052e-05 -3.53964 63.546000 Cu 0.873653 0.89178 1 239 63.546 0.000586172 -3.54033 63.546000 Cu 0.954503 0.895137 0.5 241 63.546 0.000265401 -3.53939 63.546000 Cu 0.103012 0.921897 1.08711e-16 244 63.546 0.00400711 -3.5355 63.546000 Cu 0.0221394 0.918763 0.5 246 63.546 0.00128325 -3.54002 63.546000 Cu 0.00976205 0.939183 1.55611e-16 267 63.546 0.00758049 -3.54179 63.546000 Cu 0.0904232 0.942267 0.5 269 63.546 0.0118152 -3.5337 63.546000 Cu 0.170371 0.945367 4.4254e-17 271 63.546 0.0358779 -3.52111 63.546000 Cu 0.184133 0.925147 0.5 250 63.546 0.00479221 -3.53359 63.546000 Cu 0.265301 0.92859 8.70649e-17 248 63.546 0.00360963 -3.53348 63.546000 Cu 0.360458 0.912064 0 251 63.546 0.0025946 -3.54088 63.546000 Cu 0.346671 0.932254 0.5 254 63.546 0.00489723 -3.54089 63.546000 Cu 0.250442 0.948762 0.5 273 63.546 0.0202795 -3.53367 63.546000 Cu 0.331296 0.952269 1 275 63.546 0.0226365 -3.53968 63.546000 Cu 0.428193 0.935867 1.22661e-16 252 63.546 0.0141541 -3.54476 63.546000 Cu 0.441403 0.915525 0.5 253 63.546 0.0025165 -3.54187 63.546000 Cu 0.522139 0.918763 1.22661e-16 255 63.546 0.00128325 -3.54002 63.546000 Cu 0.509762 0.939183 0.5 258 63.546 0.00758049 -3.54179 63.546000 Cu 0.590423 0.942267 1 256 63.546 0.0118152 -3.5337 63.546000 Cu 0.603012 0.921897 0.5 257 63.546 0.00400711 -3.5355 63.546000 Cu 0.684133 0.925147 9.62043e-19 259 63.546 0.00479221 -3.53359 63.546000 Cu 0.750442 0.948762 1 260 63.546 0.0202795 -3.53367 63.546000 Cu 0.765301 0.92859 0.5 261 63.546 0.00360963 -3.53348 63.546000 Cu 0.670371 0.945367 0.5 262 63.546 0.0358779 -3.52111 63.546000 Cu 0.941403 0.915525 1.23142e-16 240 63.546 0.0025165 -3.54187 63.546000 Cu 0.860458 0.912064 0.5 242 63.546 0.0025946 -3.54088 63.546000 Cu 0.846671 0.932254 1 263 63.546 0.00489723 -3.54089 63.546000 Cu 0.928193 0.935867 0.5 265 63.546 0.0141541 -3.54476 63.546000 Cu 0.831296 0.952269 0.5 266 63.546 0.0226365 -3.53968 63.546000 Cu 0.0791211 0.963077 1 268 63.546 0.122455 -3.509 63.546000 Cu 0.156347 0.966388 0.5 274 63.546 0.0899741 -3.50767 63.546000 Cu 0.0670213 0.984576 0.5 292 63.546 1.24796 -3.41155 63.546000 Cu 0.139151 0.989316 1.2218e-16 293 63.546 0.542446 -3.47142 63.546000 Cu 0.390707 0.994321 0.5 327 63.546 4.4945 -3.46372 63.546000 Cu 0.233313 0.969301 1.10394e-16 272 63.546 0.15367 -3.52139 63.546000 Cu 0.316173 0.97218 0.5 278 63.546 0.0917791 -3.54405 63.546000 Cu 0.218303 0.990544 0.5 294 63.546 0.268775 -3.51757 63.546000 Cu 0.300507 0.991518 0 295 63.546 0.413262 -3.50082 63.546000 Cu 0.473752 0.998692 4.81022e-19 297 63.546 9.47296 -3.33946 63.546000 Cu 0.400883 0.975154 1 276 63.546 0.0609181 -3.52082 63.546000 Cu 0.414929 0.955853 0.5 277 63.546 0.0250301 -3.54081 63.546000 Cu 0.498153 0.959465 7.21533e-19 279 63.546 0.0554509 -3.54319 63.546000 Cu 0.567021 0.984576 7.40773e-17 280 63.546 1.24796 -3.41155 63.546000 Cu 0.487388 0.979426 0.5 282 63.546 1.0652 -3.45802 63.546000 Cu 0.579121 0.963077 0.5 281 63.546 0.122455 -3.509 63.546000 Cu 0.656347 0.966388 9.37992e-17 283 63.546 0.0899741 -3.50767 63.546000 Cu 0.718303 0.990544 1.2218e-16 284 63.546 0.268775 -3.51757 63.546000 Cu 0.733313 0.969301 0.5 285 63.546 0.15367 -3.52139 63.546000 Cu 0.639151 0.989316 0.5 286 63.546 0.542446 -3.47142 63.546000 Cu 0.973752 0.998692 0.5 304 63.546 9.47296 -3.33946 63.546000 Cu 0.890707 0.994321 1.20255e-18 302 63.546 4.4945 -3.46372 63.546000 Cu 0.998153 0.959465 0.5 270 63.546 0.0554509 -3.54319 63.546000 Cu 0.987388 0.979426 1.33965e-16 291 63.546 1.0652 -3.45802 63.546000 Cu 0.914929 0.955853 1.23623e-16 264 63.546 0.0250301 -3.54081 63.546000 Cu 0.816173 0.97218 1.22661e-16 287 63.546 0.0917791 -3.54405 63.546000 Cu 0.900883 0.975154 0.5 289 63.546 0.0609181 -3.52082 63.546000 Cu 0.800507 0.991518 0.5 290 63.546 0.413262 -3.50082