Number of particles = 466 A = 1 Angstrom (basic length-scale) H0(1,1) = 19.4621 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 79.2085 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60362 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 0.0324154 0.0134417 4.35652e-17 234 63.546 1.61522 -3.49519 63.546000 Cu 0.114892 0.00601938 0.5 236 63.546 3.59671 -3.3585 63.546000 Cu 0.0657348 0.0360222 0.5 240 63.546 0.0425977 -3.52704 63.546000 Cu 0.151706 0.0268544 4.1399e-17 242 63.546 0.122756 -3.492 63.546000 Cu 0.234361 0.018883 0.5 244 63.546 0.245971 -3.49897 63.546000 Cu 0.184941 0.0490518 0.5 245 63.546 0.00972592 -3.53055 63.546000 Cu 0.269696 0.0408656 1 243 63.546 0.0253045 -3.53203 63.546000 Cu 0.322286 0.0112955 5.05452e-18 246 63.546 1.40748 -3.48401 63.546000 Cu 0.445934 0.0243329 0 247 63.546 0.177683 -3.47698 63.546000 Cu 0.408564 0.00563245 0.5 248 63.546 6.92559 -3.29692 63.546000 Cu 0.354913 0.0335674 0.5 249 63.546 0.233139 -3.50355 63.546000 Cu 0.391718 0.0538667 1.02535e-16 263 63.546 0.016229 -3.53913 63.546000 Cu 0.479577 0.0446554 0.5 265 63.546 0.0497163 -3.54086 63.546000 Cu 0.614892 0.00601938 0 250 63.546 3.59671 -3.3585 63.546000 Cu 0.532415 0.0134417 0.5 251 63.546 1.61522 -3.49519 63.546000 Cu 0.565735 0.0360222 3.10492e-17 267 63.546 0.0425977 -3.52704 63.546000 Cu 0.684941 0.0490518 1 268 63.546 0.00972592 -3.53055 63.546000 Cu 0.651706 0.0268544 0.5 269 63.546 0.122756 -3.492 63.546000 Cu 0.734361 0.018883 1 271 63.546 0.245971 -3.49897 63.546000 Cu 0.908564 0.00563245 0 233 63.546 6.92559 -3.29692 63.546000 Cu 0.945934 0.0243329 0.5 235 63.546 0.177683 -3.47698 63.546000 Cu 0.979577 0.0446554 1 238 63.546 0.0497163 -3.54086 63.546000 Cu 0.854913 0.0335674 1.16976e-16 272 63.546 0.233139 -3.50355 63.546000 Cu 0.822286 0.0112955 0.5 273 63.546 1.40748 -3.48401 63.546000 Cu 0.769696 0.0408656 0.5 274 63.546 0.0253045 -3.53203 63.546000 Cu 0.891718 0.0538667 0.5 296 63.546 0.016229 -3.53913 63.546000 Cu 0.0997313 0.0572521 0 239 63.546 0.0118562 -3.54074 63.546000 Cu 0.0132049 0.0659475 0.5 241 63.546 0.00546744 -3.53931 63.546000 Cu 0.0473707 0.087217 0 255 63.546 0.00304673 -3.54185 63.546000 Cu 0.167324 0.100302 1 256 63.546 0.00107583 -3.53902 63.546000 Cu 0.13318 0.078854 0.5 257 63.546 0.00135402 -3.53924 63.546000 Cu 0.0814147 0.10864 0.5 258 63.546 0.00039178 -3.54033 63.546000 Cu 0.218898 0.0706374 6.76343e-17 259 63.546 0.00446095 -3.53512 63.546000 Cu 0.339874 0.0834739 0 260 63.546 0.0031465 -3.53839 63.546000 Cu 0.304415 0.0625754 0.5 261 63.546 0.0341088 -3.52304 63.546000 Cu 0.253309 0.0920147 0.5 262 63.546 0.00609093 -3.53486 63.546000 Cu 0.426717 0.0746356 0.5 266 63.546 0.00592388 -3.54348 63.546000 Cu 0.374714 0.104468 0.5 285 63.546 0.000934732 -3.54167 63.546000 Cu 0.461127 0.095817 0 287 63.546 0.00198675 -3.54108 63.546000 Cu 0.513205 0.0659475 4.2121e-17 264 63.546 0.00546744 -3.53931 63.546000 Cu 0.599731 0.0572521 0.5 270 63.546 0.0118562 -3.54074 63.546000 Cu 0.581415 0.10864 0 288 63.546 0.00039178 -3.54033 63.546000 Cu 0.547371 0.087217 0.5 289 63.546 0.00304673 -3.54185 63.546000 Cu 0.63318 0.078854 0 291 63.546 0.00135402 -3.53924 63.546000 Cu 0.718898 0.0706374 0.5 293 63.546 0.00446095 -3.53512 63.546000 Cu 0.667324 0.100302 0.5 294 63.546 0.00107583 -3.53902 63.546000 Cu 0.926717 0.0746356 1.44415e-18 237 63.546 0.00592388 -3.54348 63.546000 Cu 0.961127 0.095817 0.5 253 63.546 0.00198675 -3.54108 63.546000 Cu 0.753309 0.0920147 6.66716e-17 292 63.546 0.00609093 -3.53486 63.546000 Cu 0.804415 0.0625754 0 295 63.546 0.0341088 -3.52304 63.546000 Cu 0.839874 0.0834739 0.5 297 63.546 0.0031465 -3.53839 63.546000 Cu 0.874714 0.104468 0 320 63.546 0.000934732 -3.54167 63.546000 Cu 0.0639104 0.15972 9.02594e-17 276 63.546 7.29276e-05 -3.53939 63.546000 Cu 0.0296226 0.138422 0.5 277 63.546 0.000104943 -3.54032 63.546000 Cu 0.115709 0.130009 6.95599e-17 279 63.546 0.000316671 -3.53946 63.546000 Cu 0.236393 0.142792 1.22753e-17 280 63.546 0.000283378 -3.53888 63.546000 Cu 0.2018 0.121618 0.5 281 63.546 0.00148057 -3.53802 63.546000 Cu 0.150078 0.15128 0.5 282 63.546 0.000372319 -3.53867 63.546000 Cu 0.288156 0.113125 1 283 63.546 0.00102186 -3.53925 63.546000 Cu 0.409166 0.125639 0 284 63.546 0.000711534 -3.54082 63.546000 Cu 0.322778 0.134225 0.5 286 63.546 0.000179819 -3.54024 63.546000 Cu 0.495395 0.117086 0.5 290 63.546 0.000894083 -3.54129 63.546000 Cu 0.270853 0.163955 0.5 306 63.546 3.91795e-05 -3.54038 63.546000 Cu 0.357209 0.15541 2.38285e-17 308 63.546 0.000228279 -3.54083 63.546000 Cu 0.443473 0.146889 0.5 310 63.546 0.00027479 -3.54081 63.546000 Cu 0.529623 0.138422 4.57314e-18 312 63.546 0.000104943 -3.54032 63.546000 Cu 0.650078 0.15128 8.90559e-17 313 63.546 0.000372319 -3.53867 63.546000 Cu 0.615709 0.130009 0.5 314 63.546 0.000316671 -3.53946 63.546000 Cu 0.56391 0.15972 0.5 315 63.546 7.29276e-05 -3.53939 63.546000 Cu 0.7018 0.121618 5.55998e-17 316 63.546 0.00148057 -3.53802 63.546000 Cu 0.736393 0.142792 0.5 319 63.546 0.000283378 -3.53888 63.546000 Cu 0.995395 0.117086 1 252 63.546 0.000894083 -3.54129 63.546000 Cu 0.909166 0.125639 0.5 254 63.546 0.000711534 -3.54082 63.546000 Cu 0.943473 0.146889 1 275 63.546 0.00027479 -3.54081 63.546000 Cu 0.822778 0.134225 7.4133e-17 317 63.546 0.000179819 -3.54024 63.546000 Cu 0.788156 0.113125 0.5 318 63.546 0.00102186 -3.53925 63.546000 Cu 0.770853 0.163955 1 341 63.546 3.91795e-05 -3.54038 63.546000 Cu 0.857209 0.15541 0.5 343 63.546 0.000228279 -3.54083 63.546000 Cu 0.0119883 0.189433 0 300 63.546 1.55974e-05 -3.53958 63.546000 Cu 0.132541 0.2022 1.27085e-16 301 63.546 9.87843e-05 -3.53995 63.546000 Cu 0.0982019 0.180975 0.5 302 63.546 0.000110657 -3.53978 63.546000 Cu 0.0462391 0.210679 0.5 303 63.546 6.10708e-05 -3.53989 63.546000 Cu 0.184515 0.172481 2.84016e-17 304 63.546 7.29134e-05 -3.54 63.546000 Cu 0.218899 0.193686 0.5 307 63.546 5.27247e-05 -3.54024 63.546000 Cu 0.305215 0.185159 1.08311e-17 305 63.546 5.11657e-05 -3.54026 63.546000 Cu 0.477727 0.168172 4.09176e-17 309 63.546 3.74701e-05 -3.53982 63.546000 Cu 0.391522 0.17665 0.5 311 63.546 0.000102511 -3.54015 63.546000 Cu 0.253109 0.214881 0 329 63.546 1.48106e-05 -3.53959 63.546000 Cu 0.33947 0.206372 0.5 331 63.546 8.22696e-05 -3.53973 63.546000 Cu 0.425743 0.197887 1 333 63.546 5.06936e-05 -3.53967 63.546000 Cu 0.459928 0.219144 0.5 336 63.546 9.08396e-06 -3.54003 63.546000 Cu 0.546239 0.210679 3.00865e-17 334 63.546 6.10708e-05 -3.53989 63.546000 Cu 0.511988 0.189433 0.5 335 63.546 1.55974e-05 -3.53958 63.546000 Cu 0.598202 0.180975 8.40014e-17 337 63.546 0.000110657 -3.53978 63.546000 Cu 0.718899 0.193686 1 338 63.546 5.27247e-05 -3.54024 63.546000 Cu 0.684515 0.172481 0.5 339 63.546 7.29134e-05 -3.54 63.546000 Cu 0.632541 0.2022 0.5 340 63.546 9.87843e-05 -3.53995 63.546000 Cu 0.977727 0.168172 0.5 278 63.546 3.74701e-05 -3.53982 63.546000 Cu 0.959928 0.219144 2.21436e-17 298 63.546 9.08396e-06 -3.54003 63.546000 Cu 0.925743 0.197887 0.5 299 63.546 5.06936e-05 -3.53967 63.546000 Cu 0.891522 0.17665 1 342 63.546 0.000102511 -3.54015 63.546000 Cu 0.805215 0.185159 0.5 344 63.546 5.11657e-05 -3.54026 63.546000 Cu 0.753109 0.214881 0.5 364 63.546 1.48106e-05 -3.53959 63.546000 Cu 0.83947 0.206372 0 366 63.546 8.22696e-05 -3.53973 63.546000 Cu 0.028228 0.261617 1 322 63.546 5.08467e-05 -3.54008 63.546000 Cu 0.0803937 0.231907 1.51154e-16 325 63.546 6.07528e-05 -3.5396 63.546000 Cu 0.200932 0.244595 1 326 63.546 8.02411e-06 -3.53991 63.546000 Cu 0.166762 0.223397 0.5 327 63.546 1.11912e-05 -3.53958 63.546000 Cu 0.114556 0.253114 0.5 328 63.546 3.55147e-05 -3.53999 63.546000 Cu 0.148794 0.274309 0 350 63.546 9.85026e-06 -3.54028 63.546000 Cu 0.235151 0.265791 0.5 352 63.546 5.40206e-05 -3.53984 63.546000 Cu 0.373635 0.2276 2.40692e-18 330 63.546 4.49149e-05 -3.54004 63.546000 Cu 0.287285 0.236083 0.5 332 63.546 5.6938e-05 -3.54 63.546000 Cu 0.321501 0.257308 0 354 63.546 6.12855e-05 -3.53977 63.546000 Cu 0.441921 0.270099 1 355 63.546 3.58389e-05 -3.53976 63.546000 Cu 0.407776 0.248847 0.5 356 63.546 3.63696e-06 -3.53982 63.546000 Cu 0.49409 0.240385 2.93644e-17 358 63.546 2.39284e-05 -3.53976 63.546000 Cu 0.614556 0.253114 4.93418e-17 359 63.546 3.55147e-05 -3.53999 63.546000 Cu 0.580394 0.231907 0.5 360 63.546 6.07528e-05 -3.5396 63.546000 Cu 0.528228 0.261617 0.5 361 63.546 5.08467e-05 -3.54008 63.546000 Cu 0.666762 0.223397 1.29011e-16 362 63.546 1.11912e-05 -3.53958 63.546000 Cu 0.700932 0.244595 0.5 365 63.546 8.02411e-06 -3.53991 63.546000 Cu 0.648794 0.274309 0.5 385 63.546 9.85026e-06 -3.54028 63.546000 Cu 0.735151 0.265791 2.31545e-16 387 63.546 5.40206e-05 -3.53984 63.546000 Cu 0.907776 0.248847 9.77208e-17 321 63.546 3.63696e-06 -3.53982 63.546000 Cu 0.99409 0.240385 0.5 323 63.546 2.39284e-05 -3.53976 63.546000 Cu 0.941921 0.270099 0.5 324 63.546 3.58389e-05 -3.53976 63.546000 Cu 0.787285 0.236083 1.0446e-16 363 63.546 5.6938e-05 -3.54 63.546000 Cu 0.873635 0.2276 0.5 367 63.546 4.49149e-05 -3.54004 63.546000 Cu 0.821501 0.257308 0.5 389 63.546 6.12855e-05 -3.53977 63.546000 Cu 0.096619 0.304028 1 347 63.546 3.39879e-05 -3.54003 63.546000 Cu 0.0623729 0.282846 0.5 348 63.546 0.00014581 -3.54033 63.546000 Cu 0.0102368 0.312578 0.5 349 63.546 0.000241108 -3.54032 63.546000 Cu 0.18306 0.295496 0.5 353 63.546 9.37515e-05 -3.5396 63.546000 Cu 0.13097 0.325193 0.5 373 63.546 0.000198278 -3.53976 63.546000 Cu 0.217319 0.316686 0 375 63.546 0.000381462 -3.53921 63.546000 Cu 0.269378 0.287003 0 351 63.546 0.000122798 -3.53936 63.546000 Cu 0.355671 0.278541 0.5 357 63.546 5.21148e-05 -3.53954 63.546000 Cu 0.337723 0.329534 5.05452e-18 376 63.546 6.47724e-05 -3.53983 63.546000 Cu 0.303608 0.308241 0.5 377 63.546 0.000151711 -3.53924 63.546000 Cu 0.389792 0.299816 7.55772e-17 379 63.546 5.37077e-05 -3.53975 63.546000 Cu 0.476064 0.291342 0.5 381 63.546 0.000105369 -3.54009 63.546000 Cu 0.423914 0.321089 0.5 382 63.546 0.000307275 -3.54035 63.546000 Cu 0.510237 0.312578 0 380 63.546 0.000241108 -3.54032 63.546000 Cu 0.562373 0.282846 4.59721e-17 383 63.546 0.00014581 -3.54033 63.546000 Cu 0.68306 0.295496 0 384 63.546 9.37515e-05 -3.5396 63.546000 Cu 0.596619 0.304028 0.5 386 63.546 3.39879e-05 -3.54003 63.546000 Cu 0.63097 0.325193 1 407 63.546 0.000198278 -3.53976 63.546000 Cu 0.717319 0.316686 0.5 409 63.546 0.000381462 -3.53921 63.546000 Cu 0.923914 0.321089 1.33825e-16 345 63.546 0.000307275 -3.54035 63.546000 Cu 0.976064 0.291342 6.81157e-17 346 63.546 0.000105369 -3.54009 63.546000 Cu 0.855671 0.278541 8.27979e-17 388 63.546 5.21148e-05 -3.53954 63.546000 Cu 0.769378 0.287003 0.5 390 63.546 0.000122798 -3.53936 63.546000 Cu 0.803608 0.308241 3.85107e-18 411 63.546 0.000151711 -3.53924 63.546000 Cu 0.889792 0.299816 0.5 412 63.546 5.37077e-05 -3.53975 63.546000 Cu 0.837723 0.329534 0.5 413 63.546 6.47724e-05 -3.53983 63.546000 Cu 0.0444959 0.333761 1 371 63.546 0.000161595 -3.54056 63.546000 Cu 0.165411 0.346365 6.37833e-17 372 63.546 0.00102814 -3.53866 63.546000 Cu 0.0789574 0.354887 0.5 374 63.546 0.000533264 -3.53955 63.546000 Cu 0.0270982 0.38456 0.5 393 63.546 0.00180389 -3.53949 63.546000 Cu 0.113713 0.375985 7.99096e-17 395 63.546 0.00375284 -3.53631 63.546000 Cu 0.199807 0.367631 0.5 397 63.546 0.00105195 -3.53887 63.546000 Cu 0.251598 0.337948 0.5 378 63.546 0.000316008 -3.53924 63.546000 Cu 0.285811 0.359273 1 399 63.546 0.000186234 -3.53927 63.546000 Cu 0.405987 0.372173 9.38697e-18 400 63.546 0.00247013 -3.54156 63.546000 Cu 0.371847 0.350875 0.5 401 63.546 0.000792838 -3.5409 63.546000 Cu 0.319922 0.380698 0.5 402 63.546 0.00169391 -3.54103 63.546000 Cu 0.458097 0.342345 0 403 63.546 0.00070646 -3.54119 63.546000 Cu 0.492456 0.363532 0.5 406 63.546 0.00082863 -3.54154 63.546000 Cu 0.578957 0.354887 4.50093e-17 404 63.546 0.000533264 -3.53955 63.546000 Cu 0.544496 0.333761 0.5 405 63.546 0.000161595 -3.54056 63.546000 Cu 0.665411 0.346365 0.5 410 63.546 0.00102814 -3.53866 63.546000 Cu 0.527098 0.38456 1.4947e-16 428 63.546 0.00180389 -3.53949 63.546000 Cu 0.613713 0.375985 0.5 430 63.546 0.00375284 -3.53631 63.546000 Cu 0.699807 0.367631 4.35652e-17 432 63.546 0.00105195 -3.53887 63.546000 Cu 0.992456 0.363532 1.09274e-16 368 63.546 0.00082863 -3.54154 63.546000 Cu 0.958097 0.342345 0.5 369 63.546 0.00070646 -3.54119 63.546000 Cu 0.905987 0.372173 0.5 370 63.546 0.00247013 -3.54156 63.546000 Cu 0.751598 0.337948 1.79556e-16 408 63.546 0.000316008 -3.53924 63.546000 Cu 0.819922 0.380698 1 433 63.546 0.00169391 -3.54103 63.546000 Cu 0.785811 0.359273 0.5 434 63.546 0.000186234 -3.53927 63.546000 Cu 0.871847 0.350875 0 436 63.546 0.000792838 -3.5409 63.546000 Cu 0.0623411 0.405488 9.2907e-17 392 63.546 0.0172706 -3.5302 63.546000 Cu 0.234085 0.389007 1 396 63.546 0.000900192 -3.5376 63.546000 Cu 0.148234 0.397273 0.5 398 63.546 0.00336657 -3.53713 63.546000 Cu 0.0112651 0.434708 4.98232e-17 416 63.546 0.101735 -3.51416 63.546000 Cu 0.0969403 0.426913 0.5 418 63.546 0.0149107 -3.53762 63.546000 Cu 0.182594 0.418681 1.93035e-16 420 63.546 0.00856314 -3.5289 63.546000 Cu 0.216184 0.44079 0.5 423 63.546 0.029064 -3.51923 63.546000 Cu 0.301282 0.432059 1.02294e-16 421 63.546 0.0246736 -3.53526 63.546000 Cu 0.26786 0.410583 0.5 422 63.546 0.0051541 -3.53882 63.546000 Cu 0.353876 0.402074 0 424 63.546 0.00677905 -3.54154 63.546000 Cu 0.475126 0.414236 2.40692e-18 425 63.546 0.00762219 -3.53943 63.546000 Cu 0.440334 0.393373 0.5 426 63.546 0.00498514 -3.54342 63.546000 Cu 0.387738 0.423377 0.5 427 63.546 0.030439 -3.54335 63.546000 Cu 0.421945 0.44396 1.75705e-17 446 63.546 0.0465841 -3.51388 63.546000 Cu 0.648234 0.397273 0 429 63.546 0.00336657 -3.53713 63.546000 Cu 0.562341 0.405488 0.5 431 63.546 0.0172706 -3.5302 63.546000 Cu 0.734085 0.389007 0.5 435 63.546 0.000900192 -3.5376 63.546000 Cu 0.511265 0.434708 0.5 448 63.546 0.101735 -3.51416 63.546000 Cu 0.59694 0.426913 1.41527e-16 450 63.546 0.0149107 -3.53762 63.546000 Cu 0.716184 0.44079 1.58856e-16 451 63.546 0.029064 -3.51923 63.546000 Cu 0.682594 0.418681 0.5 452 63.546 0.00856314 -3.5289 63.546000 Cu 0.940334 0.393373 0 391 63.546 0.00498514 -3.54342 63.546000 Cu 0.975126 0.414236 0.5 394 63.546 0.00762219 -3.53943 63.546000 Cu 0.76786 0.410583 0 454 63.546 0.0051541 -3.53882 63.546000 Cu 0.887738 0.423377 9.21849e-17 455 63.546 0.030439 -3.54335 63.546000 Cu 0.853876 0.402074 0.5 456 63.546 0.00677905 -3.54154 63.546000 Cu 0.801282 0.432059 0.5 457 63.546 0.0246736 -3.53526 63.546000 Cu 0.921945 0.44396 0.5 415 63.546 0.0465841 -3.51388 63.546000 Cu 0.132039 0.448209 3.46596e-17 417 63.546 0.0883686 -3.51432 63.546000 Cu 0.0444061 0.456574 0.5 419 63.546 0.511146 -3.48109 63.546000 Cu 0.076968 0.4766 5.89694e-17 439 63.546 9.4203 -3.34236 63.546000 Cu 0.201042 0.491313 1.15532e-17 440 63.546 13.0018 -3.32503 63.546000 Cu 0.165065 0.471315 0.5 441 63.546 2.54629 -3.5045 63.546000 Cu 0.010316 0.492867 0.5 438 63.546 7.57423 -3.59814 63.546000 Cu 0.251422 0.462766 6.95599e-17 442 63.546 0.885826 -3.44527 63.546000 Cu 0.367953 0.474842 0 443 63.546 3.24512 -3.46283 63.546000 Cu 0.334459 0.453927 0.5 444 63.546 0.603696 -3.50046 63.546000 Cu 0.291589 0.492662 0.5 445 63.546 9.72529 -3.59623 63.546000 Cu 0.459818 0.463473 0.5 449 63.546 1.80719 -3.40209 63.546000 Cu 0.420861 0.49131 0.5 458 63.546 10.3969 -3.17561 63.546000 Cu 0.510316 0.492867 8.90559e-18 459 63.546 7.57423 -3.59814 63.546000 Cu 0.544406 0.456574 1 447 63.546 0.511146 -3.48109 63.546000 Cu 0.632039 0.448209 0.5 453 63.546 0.0883686 -3.51432 63.546000 Cu 0.576968 0.4766 0.5 460 63.546 9.4203 -3.34236 63.546000 Cu 0.665065 0.471315 1.30696e-16 461 63.546 2.54629 -3.5045 63.546000 Cu 0.701042 0.491313 0.5 464 63.546 13.0018 -3.32503 63.546000 Cu 0.959818 0.463473 0 414 63.546 1.80719 -3.40209 63.546000 Cu 0.791589 0.492662 9.69987e-17 462 63.546 9.72529 -3.59623 63.546000 Cu 0.751422 0.462766 0.5 463 63.546 0.885826 -3.44527 63.546000 Cu 0.834459 0.453927 1 465 63.546 0.603696 -3.50046 63.546000 Cu 0.867953 0.474842 0.5 466 63.546 3.24512 -3.46283 63.546000 Cu 0.920861 0.49131 1 437 63.546 10.3969 -3.17561 63.546000 Cu 0.0527719 0.526419 0.5 3 63.546 0.209869 -3.49676 63.546000 Cu 0.0198279 0.547923 1.42008e-17 16 63.546 0.0489839 -3.52001 63.546000 Cu 0.0865065 0.506386 0 19 63.546 6.23972 -3.33918 63.546000 Cu 0.140698 0.534893 1 20 63.546 0.0980561 -3.51726 63.546000 Cu 0.173149 0.512159 0.5 21 63.546 1.73878 -3.48667 63.546000 Cu 0.225306 0.542248 0.5 25 63.546 0.0208827 -3.52724 63.546000 Cu 0.376478 0.508607 2.16622e-16 4 63.546 1.77458 -3.43574 63.546000 Cu 0.468226 0.518778 0.5 7 63.546 0.646254 -3.45774 63.546000 Cu 0.258991 0.519781 6.81157e-17 22 63.546 0.457712 -3.49 63.546000 Cu 0.310441 0.550699 2.40692e-19 23 63.546 0.0291376 -3.53807 63.546000 Cu 0.342746 0.528968 0.5 24 63.546 0.350336 -3.50667 63.546000 Cu 0.431111 0.538812 3.34561e-17 26 63.546 0.0219441 -3.52889 63.546000 Cu 0.552772 0.526419 4.57314e-18 5 63.546 0.209869 -3.49676 63.546000 Cu 0.586507 0.506386 0.5 6 63.546 6.23972 -3.33918 63.546000 Cu 0.673149 0.512159 1.07348e-16 8 63.546 1.73878 -3.48667 63.546000 Cu 0.725306 0.542248 2.35878e-17 9 63.546 0.0208827 -3.52724 63.546000 Cu 0.640698 0.534893 0.5 11 63.546 0.0980561 -3.51726 63.546000 Cu 0.519828 0.547923 0.5 28 63.546 0.0489839 -3.52001 63.546000 Cu 0.968226 0.518778 0 1 63.546 0.646254 -3.45774 63.546000 Cu 0.876478 0.508607 0.5 2 63.546 1.77458 -3.43574 63.546000 Cu 0.758991 0.519781 0.5 10 63.546 0.457712 -3.49 63.546000 Cu 0.842746 0.528968 1 12 63.546 0.350336 -3.50667 63.546000 Cu 0.931111 0.538812 0.5 14 63.546 0.0219441 -3.52889 63.546000 Cu 0.810441 0.550699 0.5 15 63.546 0.0291376 -3.53807 63.546000 Cu 0.105989 0.556008 0.5 42 63.546 0.0126689 -3.53728 63.546000 Cu 0.0718806 0.577244 1 17 63.546 0.00881706 -3.53326 63.546000 Cu 0.0373733 0.598192 0.5 40 63.546 0.0010022 -3.53944 63.546000 Cu 0.192192 0.564266 1 43 63.546 0.0119661 -3.52894 63.546000 Cu 0.244407 0.593871 1 44 63.546 0.00158336 -3.53678 63.546000 Cu 0.158194 0.585583 0.5 46 63.546 0.00354401 -3.5376 63.546000 Cu 0.124223 0.606784 6.66716e-17 65 63.546 0.00245928 -3.53739 63.546000 Cu 0.484604 0.568517 5.19894e-17 27 63.546 0.00464231 -3.53824 63.546000 Cu 0.397043 0.559412 0.5 29 63.546 0.0280775 -3.54342 63.546000 Cu 0.27771 0.572321 0.5 45 63.546 0.00321146 -3.53791 63.546000 Cu 0.363765 0.580716 1.09996e-16 47 63.546 0.00825761 -3.54222 63.546000 Cu 0.416734 0.610604 1 48 63.546 0.00255602 -3.54134 63.546000 Cu 0.450406 0.589404 0.5 49 63.546 0.00486572 -3.54302 63.546000 Cu 0.330456 0.602142 0.5 50 63.546 0.00114394 -3.54029 63.546000 Cu 0.605989 0.556008 0 30 63.546 0.0126689 -3.53728 63.546000 Cu 0.658194 0.585583 7.55772e-17 31 63.546 0.00354401 -3.5376 63.546000 Cu 0.692192 0.564266 0.5 32 63.546 0.0119661 -3.52894 63.546000 Cu 0.571881 0.577244 0.5 33 63.546 0.00881706 -3.53326 63.546000 Cu 0.744407 0.593871 0.5 37 63.546 0.00158336 -3.53678 63.546000 Cu 0.537373 0.598192 1 51 63.546 0.0010022 -3.53944 63.546000 Cu 0.624223 0.606784 0.5 53 63.546 0.00245928 -3.53739 63.546000 Cu 0.897043 0.559412 0 13 63.546 0.0280775 -3.54342 63.546000 Cu 0.984604 0.568517 0.5 18 63.546 0.00464231 -3.53824 63.546000 Cu 0.77771 0.572321 3.36968e-17 34 63.546 0.00321146 -3.53791 63.546000 Cu 0.830456 0.602142 4.2121e-17 35 63.546 0.00114394 -3.54029 63.546000 Cu 0.863765 0.580716 0.5 36 63.546 0.00825761 -3.54222 63.546000 Cu 0.950406 0.589404 0 38 63.546 0.00486572 -3.54302 63.546000 Cu 0.916734 0.610604 0.5 41 63.546 0.00255602 -3.54134 63.546000 Cu 0.00333777 0.619223 1.14569e-16 39 63.546 0.00100841 -3.5411 63.546000 Cu 0.0560857 0.648975 1.85333e-17 63 63.546 0.000227831 -3.54044 63.546000 Cu 0.176747 0.636397 1 66 63.546 0.000877482 -3.53865 63.546000 Cu 0.210633 0.615183 0.5 67 63.546 0.00119158 -3.53817 63.546000 Cu 0.0900956 0.627863 0.5 68 63.546 0.000286812 -3.53955 63.546000 Cu 0.142719 0.657549 0.5 90 63.546 0.000188624 -3.53964 63.546000 Cu 0.229185 0.66606 1 91 63.546 0.000375812 -3.53933 63.546000 Cu 0.296929 0.623536 1 69 63.546 0.000302734 -3.53852 63.546000 Cu 0.349483 0.653227 1 70 63.546 0.000108985 -3.53958 63.546000 Cu 0.383157 0.631912 0.5 71 63.546 0.000544892 -3.54018 63.546000 Cu 0.263139 0.64482 0.5 72 63.546 0.00032922 -3.539 63.546000 Cu 0.46959 0.640411 0 73 63.546 0.00066581 -3.54057 63.546000 Cu 0.435755 0.661657 0.5 76 63.546 0.000309264 -3.54013 63.546000 Cu 0.590096 0.627863 1.42008e-17 52 63.546 0.000286812 -3.53955 63.546000 Cu 0.503338 0.619223 0.5 54 63.546 0.00100841 -3.5411 63.546000 Cu 0.710633 0.615183 3.10492e-17 55 63.546 0.00119158 -3.53817 63.546000 Cu 0.676747 0.636397 0.5 58 63.546 0.000877482 -3.53865 63.546000 Cu 0.556086 0.648975 0.5 75 63.546 0.000227831 -3.54044 63.546000 Cu 0.642719 0.657549 0 77 63.546 0.000188624 -3.53964 63.546000 Cu 0.729185 0.66606 0.5 79 63.546 0.000375812 -3.53933 63.546000 Cu 0.763139 0.64482 7.22075e-18 56 63.546 0.00032922 -3.539 63.546000 Cu 0.796929 0.623536 0.5 57 63.546 0.000302734 -3.53852 63.546000 Cu 0.883157 0.631912 2.47912e-17 59 63.546 0.000544892 -3.54018 63.546000 Cu 0.935755 0.661657 1.37194e-17 60 63.546 0.000309264 -3.54013 63.546000 Cu 0.96959 0.640411 0.5 61 63.546 0.00066581 -3.54057 63.546000 Cu 0.849483 0.653227 0.5 62 63.546 0.000108985 -3.53958 63.546000 Cu 0.0221728 0.670165 0.5 64 63.546 0.00023848 -3.54049 63.546000 Cu 0.0405301 0.721131 0 86 63.546 5.91705e-05 -3.53964 63.546000 Cu 0.0745054 0.699902 0.5 87 63.546 0.0001241 -3.54071 63.546000 Cu 0.108618 0.678706 0 89 63.546 4.9946e-05 -3.54023 63.546000 Cu 0.195081 0.687243 0.5 94 63.546 6.34389e-05 -3.53986 63.546000 Cu 0.160975 0.708442 0 112 63.546 2.69033e-05 -3.54041 63.546000 Cu 0.247393 0.716949 0.5 114 63.546 5.25092e-05 -3.53992 63.546000 Cu 0.281485 0.695747 0 92 63.546 0.0001426 -3.53952 63.546000 Cu 0.315556 0.674506 0.5 93 63.546 0.00015742 -3.53973 63.546000 Cu 0.401829 0.682937 1 95 63.546 2.68188e-05 -3.54002 63.546000 Cu 0.454137 0.71265 3.99548e-17 96 63.546 5.26362e-05 -3.53945 63.546000 Cu 0.488153 0.691398 0.5 97 63.546 0.000120587 -3.54042 63.546000 Cu 0.367844 0.704204 0.5 98 63.546 5.63819e-05 -3.53927 63.546000 Cu 0.522173 0.670165 2.09402e-17 74 63.546 0.00023848 -3.54049 63.546000 Cu 0.695081 0.687243 5.05452e-18 78 63.546 6.34389e-05 -3.53986 63.546000 Cu 0.608618 0.678706 0.5 80 63.546 4.9946e-05 -3.54023 63.546000 Cu 0.574505 0.699902 0 99 63.546 0.0001241 -3.54071 63.546000 Cu 0.660975 0.708442 0.5 101 63.546 2.69033e-05 -3.54041 63.546000 Cu 0.54053 0.721131 0.5 102 63.546 5.91705e-05 -3.53964 63.546000 Cu 0.747393 0.716949 1 103 63.546 5.25092e-05 -3.53992 63.546000 Cu 0.815556 0.674506 0 81 63.546 0.00015742 -3.53973 63.546000 Cu 0.867844 0.704204 0 82 63.546 5.63819e-05 -3.53927 63.546000 Cu 0.901829 0.682937 0.5 83 63.546 2.68188e-05 -3.54002 63.546000 Cu 0.781485 0.695747 0.5 84 63.546 0.0001426 -3.53952 63.546000 Cu 0.988153 0.691398 1 85 63.546 0.000120587 -3.54042 63.546000 Cu 0.954137 0.71265 0.5 88 63.546 5.26362e-05 -3.53945 63.546000 Cu 0.00662426 0.742351 0.5 109 63.546 7.9269e-05 -3.53972 63.546000 Cu 0.0589551 0.772066 0.5 111 63.546 6.49312e-05 -3.53979 63.546000 Cu 0.213423 0.738161 0 113 63.546 2.76999e-05 -3.53997 63.546000 Cu 0.12695 0.729635 0.5 115 63.546 2.53828e-05 -3.53957 63.546000 Cu 0.0929948 0.750835 0 135 63.546 0.000105992 -3.53971 63.546000 Cu 0.179445 0.759356 0.5 137 63.546 3.03892e-05 -3.53981 63.546000 Cu 0.333836 0.725432 1 116 63.546 3.82274e-05 -3.53964 63.546000 Cu 0.38624 0.755142 0 117 63.546 2.15779e-05 -3.54035 63.546000 Cu 0.420215 0.733893 0.5 118 63.546 9.2077e-06 -3.53966 63.546000 Cu 0.299852 0.74667 0.5 119 63.546 8.1862e-05 -3.54011 63.546000 Cu 0.472598 0.763605 0.5 123 63.546 1.38241e-05 -3.54019 63.546000 Cu 0.265865 0.76788 0 138 63.546 6.05914e-05 -3.53979 63.546000 Cu 0.352267 0.776393 0.5 140 63.546 0.000148227 -3.53967 63.546000 Cu 0.62695 0.729635 5.53591e-18 100 63.546 2.53828e-05 -3.53957 63.546000 Cu 0.713423 0.738161 0.5 106 63.546 2.76999e-05 -3.53997 63.546000 Cu 0.506624 0.742351 0 120 63.546 7.9269e-05 -3.53972 63.546000 Cu 0.558955 0.772066 1 121 63.546 6.49312e-05 -3.53979 63.546000 Cu 0.592995 0.750835 0.5 122 63.546 0.000105992 -3.53971 63.546000 Cu 0.679445 0.759356 0 124 63.546 3.03892e-05 -3.53981 63.546000 Cu 0.799852 0.74667 4.04362e-17 104 63.546 8.1862e-05 -3.54011 63.546000 Cu 0.833836 0.725432 0.5 105 63.546 3.82274e-05 -3.53964 63.546000 Cu 0.920215 0.733893 1 107 63.546 9.2077e-06 -3.53966 63.546000 Cu 0.972598 0.763605 1 108 63.546 1.38241e-05 -3.54019 63.546000 Cu 0.88624 0.755142 0.5 110 63.546 2.15779e-05 -3.54035 63.546000 Cu 0.765865 0.76788 0.5 126 63.546 6.05914e-05 -3.53979 63.546000 Cu 0.852267 0.776393 1.97367e-17 128 63.546 0.000148227 -3.53967 63.546000 Cu 0.0248428 0.793297 1.54043e-17 132 63.546 7.69357e-05 -3.53897 63.546000 Cu 0.0769683 0.823001 6.13764e-17 133 63.546 0.000237177 -3.5397 63.546000 Cu 0.145331 0.780546 0 136 63.546 9.22123e-05 -3.5399 63.546000 Cu 0.231783 0.789075 0.5 141 63.546 3.49227e-05 -3.54009 63.546000 Cu 0.111159 0.801756 0.5 158 63.546 0.000181943 -3.53933 63.546000 Cu 0.197553 0.810256 0 159 63.546 0.000112631 -3.53986 63.546000 Cu 0.163228 0.831445 0.5 162 63.546 0.000585385 -3.53941 63.546000 Cu 0.318197 0.797612 3.61037e-18 139 63.546 0.000159469 -3.54002 63.546000 Cu 0.438563 0.784858 6.64309e-17 142 63.546 2.38884e-05 -3.53906 63.546000 Cu 0.490777 0.81457 1 143 63.546 5.68094e-05 -3.53996 63.546000 Cu 0.404541 0.80611 0.5 145 63.546 0.000183014 -3.54004 63.546000 Cu 0.283995 0.818806 0.5 161 63.546 8.49069e-05 -3.54074 63.546000 Cu 0.370406 0.827378 0 163 63.546 0.000505862 -3.54123 63.546000 Cu 0.731783 0.789075 1 125 63.546 3.49227e-05 -3.54009 63.546000 Cu 0.645331 0.780546 0.5 127 63.546 9.22123e-05 -3.5399 63.546000 Cu 0.524843 0.793297 0.5 144 63.546 7.69357e-05 -3.53897 63.546000 Cu 0.611159 0.801756 0 146 63.546 0.000181943 -3.53933 63.546000 Cu 0.663228 0.831445 1.68484e-18 147 63.546 0.000585385 -3.53941 63.546000 Cu 0.697553 0.810256 0.5 148 63.546 0.000112631 -3.53986 63.546000 Cu 0.576968 0.823001 0.5 149 63.546 0.000237177 -3.5397 63.546000 Cu 0.904541 0.80611 1 129 63.546 0.000183014 -3.54004 63.546000 Cu 0.938563 0.784858 0.5 130 63.546 2.38884e-05 -3.53906 63.546000 Cu 0.818197 0.797612 0.5 131 63.546 0.000159469 -3.54002 63.546000 Cu 0.990777 0.81457 0.5 134 63.546 5.68094e-05 -3.53996 63.546000 Cu 0.783995 0.818806 0 150 63.546 8.49069e-05 -3.54074 63.546000 Cu 0.870406 0.827378 0.5 152 63.546 0.000505862 -3.54123 63.546000 Cu 0.00873897 0.865679 0 155 63.546 0.000815754 -3.54017 63.546000 Cu 0.0428188 0.844318 0.5 156 63.546 7.49051e-05 -3.53976 63.546000 Cu 0.249637 0.839971 0 160 63.546 0.000245745 -3.53979 63.546000 Cu 0.12891 0.85271 1.02294e-16 181 63.546 0.0005389 -3.53906 63.546000 Cu 0.180783 0.882362 1 182 63.546 0.00172538 -3.53869 63.546000 Cu 0.215128 0.861108 0.5 183 63.546 0.00167337 -3.53797 63.546000 Cu 0.0947379 0.874034 0.5 184 63.546 0.00044565 -3.53838 63.546000 Cu 0.422576 0.857173 2.35878e-17 164 63.546 0.00132677 -3.54107 63.546000 Cu 0.456661 0.835887 0.5 165 63.546 0.000373778 -3.54087 63.546000 Cu 0.336124 0.848572 0.5 166 63.546 0.000413431 -3.5411 63.546000 Cu 0.301656 0.869655 0 185 63.546 0.000794167 -3.53949 63.546000 Cu 0.388356 0.878375 0.5 187 63.546 0.0025047 -3.54255 63.546000 Cu 0.474774 0.887014 9.38697e-18 189 63.546 0.00372666 -3.54125 63.546000 Cu 0.749637 0.839971 0.5 153 63.546 0.000245745 -3.53979 63.546000 Cu 0.542819 0.844318 0 167 63.546 7.49051e-05 -3.53976 63.546000 Cu 0.594738 0.874034 8.42421e-17 168 63.546 0.00044565 -3.53838 63.546000 Cu 0.62891 0.85271 0.5 169 63.546 0.0005389 -3.53906 63.546000 Cu 0.508739 0.865679 0.5 170 63.546 0.000815754 -3.54017 63.546000 Cu 0.715128 0.861108 0 171 63.546 0.00167337 -3.53797 63.546000 Cu 0.680783 0.882362 0.5 174 63.546 0.00172538 -3.53869 63.546000 Cu 0.836124 0.848572 1 151 63.546 0.000413431 -3.5411 63.546000 Cu 0.956661 0.835887 4.26024e-17 154 63.546 0.000373778 -3.54087 63.546000 Cu 0.922576 0.857173 0.5 157 63.546 0.00132677 -3.54107 63.546000 Cu 0.801656 0.869655 0.5 173 63.546 0.000794167 -3.53949 63.546000 Cu 0.888356 0.878375 0 175 63.546 0.0025047 -3.54255 63.546000 Cu 0.974774 0.887014 0.5 177 63.546 0.00372666 -3.54125 63.546000 Cu 0.0609187 0.895497 6.13764e-17 179 63.546 0.00186689 -3.53965 63.546000 Cu 0.027375 0.916921 0.5 180 63.546 0.0119289 -3.53942 63.546000 Cu 0.113347 0.925422 2.16622e-17 205 63.546 0.00746183 -3.53637 63.546000 Cu 0.146684 0.903716 0.5 206 63.546 0.00278721 -3.53505 63.546000 Cu 0.232729 0.911977 0 207 63.546 0.00521076 -3.53608 63.546000 Cu 0.198514 0.933243 0.5 210 63.546 0.0235834 -3.52449 63.546000 Cu 0.353806 0.89932 2.40692e-19 186 63.546 0.00305374 -3.53906 63.546000 Cu 0.266939 0.890693 0.5 188 63.546 0.00620803 -3.53523 63.546000 Cu 0.440953 0.908297 0.5 192 63.546 0.0165522 -3.54497 63.546000 Cu 0.284583 0.941667 0 208 63.546 0.0304564 -3.51865 63.546000 Cu 0.318541 0.920131 0.5 209 63.546 0.0301003 -3.52247 63.546000 Cu 0.406345 0.928961 1.39601e-17 211 63.546 0.0180838 -3.53693 63.546000 Cu 0.494762 0.938533 0.5 213 63.546 0.155686 -3.52854 63.546000 Cu 0.527375 0.916921 0 190 63.546 0.0119289 -3.53942 63.546000 Cu 0.560919 0.895497 0.5 191 63.546 0.00186689 -3.53965 63.546000 Cu 0.646684 0.903716 0 193 63.546 0.00278721 -3.53505 63.546000 Cu 0.698514 0.933243 1 194 63.546 0.0235834 -3.52449 63.546000 Cu 0.732729 0.911977 0.5 195 63.546 0.00521076 -3.53608 63.546000 Cu 0.613347 0.925422 0.5 196 63.546 0.00746183 -3.53637 63.546000 Cu 0.766939 0.890693 0 172 63.546 0.00620803 -3.53523 63.546000 Cu 0.940953 0.908297 6.13764e-17 176 63.546 0.0165522 -3.54497 63.546000 Cu 0.853806 0.89932 0.5 178 63.546 0.00305374 -3.53906 63.546000 Cu 0.818541 0.920131 0 197 63.546 0.0301003 -3.52247 63.546000 Cu 0.906345 0.928961 0.5 199 63.546 0.0180838 -3.53693 63.546000 Cu 0.784583 0.941667 0.5 200 63.546 0.0304564 -3.51865 63.546000 Cu 0.994762 0.938533 1 201 63.546 0.155686 -3.52854 63.546000 Cu 0.0484015 0.971695 1 202 63.546 4.63599 -3.54542 63.546000 Cu 0.0797143 0.947191 0.5 203 63.546 0.150674 -3.51578 63.546000 Cu 0.165817 0.95547 1 225 63.546 0.642851 -3.46891 63.546000 Cu 0.198426 0.99363 1 226 63.546 8.03464 -3.57721 63.546000 Cu 0.249843 0.962741 0.5 227 63.546 1.52556 -3.42011 63.546000 Cu 0.134753 0.976286 0.5 228 63.546 11.7921 -3.31192 63.546000 Cu 0.461291 0.958665 1 212 63.546 0.565491 -3.45066 63.546000 Cu 0.369762 0.949159 0.5 214 63.546 0.262916 -3.49302 63.546000 Cu 0.33541 0.972202 1.74501e-16 229 63.546 2.9985 -3.52449 63.546000 Cu 0.421866 0.976848 0.5 230 63.546 8.71972 -3.23774 63.546000 Cu 0.292455 0.991203 0.5 231 63.546 11.4701 -3.33325 63.546000 Cu 0.493687 0.99194 0 232 63.546 8.33958 -3.53999 63.546000 Cu 0.579714 0.947191 3.00865e-17 215 63.546 0.150674 -3.51578 63.546000 Cu 0.634753 0.976286 1.78112e-17 216 63.546 11.7921 -3.31192 63.546000 Cu 0.665817 0.95547 0.5 217 63.546 0.642851 -3.46891 63.546000 Cu 0.548401 0.971695 0.5 218 63.546 4.63599 -3.54542 63.546000 Cu 0.749843 0.962741 1 219 63.546 1.52556 -3.42011 63.546000 Cu 0.698426 0.99363 0.5 222 63.546 8.03464 -3.57721 63.546000 Cu 0.993687 0.99194 0.5 224 63.546 8.33958 -3.53999 63.546000 Cu 0.869762 0.949159 1 198 63.546 0.262916 -3.49302 63.546000 Cu 0.961291 0.958665 0.5 204 63.546 0.565491 -3.45066 63.546000 Cu 0.792455 0.991203 8.47235e-17 220 63.546 11.4701 -3.33325 63.546000 Cu 0.83541 0.972202 0.5 221 63.546 2.9985 -3.52449 63.546000 Cu 0.921866 0.976848 6.49867e-18 223 63.546 8.71972 -3.23774