Number of particles = 458 A = 1 Angstrom (basic length-scale) H0(1,1) = 19.3043 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.3982 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.58777 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 0.109803 0.023871 1.25229e-16 248 63.546 7.33774 -3.31825 63.546000 Cu 0.0239901 0.030015 0.5 250 63.546 1.1095 -3.43557 63.546000 Cu 0.191147 0.0124907 0.5 252 63.546 6.9639 -3.43389 63.546000 Cu 0.144159 0.0444682 0.5 266 63.546 0.0790058 -3.48953 63.546000 Cu 0.277952 0.00824655 1 251 63.546 9.35058 -3.1857 63.546000 Cu 0.228997 0.0363944 1 268 63.546 0.256403 -3.45414 63.546000 Cu 0.318935 0.0264672 0.5 270 63.546 0.651877 -3.43937 63.546000 Cu 0.405319 0.0136733 1.24504e-17 272 63.546 5.58141 -3.43083 63.546000 Cu 0.524012 0.0300055 4.21258e-16 273 63.546 1.11021 -3.43558 63.546000 Cu 0.496026 0.00844047 0.5 274 63.546 12.0913 -3.3038 63.546000 Cu 0.438947 0.0379336 0.5 275 63.546 0.14225 -3.48595 63.546000 Cu 0.691151 0.0124939 6.04025e-16 235 63.546 6.96286 -3.43393 63.546000 Cu 0.609822 0.0238717 0.5 236 63.546 5.79028 -3.31805 63.546000 Cu 0.777954 0.00825778 0.5 237 63.546 9.35004 -3.18553 63.546000 Cu 0.644168 0.0444699 1 239 63.546 0.0790679 -3.48951 63.546000 Cu 0.728997 0.0364044 0.5 241 63.546 0.25675 -3.45405 63.546000 Cu 0.818919 0.0264809 1 243 63.546 0.65135 -3.4394 63.546000 Cu 0.938926 0.037946 1 244 63.546 0.141947 -3.48596 63.546000 Cu 0.905307 0.0136861 0.5 245 63.546 5.5789 -3.43075 63.546000 Cu 0.996003 0.00844752 3.3604e-16 247 63.546 12.0867 -3.30379 63.546000 Cu 0.00628408 0.0826574 1 261 63.546 0.00850546 -3.50692 63.546000 Cu 0.0569946 0.0527623 8.46143e-19 264 63.546 0.0580892 -3.49847 63.546000 Cu 0.178443 0.0658986 1.59317e-16 265 63.546 0.0223947 -3.50585 63.546000 Cu 0.0921084 0.0743187 0.5 267 63.546 0.012176 -3.50881 63.546000 Cu 0.35375 0.046943 2.64843e-16 269 63.546 0.138337 -3.50289 63.546000 Cu 0.266501 0.0567725 0.5 271 63.546 0.0192046 -3.50192 63.546000 Cu 0.214042 0.0869047 0.5 290 63.546 0.00273121 -3.51097 63.546000 Cu 0.301052 0.0777924 1 292 63.546 0.0170435 -3.5137 63.546000 Cu 0.387354 0.0688337 0.5 294 63.546 0.0260131 -3.51259 63.546000 Cu 0.592127 0.0743171 1.64998e-16 238 63.546 0.0120794 -3.50877 63.546000 Cu 0.420879 0.0908562 4.82664e-16 293 63.546 0.00278396 -3.51053 63.546000 Cu 0.4724 0.0604552 6.90453e-16 296 63.546 0.0083315 -3.50291 63.546000 Cu 0.557014 0.0527567 0.5 297 63.546 0.0579712 -3.49836 63.546000 Cu 0.506316 0.0826464 0.5 298 63.546 0.00837162 -3.50686 63.546000 Cu 0.766487 0.0567874 1 240 63.546 0.0192975 -3.50196 63.546000 Cu 0.678445 0.0659064 0.5 242 63.546 0.0224254 -3.50585 63.546000 Cu 0.714033 0.0869194 0 256 63.546 0.0027737 -3.51098 63.546000 Cu 0.85373 0.0469598 0.5 246 63.546 0.137807 -3.50287 63.546000 Cu 0.801028 0.0778124 0.5 258 63.546 0.0168039 -3.5137 63.546000 Cu 0.887324 0.0688527 3.35315e-16 260 63.546 0.0256639 -3.51256 63.546000 Cu 0.972371 0.0604693 0.5 262 63.546 0.00828276 -3.50294 63.546000 Cu 0.920839 0.0908757 0.5 263 63.546 0.00270506 -3.51054 63.546000 Cu 0.0756353 0.125811 1 285 63.546 0.00142306 -3.51041 63.546000 Cu 0.0408913 0.104324 0.5 286 63.546 0.00432977 -3.50938 63.546000 Cu 0.12714 0.0957691 4.92818e-16 288 63.546 0.00499099 -3.50929 63.546000 Cu 0.162198 0.117061 0.5 291 63.546 0.000590022 -3.51123 63.546000 Cu 0.248793 0.108198 1 289 63.546 0.00355124 -3.51303 63.546000 Cu 0.335155 0.0993828 0.5 295 63.546 0.00715637 -3.51341 63.546000 Cu 0.283131 0.129761 0.5 315 63.546 0.00175185 -3.51265 63.546000 Cu 0.369152 0.121166 1 317 63.546 0.000855612 -3.51169 63.546000 Cu 0.575652 0.125814 0.5 255 63.546 0.00140223 -3.51041 63.546000 Cu 0.489441 0.13439 7.55969e-16 318 63.546 0.001226 -3.51021 63.546000 Cu 0.454979 0.112737 0.5 319 63.546 0.00150794 -3.50992 63.546000 Cu 0.54092 0.104318 4.39874e-16 321 63.546 0.00423498 -3.50934 63.546000 Cu 0.662194 0.117075 8.75154e-16 253 63.546 0.000613957 -3.51124 63.546000 Cu 0.627151 0.0957743 0.5 254 63.546 0.00498219 -3.50927 63.546000 Cu 0.74877 0.10822 0.5 259 63.546 0.0034449 -3.51303 63.546000 Cu 0.783093 0.12979 7.53068e-17 280 63.546 0.00159947 -3.51266 63.546000 Cu 0.835118 0.0994066 1 257 63.546 0.00690523 -3.51339 63.546000 Cu 0.869108 0.121192 0.5 282 63.546 0.000782676 -3.51171 63.546000 Cu 0.954938 0.112754 1 284 63.546 0.00159448 -3.50996 63.546000 Cu 0.989407 0.134401 0.5 287 63.546 0.00130517 -3.51023 63.546000 Cu 0.0240622 0.155931 1 309 63.546 0.000410151 -3.51096 63.546000 Cu 0.145041 0.168744 1.20878e-19 310 63.546 0.000226999 -3.51192 63.546000 Cu 0.110435 0.147242 0.5 311 63.546 0.000156599 -3.51156 63.546000 Cu 0.0587225 0.177444 0.5 312 63.546 7.85484e-05 -3.51146 63.546000 Cu 0.196805 0.138487 6.98673e-17 313 63.546 0.000867384 -3.51228 63.546000 Cu 0.317379 0.151436 6.14784e-16 314 63.546 0.000212398 -3.51173 63.546000 Cu 0.2313 0.160057 0.5 316 63.546 0.000466029 -3.51204 63.546000 Cu 0.265687 0.181687 6.87068e-16 338 63.546 0.000116706 -3.51168 63.546000 Cu 0.351801 0.173089 0.5 340 63.546 7.7324e-05 -3.51128 63.546000 Cu 0.40341 0.142892 0.5 320 63.546 0.000299775 -3.51084 63.546000 Cu 0.437891 0.164517 2.05492e-16 342 63.546 0.000228439 -3.51083 63.546000 Cu 0.558722 0.177459 2.79832e-16 343 63.546 8.70584e-05 -3.51147 63.546000 Cu 0.524083 0.155932 0.5 344 63.546 0.000398483 -3.51096 63.546000 Cu 0.610433 0.147258 1 276 63.546 0.000168268 -3.51158 63.546000 Cu 0.73126 0.160092 1.41427e-17 277 63.546 0.000377301 -3.51204 63.546000 Cu 0.696782 0.138513 0.5 278 63.546 0.000801777 -3.5123 63.546000 Cu 0.645017 0.168773 0.5 279 63.546 0.000189505 -3.51192 63.546000 Cu 0.765633 0.181726 0.5 303 63.546 9.56026e-05 -3.51167 63.546000 Cu 0.903366 0.142916 5.19774e-17 281 63.546 0.000344719 -3.51087 63.546000 Cu 0.817332 0.151469 0.5 283 63.546 0.000168022 -3.51174 63.546000 Cu 0.85175 0.17312 1.88448e-16 305 63.546 9.64765e-05 -3.51129 63.546000 Cu 0.937852 0.164533 0.5 307 63.546 0.00027055 -3.51086 63.546000 Cu 0.00725884 0.207665 0.5 332 63.546 3.58796e-05 -3.51154 63.546000 Cu 0.0934053 0.198993 2.23624e-17 334 63.546 8.24148e-05 -3.51182 63.546000 Cu 0.179537 0.190318 0.5 336 63.546 0.000218588 -3.5119 63.546000 Cu 0.128146 0.220592 0.5 337 63.546 1.25268e-05 -3.51184 63.546000 Cu 0.214245 0.211938 1 335 63.546 3.40453e-05 -3.51174 63.546000 Cu 0.386406 0.194709 1 339 63.546 6.55749e-05 -3.51129 63.546000 Cu 0.300306 0.203312 0.5 341 63.546 5.46178e-05 -3.51152 63.546000 Cu 0.3351 0.224925 5.09016e-16 363 63.546 3.20463e-06 -3.51138 63.546000 Cu 0.593378 0.199022 0.5 300 63.546 6.54108e-05 -3.51183 63.546000 Cu 0.472534 0.186101 0.5 345 63.546 9.48547e-05 -3.51115 63.546000 Cu 0.421167 0.216303 0.5 365 63.546 1.80568e-05 -3.51142 63.546000 Cu 0.507259 0.207678 3.37611e-16 367 63.546 3.32239e-05 -3.51156 63.546000 Cu 0.628101 0.220629 4.7928e-16 299 63.546 1.0323e-05 -3.51182 63.546000 Cu 0.679491 0.190357 9.03077e-16 301 63.546 0.000177515 -3.51189 63.546000 Cu 0.714187 0.21198 0.5 304 63.546 2.76292e-05 -3.51171 63.546000 Cu 0.800246 0.203348 1.55086e-16 302 63.546 7.21717e-05 -3.5115 63.546000 Cu 0.97251 0.186104 1 306 63.546 0.000103255 -3.51115 63.546000 Cu 0.886358 0.194731 0.5 308 63.546 9.49352e-05 -3.51128 63.546000 Cu 0.835055 0.224951 0.5 328 63.546 3.61599e-06 -3.51139 63.546000 Cu 0.92114 0.216309 3.12348e-16 330 63.546 2.59599e-05 -3.51142 63.546000 Cu 0.0420499 0.229256 1 331 63.546 6.41746e-06 -3.51182 63.546000 Cu 0.111645 0.272459 1 356 63.546 1.34429e-05 -3.51168 63.546000 Cu 0.0768479 0.250863 0.5 357 63.546 4.53019e-06 -3.51173 63.546000 Cu 0.162952 0.24219 3.53688e-16 359 63.546 2.00828e-05 -3.51155 63.546000 Cu 0.197755 0.263793 0.5 362 63.546 5.04371e-05 -3.51151 63.546000 Cu 0.283818 0.255158 1 360 63.546 3.04167e-05 -3.51141 63.546000 Cu 0.24903 0.233547 0.5 361 63.546 1.60237e-05 -3.51137 63.546000 Cu 0.369868 0.246542 0.5 366 63.546 6.12334e-06 -3.51148 63.546000 Cu 0.576797 0.250888 3.8149e-16 322 63.546 1.20433e-05 -3.51167 63.546000 Cu 0.455934 0.237922 5.45037e-16 364 63.546 1.21942e-05 -3.51167 63.546000 Cu 0.54202 0.229281 0.5 368 63.546 9.29841e-06 -3.51178 63.546000 Cu 0.404622 0.268178 1 388 63.546 2.17298e-05 -3.51156 63.546000 Cu 0.490698 0.259544 0.5 390 63.546 3.86053e-05 -3.5117 63.546000 Cu 0.697725 0.263823 0 323 63.546 2.63428e-05 -3.51149 63.546000 Cu 0.662902 0.242226 0.5 324 63.546 7.3399e-06 -3.51151 63.546000 Cu 0.61162 0.27248 0.5 325 63.546 6.14657e-06 -3.51165 63.546000 Cu 0.74898 0.233585 2.24953e-16 326 63.546 3.0707e-06 -3.51135 63.546000 Cu 0.783799 0.255187 0.5 329 63.546 1.5376e-05 -3.51141 63.546000 Cu 0.869866 0.246558 5.51202e-17 327 63.546 8.02046e-06 -3.51153 63.546000 Cu 0.955948 0.237916 0.5 333 63.546 1.01767e-05 -3.51173 63.546000 Cu 0.904648 0.268184 0.5 353 63.546 1.93805e-05 -3.51157 63.546000 Cu 0.990736 0.259535 4.69005e-17 355 63.546 2.66395e-05 -3.51175 63.546000 Cu 0.025496 0.281143 0.5 358 63.546 1.82327e-05 -3.51173 63.546000 Cu 0.0602511 0.30274 1 380 63.546 7.69277e-06 -3.51173 63.546000 Cu 0.181191 0.315662 1 381 63.546 8.15339e-05 -3.51134 63.546000 Cu 0.146422 0.29406 0.5 382 63.546 4.00763e-05 -3.51161 63.546000 Cu 0.232527 0.285412 3.28787e-16 384 63.546 4.09632e-05 -3.51147 63.546000 Cu 0.353322 0.298431 5.93509e-17 385 63.546 1.1295e-05 -3.51137 63.546000 Cu 0.318591 0.276791 0.5 386 63.546 7.0735e-06 -3.51144 63.546000 Cu 0.267276 0.307038 0.5 387 63.546 2.6413e-05 -3.51131 63.546000 Cu 0.525485 0.281151 1 389 63.546 2.57614e-05 -3.51172 63.546000 Cu 0.439369 0.289807 0.5 391 63.546 6.78953e-05 -3.51156 63.546000 Cu 0.474154 0.311415 1 412 63.546 6.83834e-05 -3.51173 63.546000 Cu 0.560282 0.302742 0.5 413 63.546 1.02895e-05 -3.51165 63.546000 Cu 0.646446 0.294072 8.98362e-16 347 63.546 3.77636e-05 -3.51152 63.546000 Cu 0.767302 0.307052 1 348 63.546 5.55114e-05 -3.51128 63.546000 Cu 0.732549 0.285431 0.5 349 63.546 4.0846e-05 -3.51138 63.546000 Cu 0.681243 0.31567 0.5 350 63.546 0.000122063 -3.51123 63.546000 Cu 0.818604 0.276809 4.2005e-16 351 63.546 1.12057e-05 -3.5114 63.546000 Cu 0.93938 0.289811 0 352 63.546 5.88355e-05 -3.51154 63.546000 Cu 0.853342 0.298442 0.5 354 63.546 1.87068e-05 -3.51137 63.546000 Cu 0.974112 0.311426 0.5 378 63.546 7.07004e-05 -3.51177 63.546000 Cu 0.00884575 0.333027 3.38699e-16 377 63.546 8.37227e-05 -3.51194 63.546000 Cu 0.0950505 0.324322 0.5 383 63.546 5.09491e-05 -3.51162 63.546000 Cu 0.0436851 0.354581 0.5 402 63.546 0.000118988 -3.51153 63.546000 Cu 0.129909 0.345897 1.5702e-16 404 63.546 0.000264882 -3.5112 63.546000 Cu 0.250743 0.358933 1 405 63.546 7.44177e-05 -3.51127 63.546000 Cu 0.215976 0.337278 0.5 406 63.546 0.000105028 -3.51118 63.546000 Cu 0.302008 0.328678 1 408 63.546 8.7266e-06 -3.5114 63.546000 Cu 0.388044 0.320066 0.5 410 63.546 9.30259e-05 -3.51161 63.546000 Cu 0.33676 0.35034 0.5 411 63.546 0.000175045 -3.51185 63.546000 Cu 0.595148 0.324314 2.60854e-16 346 63.546 7.51845e-05 -3.51144 63.546000 Cu 0.422817 0.341691 1 409 63.546 0.000264174 -3.51202 63.546000 Cu 0.508977 0.332999 0.5 414 63.546 4.87552e-05 -3.51183 63.546000 Cu 0.45769 0.363265 0.5 435 63.546 0.00025791 -3.51213 63.546000 Cu 0.543918 0.354541 1 437 63.546 0.00019044 -3.51146 63.546000 Cu 0.630052 0.345894 0.5 370 63.546 0.000372016 -3.51106 63.546000 Cu 0.716056 0.337299 1.32965e-18 372 63.546 0.000180788 -3.51112 63.546000 Cu 0.750778 0.35899 0.5 375 63.546 0.000116788 -3.51108 63.546000 Cu 0.836677 0.350401 3.56589e-17 373 63.546 0.000274489 -3.5118 63.546000 Cu 0.801995 0.328713 0.5 374 63.546 3.77158e-05 -3.51143 63.546000 Cu 0.888008 0.320091 1 376 63.546 0.000105996 -3.51173 63.546000 Cu 0.9227 0.341738 0.5 379 63.546 0.000319944 -3.51207 63.546000 Cu 0.957478 0.363331 5.58575e-16 400 63.546 0.00035482 -3.51214 63.546000 Cu 0.0786636 0.376095 1 401 63.546 0.000980991 -3.51059 63.546000 Cu 0.164748 0.367493 0.5 407 63.546 0.000540702 -3.51068 63.546000 Cu 0.0275373 0.406233 2.34986e-16 425 63.546 0.00413554 -3.50953 63.546000 Cu 0.113565 0.397672 0.5 427 63.546 0.00210255 -3.50988 63.546000 Cu 0.199456 0.389174 1 429 63.546 0.000486106 -3.5107 63.546000 Cu 0.319777 0.40236 1 430 63.546 0.00359802 -3.51306 63.546000 Cu 0.285349 0.380637 0.5 431 63.546 0.000551788 -3.51184 63.546000 Cu 0.371439 0.371993 3.18271e-16 433 63.546 0.000914415 -3.51244 63.546000 Cu 0.578932 0.37607 0.5 371 63.546 0.00135599 -3.5105 63.546000 Cu 0.492591 0.384745 1 434 63.546 0.000533703 -3.51124 63.546000 Cu 0.406127 0.393552 0.5 436 63.546 0.00138794 -3.5127 63.546000 Cu 0.527712 0.406159 0.5 457 63.546 0.00499454 -3.50948 63.546000 Cu 0.664921 0.367519 1 369 63.546 0.000643023 -3.51053 63.546000 Cu 0.613747 0.39768 1.23295e-16 392 63.546 0.0023365 -3.50978 63.546000 Cu 0.699588 0.389242 0.5 394 63.546 0.000596106 -3.51056 63.546000 Cu 0.78535 0.380734 2.46953e-16 396 63.546 0.000756577 -3.5116 63.546000 Cu 0.905976 0.393678 8.40946e-16 397 63.546 0.00186211 -3.5128 63.546000 Cu 0.871277 0.372089 0.5 398 63.546 0.00125456 -3.51238 63.546000 Cu 0.819724 0.402505 0.5 399 63.546 0.00443219 -3.51303 63.546000 Cu 0.992347 0.384829 0.5 403 63.546 0.000416706 -3.51131 63.546000 Cu 0.148321 0.419406 1 426 63.546 0.00254648 -3.50922 63.546000 Cu 0.0626219 0.427803 0.5 428 63.546 0.00682567 -3.50886 63.546000 Cu 0.0975029 0.449545 1.25108e-16 447 63.546 0.0160824 -3.50452 63.546000 Cu 0.182518 0.44146 0.5 449 63.546 0.00502877 -3.50768 63.546000 Cu 0.233888 0.411 0.5 432 63.546 0.00179179 -3.51135 63.546000 Cu 0.26803 0.432883 1 451 63.546 0.0132913 -3.51351 63.546000 Cu 0.389357 0.445085 3.74721e-18 452 63.546 0.0127985 -3.50706 63.546000 Cu 0.3543 0.42394 0.5 453 63.546 0.00828581 -3.51363 63.546000 Cu 0.59742 0.449549 0.5 416 63.546 0.0175224 -3.50363 63.546000 Cu 0.441063 0.414919 5.12763e-16 455 63.546 0.00209692 -3.51101 63.546000 Cu 0.562684 0.427765 1 456 63.546 0.00740845 -3.50873 63.546000 Cu 0.476675 0.436107 0.5 458 63.546 0.0210699 -3.5057 63.546000 Cu 0.733902 0.411117 1.51943e-16 393 63.546 0.00217573 -3.51124 63.546000 Cu 0.648365 0.419459 0.5 395 63.546 0.00266772 -3.50897 63.546000 Cu 0.682354 0.441562 2.05492e-18 417 63.546 0.00588887 -3.50745 63.546000 Cu 0.767902 0.433042 0.5 419 63.546 0.0149306 -3.51362 63.546000 Cu 0.854158 0.424126 1.20878e-19 421 63.546 0.0105471 -3.51364 63.546000 Cu 0.976591 0.436228 1.3091e-16 422 63.546 0.0196752 -3.50552 63.546000 Cu 0.940922 0.415068 0.5 423 63.546 0.00195737 -3.51108 63.546000 Cu 0.88918 0.445268 0.5 424 63.546 0.012925 -3.50685 63.546000 Cu 0.162553 0.493475 1 233 63.546 11.3578 -3.28729 63.546000 Cu 0.0465978 0.479255 6.76431e-16 444 63.546 1.60439 -3.37018 63.546000 Cu 0.0115596 0.457845 0.5 445 63.546 0.0266638 -3.49697 63.546000 Cu 0.1312 0.472083 0.5 450 63.546 0.578772 -3.44191 63.546000 Cu 0.302177 0.454619 0.5 454 63.546 0.0687816 -3.51034 63.546000 Cu 0.375582 0.493928 0.5 18 63.546 8.69001 -3.22379 63.546000 Cu 0.33661 0.47522 1 225 63.546 0.34339 -3.45035 63.546000 Cu 0.250626 0.48685 0.5 232 63.546 3.45616 -3.42304 63.546000 Cu 0.216341 0.46363 4.89071e-16 448 63.546 0.0620466 -3.49425 63.546000 Cu 0.546361 0.479182 0.5 2 63.546 1.73646 -3.36505 63.546000 Cu 0.511526 0.457773 9.61098e-16 4 63.546 0.0292411 -3.49673 63.546000 Cu 0.42671 0.465725 0.5 21 63.546 0.171887 -3.47375 63.546000 Cu 0.462321 0.488707 1 221 63.546 2.91347 -3.42112 63.546000 Cu 0.630958 0.472162 2.44898e-16 415 63.546 0.614804 -3.44077 63.546000 Cu 0.715972 0.463787 0.5 420 63.546 0.0674915 -3.49383 63.546000 Cu 0.66189 0.493624 0.5 439 63.546 11.2758 -3.29014 63.546000 Cu 0.750101 0.487069 5.74531e-16 440 63.546 3.52241 -3.42382 63.546000 Cu 0.801894 0.454818 1 418 63.546 0.0767803 -3.50997 63.546000 Cu 0.875317 0.494074 1 441 63.546 8.6674 -3.2238 63.546000 Cu 0.836164 0.475397 0.5 442 63.546 0.34903 -3.44932 63.546000 Cu 0.926588 0.465853 1 443 63.546 0.168866 -3.47491 63.546000 Cu 0.962162 0.488709 0.5 446 63.546 2.86197 -3.42211 63.546000 Cu 0.00315903 0.50838 1 7 63.546 10.9325 -3.30279 63.546000 Cu 0.0612809 0.536722 6.64585e-16 8 63.546 0.196557 -3.47109 63.546000 Cu 0.0953997 0.511349 0.5 9 63.546 8.31642 -3.41336 63.546000 Cu 0.180783 0.523987 1 11 63.546 10.3924 -3.30778 63.546000 Cu 0.144999 0.545069 0.5 14 63.546 0.0871977 -3.47813 63.546000 Cu 0.301154 0.508868 1 1 63.546 8.98629 -3.43455 63.546000 Cu 0.388024 0.5234 0.5 3 63.546 8.81733 -3.23684 63.546000 Cu 0.265281 0.531606 0.5 13 63.546 1.87508 -3.41858 63.546000 Cu 0.350955 0.542325 2.14074e-16 15 63.546 0.191636 -3.45324 63.546000 Cu 0.475053 0.529149 3.62633e-19 19 63.546 1.40642 -3.43705 63.546000 Cu 0.503994 0.508374 0.5 20 63.546 10.8088 -3.30515 63.546000 Cu 0.561364 0.536864 0.5 24 63.546 0.177741 -3.47235 63.546000 Cu 0.595912 0.511624 3.35919e-16 438 63.546 8.22378 -3.41275 63.546000 Cu 0.680744 0.524155 0.5 23 63.546 10.4099 -3.31015 63.546000 Cu 0.764976 0.531817 1 25 63.546 1.86787 -3.41815 63.546000 Cu 0.644898 0.545266 2.30876e-17 22 63.546 0.0833658 -3.47922 63.546000 Cu 0.887427 0.52349 1 5 63.546 8.81009 -3.23393 63.546000 Cu 0.800792 0.509029 0.5 6 63.546 8.98877 -3.43532 63.546000 Cu 0.974596 0.52914 0.5 10 63.546 1.44651 -3.43651 63.546000 Cu 0.850651 0.542467 0.5 27 63.546 0.19756 -3.45362 63.546000 Cu 0.0265809 0.559163 0.5 31 63.546 0.0154128 -3.49959 63.546000 Cu 0.111408 0.567298 5.99553e-16 33 63.546 0.00643027 -3.50935 63.546000 Cu 0.196882 0.575831 0.5 35 63.546 0.00589762 -3.51081 63.546000 Cu 0.0773913 0.589362 0.5 36 63.546 0.00337907 -3.50884 63.546000 Cu 0.230899 0.55414 1.49888e-17 12 63.546 0.022539 -3.49931 63.546000 Cu 0.317489 0.563038 0.5 17 63.546 0.0308546 -3.51397 63.546000 Cu 0.283162 0.5846 1 37 63.546 0.00534289 -3.51362 63.546000 Cu 0.404737 0.572296 3.29754e-16 16 63.546 0.0118409 -3.51031 63.546000 Cu 0.44172 0.551504 0.5 41 63.546 0.175736 -3.48499 63.546000 Cu 0.526531 0.559265 4.12918e-16 42 63.546 0.0152277 -3.49998 63.546000 Cu 0.577316 0.589483 3.10655e-16 43 63.546 0.00391149 -3.5091 63.546000 Cu 0.491607 0.581195 0.5 45 63.546 0.0255325 -3.50433 63.546000 Cu 0.73071 0.554343 0.5 28 63.546 0.0221785 -3.49952 63.546000 Cu 0.611279 0.567465 0.5 44 63.546 0.00604325 -3.50941 63.546000 Cu 0.696827 0.576018 1 46 63.546 0.00490269 -3.51102 63.546000 Cu 0.783239 0.584759 0.5 48 63.546 0.00420868 -3.51382 63.546000 Cu 0.817421 0.563191 2.40909e-16 26 63.546 0.0294079 -3.51412 63.546000 Cu 0.94164 0.551542 3.12952e-16 29 63.546 0.182818 -3.48481 63.546000 Cu 0.991754 0.581151 0 30 63.546 0.0252559 -3.50398 63.546000 Cu 0.904798 0.572356 0.5 32 63.546 0.0131226 -3.51038 63.546000 Cu 0.162926 0.597728 5.25697e-16 34 63.546 0.00125222 -3.51173 63.546000 Cu 0.042734 0.611149 1 54 63.546 0.00437395 -3.50922 63.546000 Cu 0.128675 0.619578 0.5 56 63.546 0.000717678 -3.51062 63.546000 Cu 0.00796005 0.632677 0.5 57 63.546 0.000731307 -3.51082 63.546000 Cu 0.334968 0.615049 1 38 63.546 0.00198917 -3.5125 63.546000 Cu 0.369601 0.59352 0.5 39 63.546 0.00326575 -3.51302 63.546000 Cu 0.248796 0.606303 0.5 40 63.546 0.00214613 -3.51227 63.546000 Cu 0.214541 0.62808 3.5538e-17 58 63.546 0.000417402 -3.51164 63.546000 Cu 0.456228 0.602482 1 64 63.546 0.0021941 -3.51039 63.546000 Cu 0.507853 0.632671 3.07271e-16 65 63.546 0.000601955 -3.5109 63.546000 Cu 0.542669 0.611205 0.5 66 63.546 0.00465914 -3.50932 63.546000 Cu 0.42135 0.623884 0.5 67 63.546 0.000591367 -3.51208 63.546000 Cu 0.748947 0.606454 3.39787e-16 47 63.546 0.00142571 -3.51239 63.546000 Cu 0.662958 0.597882 0.5 49 63.546 0.00087609 -3.51199 63.546000 Cu 0.62872 0.619689 6.82959e-17 68 63.546 0.00094441 -3.51072 63.546000 Cu 0.71469 0.628211 0.5 70 63.546 0.000208098 -3.51161 63.546000 Cu 0.869752 0.593612 0 50 63.546 0.00280922 -3.51328 63.546000 Cu 0.921531 0.623949 1 51 63.546 0.000402492 -3.51215 63.546000 Cu 0.956384 0.602504 0.5 52 63.546 0.00248621 -3.51058 63.546000 Cu 0.835153 0.615167 0.5 53 63.546 0.00137102 -3.51255 63.546000 Cu 0.0942012 0.641282 3.1126e-16 55 63.546 0.000907878 -3.51047 63.546000 Cu 0.180282 0.64982 0.5 61 63.546 0.000207571 -3.51103 63.546000 Cu 0.0596483 0.662857 0.5 78 63.546 0.000159236 -3.51114 63.546000 Cu 0.14586 0.671469 6.69662e-16 80 63.546 0.000167675 -3.51109 63.546000 Cu 0.266311 0.65839 8.95461e-16 59 63.546 0.000128301 -3.51156 63.546000 Cu 0.300611 0.636704 0.5 60 63.546 0.000716098 -3.51191 63.546000 Cu 0.386812 0.645404 1 62 63.546 0.000719612 -3.51202 63.546000 Cu 0.352449 0.667032 0.5 63 63.546 0.000203947 -3.51194 63.546000 Cu 0.231973 0.680063 0.5 82 63.546 4.39725e-05 -3.51132 63.546000 Cu 0.594196 0.641336 0.5 71 63.546 0.000984196 -3.5105 63.546000 Cu 0.438653 0.675713 1 88 63.546 0.000227199 -3.51198 63.546000 Cu 0.473187 0.654155 0.5 89 63.546 0.000143592 -3.51177 63.546000 Cu 0.559519 0.662869 1 90 63.546 0.00014982 -3.51123 63.546000 Cu 0.680323 0.649909 1 69 63.546 0.000242952 -3.51106 63.546000 Cu 0.766422 0.658494 0.5 75 63.546 4.76936e-05 -3.51161 63.546000 Cu 0.645813 0.671527 0.5 92 63.546 0.00022365 -3.51118 63.546000 Cu 0.732038 0.680138 1 94 63.546 6.63025e-05 -3.51135 63.546000 Cu 0.80078 0.636822 1 72 63.546 0.000403956 -3.51192 63.546000 Cu 0.852608 0.667115 1.14471e-16 73 63.546 9.61157e-05 -3.5119 63.546000 Cu 0.887011 0.645495 0.5 74 63.546 0.000357865 -3.51205 63.546000 Cu 0.973354 0.654193 4.16786e-16 76 63.546 6.52499e-05 -3.51166 63.546000 Cu 0.938857 0.675763 0.5 79 63.546 7.43374e-05 -3.51192 63.546000 Cu 0.0251426 0.684424 2.18909e-16 77 63.546 2.52198e-05 -3.51172 63.546000 Cu 0.19762 0.701693 2.62788e-16 81 63.546 7.70684e-05 -3.51126 63.546000 Cu 0.111407 0.693072 0.5 83 63.546 8.14724e-05 -3.51144 63.546000 Cu 0.0770741 0.714654 1 102 63.546 4.36791e-05 -3.51156 63.546000 Cu 0.163396 0.723292 0.5 104 63.546 5.67533e-05 -3.51137 63.546000 Cu 0.318097 0.688678 8.0988e-17 84 63.546 7.25246e-05 -3.5116 63.546000 Cu 0.370093 0.718931 1 85 63.546 6.26291e-05 -3.5114 63.546000 Cu 0.283827 0.710307 0.5 87 63.546 5.72648e-05 -3.5113 63.546000 Cu 0.404332 0.697327 0.5 86 63.546 8.04888e-05 -3.51177 63.546000 Cu 0.524986 0.684414 0.5 93 63.546 8.45429e-05 -3.51176 63.546000 Cu 0.490656 0.705993 1 111 63.546 3.90039e-05 -3.51175 63.546000 Cu 0.577007 0.714661 0.5 113 63.546 3.7518e-05 -3.51164 63.546000 Cu 0.611332 0.693094 1 91 63.546 7.34776e-05 -3.51145 63.546000 Cu 0.783886 0.710353 1 95 63.546 5.12147e-05 -3.51129 63.546000 Cu 0.697637 0.701737 0.5 97 63.546 7.51054e-05 -3.5113 63.546000 Cu 0.663367 0.723319 1 115 63.546 6.376e-05 -3.51145 63.546000 Cu 0.818233 0.688743 0.5 96 63.546 2.12405e-05 -3.51155 63.546000 Cu 0.904472 0.697367 1 98 63.546 3.76449e-05 -3.5117 63.546000 Cu 0.990755 0.706007 0.5 100 63.546 3.26109e-05 -3.5117 63.546000 Cu 0.870148 0.71896 0.5 101 63.546 6.92001e-05 -3.51137 63.546000 Cu 0.129254 0.744872 1 103 63.546 3.50002e-05 -3.51151 63.546000 Cu 0.0428563 0.736225 0.5 105 63.546 2.4197e-05 -3.51154 63.546000 Cu 0.00872368 0.757783 6.35816e-17 123 63.546 4.97635e-05 -3.51133 63.546000 Cu 0.0951664 0.766438 0.5 125 63.546 1.11724e-05 -3.51141 63.546000 Cu 0.249684 0.731914 5.27873e-16 106 63.546 3.24305e-05 -3.5113 63.546000 Cu 0.301989 0.762142 1 107 63.546 1.09983e-05 -3.51132 63.546000 Cu 0.335976 0.740533 0.5 108 63.546 3.76595e-05 -3.51126 63.546000 Cu 0.215629 0.753516 0.5 109 63.546 4.28032e-05 -3.51147 63.546000 Cu 0.388321 0.770751 0.5 110 63.546 2.86258e-05 -3.51126 63.546000 Cu 0.542827 0.736239 1 112 63.546 2.29122e-05 -3.51161 63.546000 Cu 0.456423 0.727576 0.5 114 63.546 5.66484e-05 -3.51151 63.546000 Cu 0.422311 0.749156 5.41532e-17 134 63.546 8.11566e-05 -3.51129 63.546000 Cu 0.508732 0.757805 0.5 136 63.546 2.83338e-05 -3.51139 63.546000 Cu 0.595192 0.766472 1 137 63.546 1.41739e-05 -3.51145 63.546000 Cu 0.715641 0.753545 2.41755e-19 116 63.546 4.81092e-05 -3.51149 63.546000 Cu 0.749683 0.731947 0.5 117 63.546 5.85402e-05 -3.5113 63.546000 Cu 0.629247 0.7449 0.5 118 63.546 3.33162e-05 -3.51158 63.546000 Cu 0.956473 0.727583 2.39217e-16 99 63.546 6.15658e-05 -3.51147 63.546000 Cu 0.835994 0.740556 8.02627e-17 119 63.546 4.84591e-05 -3.51122 63.546000 Cu 0.888325 0.770747 1 120 63.546 3.87942e-05 -3.51122 63.546000 Cu 0.922323 0.749157 0.5 121 63.546 9.46205e-05 -3.51123 63.546000 Cu 0.802002 0.762159 0.5 122 63.546 1.62738e-05 -3.5113 63.546000 Cu 0.0611055 0.787984 1 124 63.546 7.37534e-05 -3.51141 63.546000 Cu 0.181614 0.775101 1.87239e-16 127 63.546 5.43181e-05 -3.51147 63.546000 Cu 0.14757 0.796663 0.5 130 63.546 5.75498e-05 -3.51156 63.546000 Cu 0.0269997 0.809551 0.5 147 63.546 0.000148086 -3.51131 63.546000 Cu 0.23397 0.80534 1 128 63.546 0.00015511 -3.51169 63.546000 Cu 0.268006 0.783749 0.5 129 63.546 6.74196e-05 -3.51141 63.546000 Cu 0.35435 0.792363 0 131 63.546 1.99126e-05 -3.51125 63.546000 Cu 0.320333 0.813981 0.5 133 63.546 0.000190252 -3.51151 63.546000 Cu 0.474711 0.779371 1 135 63.546 7.5202e-05 -3.51129 63.546000 Cu 0.561137 0.788019 0.5 140 63.546 4.33377e-05 -3.51141 63.546000 Cu 0.440676 0.800957 0.5 157 63.546 9.10427e-05 -3.51124 63.546000 Cu 0.52703 0.809581 1 158 63.546 0.000118817 -3.51131 63.546000 Cu 0.647616 0.796699 1 138 63.546 7.7867e-05 -3.51156 63.546000 Cu 0.681647 0.775135 0.5 139 63.546 8.05136e-05 -3.5115 63.546000 Cu 0.768037 0.78377 2.70161e-16 141 63.546 8.72667e-05 -3.51143 63.546000 Cu 0.734018 0.805367 0.5 144 63.546 0.000200858 -3.5117 63.546000 Cu 0.974699 0.779347 0.5 126 63.546 0.000107826 -3.51126 63.546000 Cu 0.820367 0.813993 7.19343e-16 142 63.546 0.000215869 -3.51151 63.546000 Cu 0.854369 0.792365 0.5 143 63.546 2.16556e-05 -3.51126 63.546000 Cu 0.940671 0.800939 2.66052e-16 145 63.546 0.000110109 -3.51124 63.546000 Cu 0.113352 0.818206 1.02262e-16 149 63.546 6.75916e-05 -3.51155 63.546000 Cu 0.165443 0.848432 1.04922e-16 150 63.546 4.85728e-05 -3.51184 63.546000 Cu 0.199779 0.826907 0.5 151 63.546 0.000126451 -3.51186 63.546000 Cu 0.0790455 0.839739 0.5 152 63.546 0.000327852 -3.51125 63.546000 Cu 0.044651 0.861288 1 170 63.546 0.000907507 -3.51075 63.546000 Cu 0.286117 0.835597 2.91678e-16 153 63.546 0.000362865 -3.51182 63.546000 Cu 0.372355 0.844213 0.5 155 63.546 0.000134611 -3.51167 63.546000 Cu 0.251793 0.857165 0.5 156 63.546 0.000309584 -3.51205 63.546000 Cu 0.406556 0.822567 7.32518e-17 132 63.546 5.67026e-05 -3.51136 63.546000 Cu 0.579085 0.839771 6.97585e-16 159 63.546 0.000264314 -3.51128 63.546000 Cu 0.492837 0.83115 0.5 161 63.546 0.000240129 -3.51109 63.546000 Cu 0.458527 0.852764 7.95375e-17 180 63.546 0.000143622 -3.51111 63.546000 Cu 0.544679 0.861313 0.5 182 63.546 0.000830084 -3.51074 63.546000 Cu 0.613399 0.81824 0.5 160 63.546 4.89789e-05 -3.51156 63.546000 Cu 0.699832 0.826939 1 162 63.546 0.000163495 -3.51189 63.546000 Cu 0.751842 0.857192 4.435e-16 163 63.546 0.000374199 -3.51205 63.546000 Cu 0.786161 0.835617 0.5 164 63.546 0.000416135 -3.51183 63.546000 Cu 0.665494 0.848466 0.5 165 63.546 4.69888e-05 -3.51186 63.546000 Cu 0.992818 0.831127 1 146 63.546 0.000274978 -3.51106 63.546000 Cu 0.906565 0.82256 0.5 148 63.546 5.88924e-05 -3.51134 63.546000 Cu 0.872379 0.844218 1 166 63.546 0.000141556 -3.51165 63.546000 Cu 0.958525 0.852752 0.5 168 63.546 0.000151233 -3.5111 63.546000 Cu 0.0964377 0.891386 0 171 63.546 0.0037697 -3.50953 63.546000 Cu 0.131023 0.869926 0.5 172 63.546 0.000581292 -3.5112 63.546000 Cu 0.0103454 0.882926 0.5 173 63.546 0.000746129 -3.51057 63.546000 Cu 0.182988 0.90006 0.5 177 63.546 0.00183043 -3.51049 63.546000 Cu 0.338167 0.865857 2.99293e-16 154 63.546 0.000659003 -3.51198 63.546000 Cu 0.217547 0.878682 1 174 63.546 0.000507381 -3.51207 63.546000 Cu 0.303972 0.887466 0.5 176 63.546 0.001511 -3.51252 63.546000 Cu 0.390308 0.896158 1 178 63.546 0.00158246 -3.5121 63.546000 Cu 0.26973 0.908969 1.78174e-16 175 63.546 0.00294501 -3.51306 63.546000 Cu 0.510355 0.882939 1.71404e-16 181 63.546 0.00074172 -3.51059 63.546000 Cu 0.424312 0.874444 0.5 183 63.546 0.000226841 -3.51145 63.546000 Cu 0.596467 0.891407 0.5 187 63.546 0.00365731 -3.50952 63.546000 Cu 0.476285 0.904683 0.5 205 63.546 0.000640171 -3.51135 63.546000 Cu 0.631068 0.869955 1 184 63.546 0.0005133 -3.51117 63.546000 Cu 0.683029 0.900084 1 185 63.546 0.0017352 -3.51048 63.546000 Cu 0.717598 0.878709 0.5 186 63.546 0.000570037 -3.51204 63.546000 Cu 0.769772 0.90899 0.5 191 63.546 0.00309214 -3.51308 63.546000 Cu 0.924326 0.874443 1 167 63.546 0.00022449 -3.51142 63.546000 Cu 0.838202 0.865871 0.5 169 63.546 0.000716124 -3.51197 63.546000 Cu 0.804016 0.887484 1.38647e-16 188 63.546 0.00162208 -3.51251 63.546000 Cu 0.890336 0.896164 0.5 190 63.546 0.00163142 -3.51208 63.546000 Cu 0.976294 0.904679 2.68107e-16 192 63.546 0.000622207 -3.51131 63.546000 Cu 0.0282851 0.934936 3.7883e-16 193 63.546 0.0026764 -3.5099 63.546000 Cu 0.0621029 0.913042 0.5 194 63.546 0.00317223 -3.50928 63.546000 Cu 0.147998 0.921348 4.8351e-19 196 63.546 0.0191547 -3.50539 63.546000 Cu 0.198765 0.950961 6.143e-16 197 63.546 0.134074 -3.48884 63.546000 Cu 0.113434 0.943164 0.5 199 63.546 0.0120791 -3.50451 63.546000 Cu 0.356303 0.917819 0.5 179 63.546 0.0047633 -3.51348 63.546000 Cu 0.235062 0.930184 0.5 198 63.546 0.00944404 -3.51 63.546000 Cu 0.322345 0.939356 6.48871e-16 200 63.546 0.0252045 -3.51432 63.546000 Cu 0.408999 0.948208 0.5 202 63.546 0.0177347 -3.50294 63.546000 Cu 0.442639 0.926505 1.21845e-16 204 63.546 0.00398531 -3.51083 63.546000 Cu 0.562112 0.913056 2.43689e-16 206 63.546 0.00313813 -3.50931 63.546000 Cu 0.528279 0.934941 0.5 209 63.546 0.00269663 -3.50993 63.546000 Cu 0.613444 0.943176 3.81127e-16 207 63.546 0.0120376 -3.50454 63.546000 Cu 0.648021 0.921366 0.5 208 63.546 0.0188964 -3.50538 63.546000 Cu 0.735095 0.930204 2.96996e-16 210 63.546 0.00935439 -3.51 63.546000 Cu 0.698785 0.950976 0.5 213 63.546 0.133559 -3.48878 63.546000 Cu 0.856339 0.917832 1 189 63.546 0.00490053 -3.5135 63.546000 Cu 0.942661 0.926509 0.5 195 63.546 0.00404115 -3.51083 63.546000 Cu 0.822377 0.939373 0.5 212 63.546 0.0255992 -3.51436 63.546000 Cu 0.909023 0.948217 1 214 63.546 0.0178282 -3.50293 63.546000 Cu 0.045425 0.988954 0.5 249 63.546 3.83748 -3.41007 63.546000 Cu 0.0790458 0.965287 1.34174e-16 218 63.546 0.0717343 -3.49156 63.546000 Cu 0.135934 0.99399 1 219 63.546 10.1496 -3.31201 63.546000 Cu 0.165548 0.973174 0.5 220 63.546 0.899737 -3.44362 63.546000 Cu 0.374835 0.970528 1 201 63.546 1.24507 -3.43327 63.546000 Cu 0.28903 0.960165 0.5 203 63.546 0.125603 -3.46618 63.546000 Cu 0.251507 0.979345 7.37474e-16 222 63.546 3.83963 -3.26372 63.546000 Cu 0.342006 0.992669 0.5 223 63.546 8.11785 -3.41277 63.546000 Cu 0.545419 0.988949 1 234 63.546 3.83363 -3.41012 63.546000 Cu 0.494716 0.957072 1 224 63.546 0.0274163 -3.49178 63.546000 Cu 0.579043 0.96529 0.5 226 63.546 0.0717122 -3.49164 63.546000 Cu 0.459512 0.978478 0.5 227 63.546 2.70558 -3.34342 63.546000 Cu 0.789058 0.960181 1.21966e-16 211 63.546 0.125635 -3.46615 63.546000 Cu 0.665562 0.973181 1 228 63.546 0.899608 -3.44364 63.546000 Cu 0.751523 0.979357 0.5 229 63.546 3.83633 -3.26362 63.546000 Cu 0.635928 0.993993 0.5 230 63.546 10.1459 -3.31197 63.546000 Cu 0.95953 0.978483 1 215 63.546 2.70883 -3.34331 63.546000 Cu 0.994729 0.957076 0.5 216 63.546 0.0275858 -3.49177 63.546000 Cu 0.874857 0.970541 0.5 217 63.546 1.24679 -3.43328 63.546000 Cu 0.842028 0.992682 3.46798e-16 231 63.546 8.1199 -3.41292