Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.3145 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.5831 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61214 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 0.148344 0.00459286 6.68264e-16 214 63.546 2.46496 -3.67237 63.546000 Cu 0.0482934 0.00458709 0.5 215 63.546 8.3974 -3.92171 63.546000 Cu 0.250586 0.00457972 0.5 217 63.546 1.32766 -3.43003 63.546000 Cu 0.00125597 0.0659185 1.69767e-16 219 63.546 0.0563135 -3.54782 63.546000 Cu 0.0799417 0.0355673 4.05449e-16 222 63.546 0.746601 -3.33418 63.546000 Cu 0.188843 0.0570296 7.01401e-16 223 63.546 0.126044 -3.44706 63.546000 Cu 0.164679 0.030528 0.5 224 63.546 0.607358 -3.44334 63.546000 Cu 0.0973786 0.0614803 0.5 225 63.546 0.106365 -3.46179 63.546000 Cu 0.260247 0.0287773 1.16544e-15 226 63.546 0.667202 -3.44103 63.546000 Cu 0.283333 0.0518908 0.5 229 63.546 0.15331 -3.55574 63.546000 Cu 0.210573 0.0813247 0.5 245 63.546 0.0244092 -3.49932 63.546000 Cu 0.305791 0.0761282 8.3503e-16 247 63.546 0.00816152 -3.5304 63.546000 Cu 0.347674 0.00459179 2.86492e-15 216 63.546 7.1167 -2.78601 63.546000 Cu 0.382115 0.0476903 1.34481e-15 227 63.546 0.108807 -3.50209 63.546000 Cu 0.369091 0.0247546 0.5 228 63.546 3.67594 -3.36027 63.546000 Cu 0.466295 0.0202341 1.09268e-15 230 63.546 9.21235 -3.0574 63.546000 Cu 0.579942 0.0355673 3.34853e-16 231 63.546 0.746601 -3.33418 63.546000 Cu 0.548293 0.00458709 0.5 232 63.546 8.3974 -3.92171 63.546000 Cu 0.486308 0.0423105 0.5 233 63.546 0.773752 -3.38319 63.546000 Cu 0.648344 0.00459286 2.12029e-16 234 63.546 2.46496 -3.67237 63.546000 Cu 0.403118 0.0708307 0.5 249 63.546 0.0409962 -3.56198 63.546000 Cu 0.501256 0.0659185 7.91928e-16 251 63.546 0.0563135 -3.54782 63.546000 Cu 0.597379 0.0614803 0.5 253 63.546 0.106365 -3.46179 63.546000 Cu 0.664679 0.030528 0.5 237 63.546 0.607358 -3.44334 63.546000 Cu 0.847674 0.00459179 1 211 63.546 7.1167 -2.78601 63.546000 Cu 0.966295 0.0202341 1 212 63.546 9.21235 -3.0574 63.546000 Cu 0.869091 0.0247546 0.5 213 63.546 3.67594 -3.36027 63.546000 Cu 0.882115 0.0476903 1 218 63.546 0.108807 -3.50209 63.546000 Cu 0.986308 0.0423105 0.5 220 63.546 0.773752 -3.38319 63.546000 Cu 0.903118 0.0708307 0.5 221 63.546 0.0409962 -3.56198 63.546000 Cu 0.760247 0.0287773 1 235 63.546 0.667202 -3.44103 63.546000 Cu 0.750586 0.00457972 0.5 236 63.546 1.32766 -3.43003 63.546000 Cu 0.688843 0.0570296 1.87897e-16 255 63.546 0.126044 -3.44706 63.546000 Cu 0.805791 0.0761282 1.51998e-16 256 63.546 0.00816152 -3.5304 63.546000 Cu 0.783333 0.0518908 0.5 257 63.546 0.15331 -3.55574 63.546000 Cu 0.710573 0.0813247 0.5 258 63.546 0.0244092 -3.49932 63.546000 Cu 0.0375275 0.114731 3.76994e-16 240 63.546 0.00312247 -3.52951 63.546000 Cu 0.0186873 0.0902972 0.5 241 63.546 0.00592519 -3.54169 63.546000 Cu 0.114492 0.0860499 5.11944e-16 243 63.546 0.0179926 -3.50638 63.546000 Cu 0.230328 0.105271 6.33206e-16 244 63.546 0.00283607 -3.52523 63.546000 Cu 0.133652 0.110094 0.5 246 63.546 0.00401953 -3.5273 63.546000 Cu 0.0766937 0.163077 4.53114e-16 262 63.546 0.000178349 -3.53337 63.546000 Cu 0.0571266 0.138955 0.5 263 63.546 0.00119072 -3.53014 63.546000 Cu 0.153312 0.134114 6.17118e-16 265 63.546 0.000582484 -3.53423 63.546000 Cu 0.269221 0.153284 6.35968e-16 266 63.546 0.000556019 -3.5389 63.546000 Cu 0.2499 0.129195 0.5 267 63.546 0.000744635 -3.53746 63.546000 Cu 0.172953 0.158184 0.5 268 63.546 0.000136262 -3.53703 63.546000 Cu 0.326969 0.100123 0.5 250 63.546 0.00478969 -3.53533 63.546000 Cu 0.422915 0.0949632 8.24345e-16 248 63.546 0.0119217 -3.55026 63.546000 Cu 0.614492 0.0860499 4.30302e-16 252 63.546 0.0179926 -3.50638 63.546000 Cu 0.518687 0.0902972 0.5 254 63.546 0.00592519 -3.54169 63.546000 Cu 0.346364 0.124239 7.22532e-16 269 63.546 0.00282784 -3.53793 63.546000 Cu 0.461227 0.143705 5.89264e-16 270 63.546 0.000465269 -3.53053 63.546000 Cu 0.442158 0.119379 0.5 271 63.546 0.00130339 -3.53424 63.546000 Cu 0.36534 0.148445 0.5 272 63.546 0.000423713 -3.53585 63.546000 Cu 0.537528 0.114731 7.34659e-16 273 63.546 0.00312247 -3.52951 63.546000 Cu 0.653312 0.134114 3.53102e-16 274 63.546 0.000582484 -3.53423 63.546000 Cu 0.633652 0.110094 0.5 275 63.546 0.00401953 -3.5273 63.546000 Cu 0.557127 0.138955 0.5 276 63.546 0.00119072 -3.53014 63.546000 Cu 0.576694 0.163077 6.86154e-16 294 63.546 0.000178349 -3.53337 63.546000 Cu 0.846364 0.124239 5.90464e-16 238 63.546 0.00282784 -3.53793 63.546000 Cu 0.922915 0.0949632 4.14213e-16 239 63.546 0.0119217 -3.55026 63.546000 Cu 0.942158 0.119379 0.5 242 63.546 0.00130339 -3.53424 63.546000 Cu 0.86534 0.148445 0.5 260 63.546 0.000423713 -3.53585 63.546000 Cu 0.961227 0.143705 3.60186e-16 261 63.546 0.000465269 -3.53053 63.546000 Cu 0.730328 0.105271 4.89252e-16 277 63.546 0.00283607 -3.52523 63.546000 Cu 0.826969 0.100123 0.5 278 63.546 0.00478969 -3.53533 63.546000 Cu 0.7499 0.129195 0.5 279 63.546 0.000744635 -3.53746 63.546000 Cu 0.672953 0.158184 0.5 296 63.546 0.000136262 -3.53703 63.546000 Cu 0.769221 0.153284 6.18679e-16 298 63.546 0.000556019 -3.5389 63.546000 Cu 0.115536 0.211323 7.01522e-16 283 63.546 1.47121e-05 -3.53563 63.546000 Cu 0.0961482 0.187188 0.5 284 63.546 1.68947e-05 -3.53573 63.546000 Cu 0.0193631 0.216171 0.5 285 63.546 1.59171e-05 -3.53471 63.546000 Cu 0.192341 0.182318 5.26471e-16 286 63.546 8.18182e-05 -3.53704 63.546000 Cu 0.307752 0.201651 6.13636e-16 287 63.546 2.20509e-05 -3.53462 63.546000 Cu 0.288483 0.177462 0.5 288 63.546 0.000132134 -3.53666 63.546000 Cu 0.211687 0.206473 0.5 289 63.546 3.46228e-05 -3.53569 63.546000 Cu 0.0387614 0.240296 5.14105e-16 304 63.546 7.75552e-06 -3.53522 63.546000 Cu 0.134898 0.235457 0.5 306 63.546 1.21044e-05 -3.53505 63.546000 Cu 0.231022 0.230631 4.52993e-16 308 63.546 1.51743e-05 -3.53458 63.546000 Cu 0.327118 0.225809 0.5 310 63.546 1.13523e-05 -3.53366 63.546000 Cu 0.38448 0.172669 5.45201e-16 290 63.546 7.88429e-05 -3.53419 63.546000 Cu 0.499936 0.192041 5.54326e-16 291 63.546 8.4663e-05 -3.53422 63.546000 Cu 0.480542 0.167901 0.5 292 63.546 0.000291064 -3.53248 63.546000 Cu 0.403837 0.196848 0.5 293 63.546 4.20455e-05 -3.53359 63.546000 Cu 0.596148 0.187188 0.5 297 63.546 1.68947e-05 -3.53573 63.546000 Cu 0.423196 0.220997 3.69671e-16 312 63.546 3.44132e-05 -3.53376 63.546000 Cu 0.538761 0.240296 2.45527e-16 313 63.546 7.75552e-06 -3.53522 63.546000 Cu 0.519363 0.216171 0.5 314 63.546 1.59171e-05 -3.53471 63.546000 Cu 0.442646 0.245136 0.5 315 63.546 1.07874e-05 -3.53479 63.546000 Cu 0.615536 0.211323 6.25162e-16 316 63.546 1.47121e-05 -3.53563 63.546000 Cu 0.634898 0.235457 0.5 319 63.546 1.21044e-05 -3.53505 63.546000 Cu 0.346556 0.249953 6.56138e-16 309 63.546 1.33522e-06 -3.53393 63.546000 Cu 0.999936 0.192041 5.99229e-16 282 63.546 8.4663e-05 -3.53422 63.546000 Cu 0.88448 0.172669 4.51553e-16 259 63.546 7.88429e-05 -3.53419 63.546000 Cu 0.980542 0.167901 0.5 264 63.546 0.000291064 -3.53248 63.546000 Cu 0.923196 0.220997 3.22726e-16 280 63.546 3.44132e-05 -3.53376 63.546000 Cu 0.903837 0.196848 0.5 281 63.546 4.20455e-05 -3.53359 63.546000 Cu 0.692341 0.182318 5.49163e-16 295 63.546 8.18182e-05 -3.53704 63.546000 Cu 0.788483 0.177462 0.5 299 63.546 0.000132134 -3.53666 63.546000 Cu 0.942646 0.245136 0.5 302 63.546 1.07874e-05 -3.53479 63.546000 Cu 0.731022 0.230631 4.00046e-16 317 63.546 1.51743e-05 -3.53458 63.546000 Cu 0.711687 0.206473 0.5 318 63.546 3.46228e-05 -3.53569 63.546000 Cu 0.807752 0.201651 4.47711e-16 320 63.546 2.20509e-05 -3.53462 63.546000 Cu 0.827118 0.225809 0.5 321 63.546 1.13523e-05 -3.53366 63.546000 Cu 0.846556 0.249953 5.2335e-16 300 63.546 1.33522e-06 -3.53393 63.546000 Cu 0.154328 0.259598 8.23264e-16 305 63.546 6.23214e-06 -3.53458 63.546000 Cu 0.0582135 0.264438 0.5 307 63.546 8.46376e-06 -3.53536 63.546000 Cu 0.25045 0.254767 0.5 311 63.546 8.43253e-06 -3.53406 63.546000 Cu 0.000967939 0.31752 7.3814e-16 323 63.546 6.58693e-05 -3.53435 63.546000 Cu 0.0776769 0.288558 6.47734e-16 326 63.546 1.81871e-05 -3.53458 63.546000 Cu 0.19319 0.307874 6.55058e-16 327 63.546 4.14174e-05 -3.53418 63.546000 Cu 0.173822 0.283727 0.5 328 63.546 4.98882e-05 -3.53405 63.546000 Cu 0.0970965 0.312687 0.5 329 63.546 8.97208e-05 -3.53413 63.546000 Cu 0.269906 0.278908 6.74027e-16 330 63.546 2.84091e-05 -3.53443 63.546000 Cu 0.289243 0.303072 0.5 333 63.546 2.82576e-05 -3.53473 63.546000 Cu 0.212436 0.33205 0.5 349 63.546 3.69707e-05 -3.53559 63.546000 Cu 0.308505 0.327219 4.82649e-16 351 63.546 0.000100236 -3.53589 63.546000 Cu 0.385367 0.298246 7.11727e-16 331 63.546 4.55223e-05 -3.5352 63.546000 Cu 0.365957 0.2741 0.5 332 63.546 1.00837e-05 -3.53462 63.546000 Cu 0.462076 0.269277 5.64651e-16 334 63.546 1.81173e-05 -3.53528 63.546000 Cu 0.577677 0.288558 4.34384e-16 335 63.546 1.81871e-05 -3.53458 63.546000 Cu 0.558214 0.264438 0.5 336 63.546 8.46376e-06 -3.53536 63.546000 Cu 0.481468 0.293407 0.5 337 63.546 2.87551e-05 -3.53506 63.546000 Cu 0.654328 0.259598 6.09914e-16 338 63.546 6.23214e-06 -3.53458 63.546000 Cu 0.404697 0.322377 0.5 353 63.546 4.91993e-05 -3.53549 63.546000 Cu 0.500968 0.31752 9.14631e-16 355 63.546 6.58693e-05 -3.53435 63.546000 Cu 0.597096 0.312687 0.5 357 63.546 8.97208e-05 -3.53413 63.546000 Cu 0.962076 0.269277 5.52045e-16 301 63.546 1.81173e-05 -3.53528 63.546000 Cu 0.865957 0.2741 0.5 303 63.546 1.00837e-05 -3.53462 63.546000 Cu 0.885367 0.298246 5.89384e-16 322 63.546 4.55223e-05 -3.5352 63.546000 Cu 0.981468 0.293407 0.5 324 63.546 2.87551e-05 -3.53506 63.546000 Cu 0.904697 0.322377 0.5 325 63.546 4.91993e-05 -3.53549 63.546000 Cu 0.769906 0.278908 4.63199e-16 339 63.546 2.84091e-05 -3.53443 63.546000 Cu 0.75045 0.254767 0.5 340 63.546 8.43253e-06 -3.53406 63.546000 Cu 0.673822 0.283727 0.5 341 63.546 4.98882e-05 -3.53405 63.546000 Cu 0.69319 0.307874 3.73993e-16 359 63.546 4.14174e-05 -3.53418 63.546000 Cu 0.808505 0.327219 4.89612e-16 360 63.546 0.000100236 -3.53589 63.546000 Cu 0.789243 0.303072 0.5 361 63.546 2.82576e-05 -3.53473 63.546000 Cu 0.712436 0.33205 0.5 362 63.546 3.69707e-05 -3.53559 63.546000 Cu 0.0396019 0.365804 7.1857e-16 344 63.546 0.000485726 -3.53086 63.546000 Cu 0.0203121 0.341635 0.5 345 63.546 0.000254779 -3.53263 63.546000 Cu 0.11642 0.336848 6.56258e-16 347 63.546 9.18704e-05 -3.53423 63.546000 Cu 0.231626 0.35623 6.0055e-16 348 63.546 0.000480515 -3.53838 63.546000 Cu 0.135534 0.361047 0.5 350 63.546 0.000200541 -3.53557 63.546000 Cu 0.0778612 0.414507 1.08416e-15 366 63.546 0.0105695 -3.54959 63.546000 Cu 0.0587309 0.390103 0.5 367 63.546 0.000868699 -3.53428 63.546000 Cu 0.154478 0.38525 8.32389e-16 369 63.546 0.00227878 -3.5373 63.546000 Cu 0.270371 0.404252 8.81975e-16 370 63.546 0.00239582 -3.52497 63.546000 Cu 0.250864 0.380325 0.5 371 63.546 0.000870163 -3.53779 63.546000 Cu 0.173753 0.409377 0.5 372 63.546 0.00465495 -3.534 63.546000 Cu 0.327839 0.35136 0.5 354 63.546 0.000250247 -3.53748 63.546000 Cu 0.42412 0.346472 7.67436e-16 352 63.546 0.000104087 -3.53404 63.546000 Cu 0.61642 0.336848 5.30433e-16 356 63.546 9.18704e-05 -3.53423 63.546000 Cu 0.520312 0.341635 0.5 358 63.546 0.000254779 -3.53263 63.546000 Cu 0.347485 0.375426 7.48946e-16 373 63.546 0.000488244 -3.53517 63.546000 Cu 0.463274 0.394776 9.85228e-16 374 63.546 0.00324605 -3.52985 63.546000 Cu 0.443693 0.370581 0.5 375 63.546 0.000957734 -3.53066 63.546000 Cu 0.36708 0.399428 0.5 376 63.546 0.00356324 -3.52741 63.546000 Cu 0.539602 0.365804 7.3646e-16 377 63.546 0.000485726 -3.53086 63.546000 Cu 0.654478 0.38525 8.47877e-16 378 63.546 0.00227878 -3.5373 63.546000 Cu 0.635534 0.361047 0.5 379 63.546 0.000200541 -3.53557 63.546000 Cu 0.558731 0.390103 0.5 380 63.546 0.000868699 -3.53428 63.546000 Cu 0.577861 0.414507 1.06951e-15 398 63.546 0.0105695 -3.54959 63.546000 Cu 0.847485 0.375426 7.5627e-16 342 63.546 0.000488244 -3.53517 63.546000 Cu 0.92412 0.346472 6.15317e-16 343 63.546 0.000104087 -3.53404 63.546000 Cu 0.943693 0.370581 0.5 346 63.546 0.000957734 -3.53066 63.546000 Cu 0.86708 0.399428 0.5 364 63.546 0.00356324 -3.52741 63.546000 Cu 0.963274 0.394776 8.43915e-16 365 63.546 0.00324605 -3.52985 63.546000 Cu 0.731626 0.35623 5.81099e-16 381 63.546 0.000480515 -3.53838 63.546000 Cu 0.827839 0.35136 0.5 382 63.546 0.000250247 -3.53748 63.546000 Cu 0.750864 0.380325 0.5 383 63.546 0.000870163 -3.53779 63.546000 Cu 0.673753 0.409377 0.5 400 63.546 0.00465495 -3.534 63.546000 Cu 0.770371 0.404252 1.01392e-15 402 63.546 0.00239582 -3.52497 63.546000 Cu 0.118178 0.46181 2.06542e-15 387 63.546 0.107854 -3.50283 63.546000 Cu 0.0974457 0.43865 0.5 388 63.546 0.041406 -3.56243 63.546000 Cu 0.01394 0.467144 0.5 389 63.546 0.781135 -3.38214 63.546000 Cu 0.19473 0.433378 9.83907e-16 390 63.546 0.00776967 -3.53013 63.546000 Cu 0.311533 0.45244 1.15668e-15 391 63.546 0.126284 -3.44762 63.546000 Cu 0.289945 0.428171 0.5 392 63.546 0.0241618 -3.49842 63.546000 Cu 0.21701 0.457618 0.5 393 63.546 0.155161 -3.55616 63.546000 Cu 0.033711 0.489247 1.60859e-15 406 63.546 9.20233 -3.05936 63.546000 Cu 0.130976 0.484725 0.5 407 63.546 3.69986 -3.3574 63.546000 Cu 0.239985 0.480693 2.13458e-15 408 63.546 0.670806 -3.43993 63.546000 Cu 0.630976 0.484725 0.5 10 63.546 3.69986 -3.3574 63.546000 Cu 0.618178 0.46181 3.343e-15 205 63.546 0.107854 -3.50283 63.546000 Cu 0.51394 0.467144 0.5 210 63.546 0.781135 -3.38214 63.546000 Cu 0.386142 0.423435 1.18789e-15 394 63.546 0.0179828 -3.50613 63.546000 Cu 0.499295 0.44353 1.29655e-15 395 63.546 0.0532874 -3.54765 63.546000 Cu 0.482059 0.419171 0.5 396 63.546 0.00599688 -3.54178 63.546000 Cu 0.403081 0.44796 0.5 397 63.546 0.108958 -3.46135 63.546000 Cu 0.597446 0.43865 0.5 401 63.546 0.041406 -3.56243 63.546000 Cu 0.335637 0.478925 0.5 410 63.546 0.618168 -3.44508 63.546000 Cu 0.420334 0.473853 1.36126e-15 411 63.546 0.745375 -3.33109 63.546000 Cu 0.533711 0.489247 2.06206e-15 412 63.546 9.20233 -3.05936 63.546000 Cu 0.999295 0.44353 1.2861e-15 386 63.546 0.0532874 -3.54765 63.546000 Cu 0.835637 0.478925 0.5 2 63.546 0.618168 -3.44508 63.546000 Cu 0.811533 0.45244 1.48589e-15 5 63.546 0.126284 -3.44762 63.546000 Cu 0.71701 0.457618 0.5 12 63.546 0.155161 -3.55616 63.546000 Cu 0.739985 0.480693 2.57665e-15 203 63.546 0.670806 -3.43993 63.546000 Cu 0.886142 0.423435 1.09448e-15 363 63.546 0.0179828 -3.50613 63.546000 Cu 0.982059 0.419171 0.5 368 63.546 0.00599688 -3.54178 63.546000 Cu 0.920334 0.473853 1.38924e-15 384 63.546 0.745375 -3.33109 63.546000 Cu 0.903081 0.44796 0.5 385 63.546 0.108958 -3.46135 63.546000 Cu 0.69473 0.433378 1.43198e-15 399 63.546 0.00776967 -3.53013 63.546000 Cu 0.789945 0.428171 0.5 403 63.546 0.0241618 -3.49842 63.546000 Cu 0.0338397 0.520538 1.49261e-15 4 63.546 9.20396 -3.05778 63.546000 Cu 0.13111 0.52504 0.5 6 63.546 3.66878 -3.35983 63.546000 Cu 0.152414 0.504865 4.75337e-15 7 63.546 7.11545 -2.78739 63.546000 Cu 0.239938 0.529048 1.98366e-15 8 63.546 0.665388 -3.44195 63.546000 Cu 0.249497 0.504859 0.5 9 63.546 1.32665 -3.43023 63.546000 Cu 0.0139169 0.542587 0.5 24 63.546 0.777414 -3.38146 63.546000 Cu 0.118179 0.547955 1.98498e-15 26 63.546 0.108846 -3.50148 63.546000 Cu 0.097271 0.57107 0.5 27 63.546 0.0422787 -3.56161 63.546000 Cu 0.194619 0.576368 9.67459e-16 28 63.546 0.00804345 -3.52908 63.546000 Cu 0.217006 0.552158 0.5 29 63.546 0.154425 -3.55603 63.546000 Cu 0.311461 0.557307 9.81386e-16 30 63.546 0.128452 -3.44729 63.546000 Cu 0.289871 0.581576 0.5 33 63.546 0.0256295 -3.49815 63.546000 Cu 0.451794 0.504883 0.5 209 63.546 8.39988 -3.92037 63.546000 Cu 0.335518 0.530798 0.5 13 63.546 0.608356 -3.44502 63.546000 Cu 0.652414 0.504865 7.81195e-15 1 63.546 7.11545 -2.78739 63.546000 Cu 0.420266 0.53586 1.30555e-15 11 63.546 0.747367 -3.33371 63.546000 Cu 0.53384 0.520538 2.21982e-15 14 63.546 9.20396 -3.05778 63.546000 Cu 0.618179 0.547955 2.8265e-15 15 63.546 0.108846 -3.50148 63.546000 Cu 0.63111 0.52504 0.5 16 63.546 3.66878 -3.35983 63.546000 Cu 0.513917 0.542587 0.5 17 63.546 0.777414 -3.38146 63.546000 Cu 0.402916 0.561748 0.5 32 63.546 0.108672 -3.46199 63.546000 Cu 0.499086 0.566184 1.42585e-15 34 63.546 0.0558189 -3.54804 63.546000 Cu 0.597271 0.57107 0.5 36 63.546 0.0422787 -3.56161 63.546000 Cu 0.351769 0.504861 1.1347e-15 409 63.546 2.46788 -3.67298 63.546000 Cu 0.951794 0.504883 0.5 405 63.546 8.39988 -3.92037 63.546000 Cu 0.749497 0.504859 0.5 3 63.546 1.32665 -3.43023 63.546000 Cu 0.739938 0.529048 2.7164e-15 18 63.546 0.665388 -3.44195 63.546000 Cu 0.811461 0.557307 1.13242e-15 19 63.546 0.128452 -3.44729 63.546000 Cu 0.835518 0.530798 0.5 20 63.546 0.608356 -3.44502 63.546000 Cu 0.717006 0.552158 0.5 21 63.546 0.154425 -3.55603 63.546000 Cu 0.920266 0.53586 1.26761e-15 22 63.546 0.747367 -3.33371 63.546000 Cu 0.999086 0.566184 1.0126e-15 23 63.546 0.0558189 -3.54804 63.546000 Cu 0.902916 0.561748 0.5 25 63.546 0.108672 -3.46199 63.546000 Cu 0.694619 0.576368 1.16196e-15 38 63.546 0.00804345 -3.52908 63.546000 Cu 0.789871 0.581576 0.5 40 63.546 0.0256295 -3.49815 63.546000 Cu 0.851769 0.504861 1.28358e-15 404 63.546 2.46788 -3.67298 63.546000 Cu 0.0776707 0.595182 6.3957e-16 46 63.546 0.0121161 -3.54933 63.546000 Cu 0.0585585 0.619579 0.5 47 63.546 0.0010719 -3.53398 63.546000 Cu 0.1543 0.624413 8.69488e-16 48 63.546 0.00282297 -3.53734 63.546000 Cu 0.173565 0.600324 0.5 49 63.546 0.00517029 -3.53326 63.546000 Cu 0.270201 0.605465 8.00813e-16 50 63.546 0.00253868 -3.52448 63.546000 Cu 0.250715 0.629357 0.5 53 63.546 0.000920804 -3.53772 63.546000 Cu 0.0394902 0.643877 6.7883e-16 66 63.546 0.000642404 -3.52999 63.546000 Cu 0.135361 0.648601 0.5 68 63.546 0.000376495 -3.53601 63.546000 Cu 0.231479 0.653422 8.03454e-16 70 63.546 0.000569965 -3.53898 63.546000 Cu 0.327702 0.658311 0.5 72 63.546 0.000149916 -3.53693 63.546000 Cu 0.386031 0.5863 9.03946e-16 31 63.546 0.0193384 -3.5069 63.546000 Cu 0.577671 0.595182 9.33481e-16 35 63.546 0.0121161 -3.54933 63.546000 Cu 0.481909 0.590535 0.5 37 63.546 0.00629821 -3.54216 63.546000 Cu 0.347328 0.634274 7.98652e-16 51 63.546 0.000520624 -3.53488 63.546000 Cu 0.366989 0.610303 0.5 52 63.546 0.0044599 -3.52794 63.546000 Cu 0.463163 0.614943 6.81111e-16 54 63.546 0.00370233 -3.52997 63.546000 Cu 0.53949 0.643877 4.47711e-16 55 63.546 0.000642404 -3.52999 63.546000 Cu 0.558558 0.619579 0.5 56 63.546 0.0010719 -3.53398 63.546000 Cu 0.443594 0.639121 0.5 57 63.546 0.00129404 -3.53014 63.546000 Cu 0.6543 0.624413 6.82072e-16 58 63.546 0.00282297 -3.53734 63.546000 Cu 0.635361 0.648601 0.5 61 63.546 0.000376495 -3.53601 63.546000 Cu 0.42395 0.663198 7.5759e-16 74 63.546 0.000131246 -3.53348 63.546000 Cu 0.673565 0.600324 0.5 41 63.546 0.00517029 -3.53326 63.546000 Cu 0.770201 0.605465 7.40422e-16 39 63.546 0.00253868 -3.52448 63.546000 Cu 0.886031 0.5863 8.70449e-16 42 63.546 0.0193384 -3.5069 63.546000 Cu 0.963163 0.614943 5.27432e-16 43 63.546 0.00370233 -3.52997 63.546000 Cu 0.981909 0.590535 0.5 44 63.546 0.00629821 -3.54216 63.546000 Cu 0.866989 0.610303 0.5 45 63.546 0.0044599 -3.52794 63.546000 Cu 0.731479 0.653422 6.601e-16 59 63.546 0.000569965 -3.53898 63.546000 Cu 0.750715 0.629357 0.5 60 63.546 0.000920804 -3.53772 63.546000 Cu 0.847328 0.634274 5.19628e-16 62 63.546 0.000520624 -3.53488 63.546000 Cu 0.92395 0.663198 3.95004e-16 63 63.546 0.000131246 -3.53348 63.546000 Cu 0.943594 0.639121 0.5 64 63.546 0.00129404 -3.53014 63.546000 Cu 0.827702 0.658311 0.5 65 63.546 0.000149916 -3.53693 63.546000 Cu 0.116175 0.672793 7.49186e-16 67 63.546 9.81422e-05 -3.53347 63.546000 Cu 0.0201317 0.668025 0.5 69 63.546 0.000325623 -3.53176 63.546000 Cu 0.308255 0.682409 4.51793e-16 71 63.546 0.000112167 -3.53664 63.546000 Cu 0.21216 0.677572 0.5 73 63.546 0.00010763 -3.53619 63.546000 Cu 0.0773596 0.721064 3.08679e-16 87 63.546 5.4122e-05 -3.53467 63.546000 Cu 0.0967556 0.696933 0.5 88 63.546 3.50503e-05 -3.53349 63.546000 Cu 0.192796 0.701726 5.83981e-16 90 63.546 1.59554e-05 -3.53418 63.546000 Cu 0.269507 0.730661 4.55155e-16 91 63.546 2.48697e-05 -3.5344 63.546000 Cu 0.288895 0.706537 0.5 92 63.546 3.5039e-05 -3.5353 63.546000 Cu 0.173456 0.72586 0.5 93 63.546 1.03648e-05 -3.53403 63.546000 Cu 0.0579386 0.745177 0.5 108 63.546 4.37723e-05 -3.53558 63.546000 Cu 0.154036 0.749994 2.04946e-16 111 63.546 2.04075e-05 -3.53449 63.546000 Cu 0.000645831 0.692122 4.75445e-16 86 63.546 6.28913e-05 -3.5347 63.546000 Cu 0.500646 0.692122 5.27552e-16 75 63.546 6.28913e-05 -3.5347 63.546000 Cu 0.520132 0.668025 0.5 76 63.546 0.000325623 -3.53176 63.546000 Cu 0.404449 0.687275 0.5 77 63.546 2.0397e-05 -3.53586 63.546000 Cu 0.616175 0.672793 5.27792e-16 78 63.546 9.81422e-05 -3.53347 63.546000 Cu 0.596756 0.696933 0.5 81 63.546 3.50503e-05 -3.53349 63.546000 Cu 0.385028 0.711375 4.29701e-16 94 63.546 2.06939e-05 -3.53614 63.546000 Cu 0.461763 0.740332 3.98005e-16 95 63.546 1.0117e-06 -3.53587 63.546000 Cu 0.481225 0.716235 0.5 96 63.546 3.73943e-05 -3.53599 63.546000 Cu 0.365603 0.735488 0.5 97 63.546 2.44227e-05 -3.5353 63.546000 Cu 0.57736 0.721064 3.46739e-16 98 63.546 5.4122e-05 -3.53467 63.546000 Cu 0.654036 0.749994 6.69705e-16 99 63.546 2.04075e-05 -3.53449 63.546000 Cu 0.557939 0.745177 0.5 101 63.546 4.37723e-05 -3.53558 63.546000 Cu 0.673456 0.72586 0.5 100 63.546 1.03648e-05 -3.53403 63.546000 Cu 0.692796 0.701726 4.94775e-16 79 63.546 1.59554e-05 -3.53418 63.546000 Cu 0.71216 0.677572 0.5 80 63.546 0.00010763 -3.53619 63.546000 Cu 0.808255 0.682409 7.10646e-16 82 63.546 0.000112167 -3.53664 63.546000 Cu 0.885028 0.711375 4.0725e-16 83 63.546 2.06939e-05 -3.53614 63.546000 Cu 0.904449 0.687275 0.5 84 63.546 2.0397e-05 -3.53586 63.546000 Cu 0.788895 0.706537 0.5 85 63.546 3.5039e-05 -3.5353 63.546000 Cu 0.981225 0.716235 0.5 89 63.546 3.73943e-05 -3.53599 63.546000 Cu 0.769507 0.730661 5.27552e-16 102 63.546 2.48697e-05 -3.5344 63.546000 Cu 0.865603 0.735488 0.5 104 63.546 2.44227e-05 -3.5353 63.546000 Cu 0.961763 0.740332 3.58625e-16 106 63.546 1.0117e-06 -3.53587 63.546000 Cu 0.0384994 0.769282 5.90104e-16 107 63.546 2.46209e-05 -3.53586 63.546000 Cu 0.134648 0.774121 0.5 110 63.546 7.53204e-05 -3.53473 63.546000 Cu 0.23071 0.778921 3.52141e-16 112 63.546 5.76533e-06 -3.53391 63.546000 Cu 0.250077 0.754792 0.5 113 63.546 1.39385e-05 -3.53384 63.546000 Cu 0.326749 0.783709 0.5 117 63.546 5.94846e-05 -3.53358 63.546000 Cu 0.019045 0.793368 0.5 128 63.546 1.32174e-05 -3.53555 63.546000 Cu 0.115224 0.798224 3.72072e-16 130 63.546 6.59473e-05 -3.53617 63.546000 Cu 0.0957211 0.82231 0.5 131 63.546 4.13152e-05 -3.53648 63.546000 Cu 0.19195 0.827174 4.93574e-16 132 63.546 0.00022454 -3.53727 63.546000 Cu 0.211375 0.803056 0.5 133 63.546 0.000113175 -3.53546 63.546000 Cu 0.3074 0.807849 4.60197e-16 134 63.546 1.59516e-05 -3.53365 63.546000 Cu 0.287989 0.831995 0.5 137 63.546 0.000126891 -3.53573 63.546000 Cu 0.346151 0.759601 5.61049e-16 114 63.546 3.5364e-05 -3.534 63.546000 Cu 0.422874 0.788523 5.98508e-16 115 63.546 6.84726e-05 -3.53456 63.546000 Cu 0.442276 0.764429 0.5 116 63.546 3.19069e-05 -3.53541 63.546000 Cu 0.538499 0.769282 6.12196e-16 118 63.546 2.46209e-05 -3.53586 63.546000 Cu 0.615224 0.798224 4.42908e-16 119 63.546 6.59473e-05 -3.53617 63.546000 Cu 0.634648 0.774121 0.5 120 63.546 7.53204e-05 -3.53473 63.546000 Cu 0.519045 0.793368 0.5 121 63.546 1.32174e-05 -3.53555 63.546000 Cu 0.403376 0.812628 0.5 136 63.546 0.000135787 -3.53353 63.546000 Cu 0.499494 0.817448 5.94546e-16 138 63.546 8.58777e-05 -3.53454 63.546000 Cu 0.595721 0.82231 0.5 140 63.546 4.13152e-05 -3.53648 63.546000 Cu 0.846151 0.759601 6.31886e-16 103 63.546 3.5364e-05 -3.534 63.546000 Cu 0.750077 0.754792 0.5 105 63.546 1.39385e-05 -3.53384 63.546000 Cu 0.942276 0.764429 0.5 109 63.546 3.19069e-05 -3.53541 63.546000 Cu 0.73071 0.778921 5.32114e-16 122 63.546 5.76533e-06 -3.53391 63.546000 Cu 0.8074 0.807849 3.20565e-16 123 63.546 1.59516e-05 -3.53365 63.546000 Cu 0.826749 0.783709 0.5 124 63.546 5.94846e-05 -3.53358 63.546000 Cu 0.711375 0.803056 0.5 125 63.546 0.000113175 -3.53546 63.546000 Cu 0.922874 0.788523 5.66932e-16 126 63.546 6.84726e-05 -3.53456 63.546000 Cu 0.999494 0.817448 4.83369e-16 127 63.546 8.58777e-05 -3.53454 63.546000 Cu 0.903376 0.812628 0.5 129 63.546 0.000135787 -3.53353 63.546000 Cu 0.69195 0.827174 2.63536e-16 142 63.546 0.00022454 -3.53727 63.546000 Cu 0.787989 0.831995 0.5 144 63.546 0.000126891 -3.53573 63.546000 Cu 0.0761215 0.846354 3.51541e-16 150 63.546 0.000189624 -3.53312 63.546000 Cu 0.0564477 0.870409 0.5 151 63.546 0.00156538 -3.5293 63.546000 Cu 0.152698 0.875256 4.8529e-16 152 63.546 0.000602331 -3.53471 63.546000 Cu 0.172417 0.851259 0.5 153 63.546 0.000265132 -3.53739 63.546000 Cu 0.26869 0.856144 5.55526e-16 154 63.546 0.000866871 -3.53896 63.546000 Cu 0.249384 0.880176 0.5 157 63.546 0.00102333 -3.53819 63.546000 Cu 0.0368352 0.894576 4.43148e-16 170 63.546 0.00369625 -3.52946 63.546000 Cu 0.132974 0.899203 0.5 172 63.546 0.00485022 -3.52791 63.546000 Cu 0.229778 0.904046 5.2395e-16 174 63.546 0.00269634 -3.52541 63.546000 Cu 0.326429 0.909202 0.5 176 63.546 0.00541887 -3.53368 63.546000 Cu 0.383928 0.836765 5.8182e-16 135 63.546 0.000163569 -3.53322 63.546000 Cu 0.576122 0.846354 3.06398e-16 139 63.546 0.000189624 -3.53312 63.546000 Cu 0.479948 0.841522 0.5 141 63.546 0.000519578 -3.53117 63.546000 Cu 0.3458 0.885119 3.26328e-16 155 63.546 0.00318377 -3.53736 63.546000 Cu 0.364802 0.860944 0.5 156 63.546 0.000389575 -3.53522 63.546000 Cu 0.460621 0.865657 3.89961e-16 158 63.546 0.000674202 -3.5291 63.546000 Cu 0.536835 0.894576 4.29221e-16 159 63.546 0.00369625 -3.52946 63.546000 Cu 0.556448 0.870409 0.5 160 63.546 0.00156538 -3.5293 63.546000 Cu 0.441478 0.889949 0.5 161 63.546 0.00107418 -3.53365 63.546000 Cu 0.652698 0.875256 4.24419e-16 162 63.546 0.000602331 -3.53471 63.546000 Cu 0.632974 0.899203 0.5 165 63.546 0.00485022 -3.52791 63.546000 Cu 0.422266 0.914339 6.45333e-16 178 63.546 0.0124345 -3.54901 63.546000 Cu 0.672417 0.851259 0.5 145 63.546 0.000265132 -3.53739 63.546000 Cu 0.76869 0.856144 4.16855e-16 143 63.546 0.000866871 -3.53896 63.546000 Cu 0.883928 0.836765 4.00887e-16 146 63.546 0.000163569 -3.53322 63.546000 Cu 0.960621 0.865657 4.6656e-16 147 63.546 0.000674202 -3.5291 63.546000 Cu 0.979948 0.841522 0.5 148 63.546 0.000519578 -3.53117 63.546000 Cu 0.864802 0.860944 0.5 149 63.546 0.000389575 -3.53522 63.546000 Cu 0.729778 0.904046 3.98125e-16 163 63.546 0.00269634 -3.52541 63.546000 Cu 0.749384 0.880176 0.5 164 63.546 0.00102333 -3.53819 63.546000 Cu 0.8458 0.885119 2.81905e-16 166 63.546 0.00318377 -3.53736 63.546000 Cu 0.922266 0.914339 2.22114e-16 167 63.546 0.0124345 -3.54901 63.546000 Cu 0.941478 0.889949 0.5 168 63.546 0.00107418 -3.53365 63.546000 Cu 0.826429 0.909202 0.5 169 63.546 0.00541887 -3.53368 63.546000 Cu 0.113885 0.923194 3.77475e-16 171 63.546 0.019631 -3.50746 63.546000 Cu 0.0179973 0.918966 0.5 173 63.546 0.00634382 -3.54227 63.546000 Cu 0.305293 0.933145 6.63702e-16 175 63.546 0.00795853 -3.52956 63.546000 Cu 0.210045 0.927915 0.5 177 63.546 0.0263772 -3.49899 63.546000 Cu 0.0797272 0.973606 3.62227e-16 191 63.546 0.746092 -3.33259 63.546000 Cu 0.0969577 0.947734 0.5 192 63.546 0.107848 -3.46179 63.546000 Cu 0.188438 0.952178 8.08257e-16 194 63.546 0.128671 -3.44737 63.546000 Cu 0.260029 0.980417 1.37171e-15 195 63.546 0.671251 -3.44101 63.546000 Cu 0.282907 0.957342 0.5 196 63.546 0.156742 -3.55642 63.546000 Cu 0.164407 0.978671 0.5 197 63.546 0.616145 -3.44452 63.546000 Cu 0.000783942 0.943314 2.9043e-16 190 63.546 0.0557336 -3.54793 63.546000 Cu 0.500784 0.943314 5.2299e-16 179 63.546 0.0557336 -3.54793 63.546000 Cu 0.517997 0.918966 0.5 180 63.546 0.00634382 -3.54227 63.546000 Cu 0.402637 0.938444 0.5 181 63.546 0.0435167 -3.5615 63.546000 Cu 0.613885 0.923194 3.50341e-16 182 63.546 0.019631 -3.50746 63.546000 Cu 0.596958 0.947734 0.5 185 63.546 0.107848 -3.46179 63.546000 Cu 0.38176 0.961547 1.36102e-15 198 63.546 0.109986 -3.50197 63.546000 Cu 0.46623 0.98897 9.06227e-16 199 63.546 9.19877 -3.05719 63.546000 Cu 0.486086 0.966904 0.5 200 63.546 0.778677 -3.38198 63.546000 Cu 0.368959 0.984445 0.5 201 63.546 3.68159 -3.35761 63.546000 Cu 0.579727 0.973606 2.1371e-16 202 63.546 0.746092 -3.33259 63.546000 Cu 0.664407 0.978671 0.5 204 63.546 0.616145 -3.44452 63.546000 Cu 0.688438 0.952178 2.21154e-16 183 63.546 0.128671 -3.44737 63.546000 Cu 0.710045 0.927915 0.5 184 63.546 0.0263772 -3.49899 63.546000 Cu 0.805293 0.933145 0 186 63.546 0.00795853 -3.52956 63.546000 Cu 0.88176 0.961547 1 187 63.546 0.109986 -3.50197 63.546000 Cu 0.902637 0.938444 0.5 188 63.546 0.0435167 -3.5615 63.546000 Cu 0.782907 0.957342 0.5 189 63.546 0.156742 -3.55642 63.546000 Cu 0.986086 0.966904 0.5 193 63.546 0.778677 -3.38198 63.546000 Cu 0.760029 0.980417 1 206 63.546 0.671251 -3.44101 63.546000 Cu 0.868959 0.984445 0.5 207 63.546 3.68159 -3.35761 63.546000 Cu 0.96623 0.98897 1 208 63.546 9.19877 -3.05719