Number of particles = 396 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0835 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.3064 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60711 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 0.0665792 0.00258575 1.37062e-17 204 63.546 0.424641 -3.52505 63.546000 Cu 0.0524465 0.038697 2.64505e-18 209 63.546 0.0698464 -3.52757 63.546000 Cu 0.190878 0.0423075 6.4443e-17 210 63.546 0.235155 -3.52692 63.546000 Cu 0.131741 0.021029 0.5 211 63.546 0.395275 -3.49829 63.546000 Cu 0.214224 0.00260632 0 213 63.546 4.69275 -3.57902 63.546000 Cu 0.349133 0.0186313 0 214 63.546 7.74261 -3.27247 63.546000 Cu 0.26602 0.0266777 0.5 215 63.546 5.6618 -3.47509 63.546000 Cu 0.423098 0.00259289 0.5 216 63.546 3.41936 -3.49441 63.546000 Cu 0.32806 0.051485 7.45423e-18 227 63.546 0.470005 -3.48059 63.546000 Cu 0.471403 0.0555201 0 228 63.546 0.0313426 -3.52844 63.546000 Cu 0.410259 0.0371177 0.5 229 63.546 0.496536 -3.48975 63.546000 Cu 0.490833 0.0203031 4.80918e-19 231 63.546 0.181934 -3.52642 63.546000 Cu 0.631741 0.021029 2.40459e-19 232 63.546 0.395275 -3.49829 63.546000 Cu 0.566579 0.00258575 0.5 233 63.546 0.424641 -3.52505 63.546000 Cu 0.552447 0.038697 0.5 234 63.546 0.0698464 -3.52757 63.546000 Cu 0.714224 0.00260632 0.5 235 63.546 4.69275 -3.57902 63.546000 Cu 0.690878 0.0423075 0.5 255 63.546 0.235155 -3.52692 63.546000 Cu 0.923098 0.00259289 0 203 63.546 3.41936 -3.49441 63.546000 Cu 0.990833 0.0203031 0.5 205 63.546 0.181934 -3.52642 63.546000 Cu 0.971403 0.0555201 0.5 207 63.546 0.0313426 -3.52844 63.546000 Cu 0.76602 0.0266777 0 257 63.546 5.6618 -3.47509 63.546000 Cu 0.910259 0.0371177 2.98169e-17 258 63.546 0.496536 -3.48975 63.546000 Cu 0.849133 0.0186313 0.5 259 63.546 7.74261 -3.27247 63.546000 Cu 0.82806 0.051485 0.5 260 63.546 0.470005 -3.48059 63.546000 Cu 0.0313144 0.0745157 6.99736e-17 206 63.546 0.0145522 -3.53805 63.546000 Cu 0.111534 0.0582295 0.5 212 63.546 0.0747417 -3.53603 63.546000 Cu 0.0106974 0.109826 5.12178e-17 219 63.546 0.00364073 -3.54067 63.546000 Cu 0.0909329 0.0941528 0.5 221 63.546 0.0239537 -3.54209 63.546000 Cu 0.170543 0.0787894 0 223 63.546 0.0488819 -3.5409 63.546000 Cu 0.248985 0.0640586 0.5 225 63.546 0.0828335 -3.53429 63.546000 Cu 0.229753 0.0996782 0.5 226 63.546 0.0106357 -3.54044 63.546000 Cu 0.309237 0.0857784 0 224 63.546 0.0695973 -3.52017 63.546000 Cu 0.389715 0.0712418 0.5 230 63.546 0.100537 -3.52156 63.546000 Cu 0.369868 0.105731 0.5 247 63.546 0.0262892 -3.52934 63.546000 Cu 0.450597 0.0904195 0 249 63.546 0.00933366 -3.53494 63.546000 Cu 0.590933 0.0941528 1.13016e-17 250 63.546 0.0239537 -3.54209 63.546000 Cu 0.531314 0.0745157 0.5 251 63.546 0.0145522 -3.53805 63.546000 Cu 0.510697 0.109826 0.5 252 63.546 0.00364073 -3.54067 63.546000 Cu 0.611534 0.0582295 2.18818e-17 253 63.546 0.0747417 -3.53603 63.546000 Cu 0.748985 0.0640586 3.22215e-17 254 63.546 0.0828335 -3.53429 63.546000 Cu 0.670543 0.0787894 0.5 256 63.546 0.0488819 -3.5409 63.546000 Cu 0.729753 0.0996782 1.22634e-17 281 63.546 0.0106357 -3.54044 63.546000 Cu 0.950597 0.0904195 0.5 208 63.546 0.00933366 -3.53494 63.546000 Cu 0.869868 0.105731 0 282 63.546 0.0262892 -3.52934 63.546000 Cu 0.809237 0.0857784 0.5 283 63.546 0.0695973 -3.52017 63.546000 Cu 0.889715 0.0712418 0 285 63.546 0.100537 -3.52156 63.546000 Cu 0.150301 0.114396 0 220 63.546 0.0143325 -3.54289 63.546000 Cu 0.070467 0.129584 0.5 222 63.546 0.00762535 -3.54284 63.546000 Cu 0.0502255 0.164806 0.5 239 63.546 0.00206263 -3.54188 63.546000 Cu 0.130127 0.149698 6.39621e-17 241 63.546 0.00429998 -3.54225 63.546000 Cu 0.209807 0.134872 0.5 243 63.546 0.0022283 -3.54044 63.546000 Cu 0.269723 0.155213 3.48665e-17 242 63.546 0.00290692 -3.53663 63.546000 Cu 0.289586 0.120404 1.26481e-16 245 63.546 0.0131988 -3.53194 63.546000 Cu 0.430216 0.125309 3.63093e-17 246 63.546 0.00371819 -3.53726 63.546000 Cu 0.349843 0.140416 0.5 248 63.546 0.00705991 -3.53513 63.546000 Cu 0.410082 0.160198 5.38628e-17 273 63.546 0.00124233 -3.53862 63.546000 Cu 0.490305 0.144953 0.5 275 63.546 0.00105421 -3.54071 63.546000 Cu 0.550226 0.164806 0 274 63.546 0.00206263 -3.54188 63.546000 Cu 0.570467 0.129584 3.17406e-17 277 63.546 0.00762535 -3.54284 63.546000 Cu 0.709807 0.134872 3.91948e-17 278 63.546 0.0022283 -3.54044 63.546000 Cu 0.650301 0.114396 0.5 279 63.546 0.0143325 -3.54289 63.546000 Cu 0.630127 0.149698 0.5 280 63.546 0.00429998 -3.54225 63.546000 Cu 0.990305 0.144953 7.64659e-17 217 63.546 0.00105421 -3.54071 63.546000 Cu 0.930216 0.125309 0.5 218 63.546 0.00371819 -3.53726 63.546000 Cu 0.789586 0.120404 0.5 284 63.546 0.0131988 -3.53194 63.546000 Cu 0.769723 0.155213 0.5 307 63.546 0.00290692 -3.53663 63.546000 Cu 0.849843 0.140416 0 309 63.546 0.00705991 -3.53513 63.546000 Cu 0.910082 0.160198 0.5 310 63.546 0.00124233 -3.53862 63.546000 Cu 0.110035 0.184847 5.53056e-18 238 63.546 0.00121367 -3.54131 63.546000 Cu 0.0300982 0.199909 0.5 240 63.546 0.000542521 -3.54113 63.546000 Cu 0.189886 0.16994 0.5 244 63.546 0.000633714 -3.54004 63.546000 Cu 0.0900085 0.219923 6.90117e-17 265 63.546 0.000321393 -3.54119 63.546000 Cu 0.169933 0.204961 0.5 267 63.546 0.000212742 -3.54047 63.546000 Cu 0.249873 0.1901 5.89124e-17 269 63.546 0.000549973 -3.53851 63.546000 Cu 0.390039 0.195122 2.71719e-17 270 63.546 0.000467509 -3.53905 63.546000 Cu 0.329892 0.175235 0.5 271 63.546 0.00201898 -3.53761 63.546000 Cu 0.309977 0.210119 0.5 272 63.546 0.000482872 -3.53842 63.546000 Cu 0.470167 0.180001 0.5 276 63.546 0.000281393 -3.54033 63.546000 Cu 0.450069 0.21502 0.5 299 63.546 8.8676e-05 -3.54022 63.546000 Cu 0.530098 0.199909 6.15575e-17 301 63.546 0.000542521 -3.54113 63.546000 Cu 0.669933 0.204961 1.49085e-17 302 63.546 0.000212742 -3.54047 63.546000 Cu 0.610035 0.184847 0.5 303 63.546 0.00121367 -3.54131 63.546000 Cu 0.590008 0.219923 0.5 304 63.546 0.000321393 -3.54119 63.546000 Cu 0.689886 0.16994 0 305 63.546 0.000633714 -3.54004 63.546000 Cu 0.749873 0.1901 0.5 308 63.546 0.000549973 -3.53851 63.546000 Cu 0.950069 0.21502 4.92941e-17 236 63.546 8.8676e-05 -3.54022 63.546000 Cu 0.970167 0.180001 4.54467e-17 237 63.546 0.000281393 -3.54033 63.546000 Cu 0.829892 0.175235 0 306 63.546 0.00201898 -3.53761 63.546000 Cu 0.809977 0.210119 2.64505e-17 333 63.546 0.000482872 -3.53842 63.546000 Cu 0.890039 0.195122 0.5 334 63.546 0.000467509 -3.53905 63.546000 Cu 0.0699906 0.254958 0 262 63.546 7.31939e-05 -3.54042 63.546000 Cu 0.0100252 0.234972 0.5 263 63.546 4.83773e-05 -3.54107 63.546000 Cu 0.229956 0.225033 1.56298e-17 266 63.546 0.000100114 -3.53897 63.546000 Cu 0.149976 0.239957 0.5 268 63.546 0.000124195 -3.53978 63.546000 Cu 0.129978 0.27492 0.5 291 63.546 0.000190097 -3.5393 63.546000 Cu 0.209987 0.259959 2.40459e-19 293 63.546 4.45872e-05 -3.53872 63.546000 Cu 0.350045 0.265036 2.40459e-19 294 63.546 0.000128826 -3.54024 63.546000 Cu 0.290008 0.24503 0.5 295 63.546 4.40343e-05 -3.53881 63.546000 Cu 0.370033 0.230065 0 297 63.546 0.000163036 -3.53919 63.546000 Cu 0.430044 0.25003 0.5 300 63.546 6.9911e-05 -3.54062 63.546000 Cu 0.489999 0.270017 7.93515e-18 325 63.546 4.81972e-05 -3.54084 63.546000 Cu 0.510025 0.234972 1.82749e-17 298 63.546 4.83773e-05 -3.54107 63.546000 Cu 0.629978 0.27492 0 326 63.546 0.000190097 -3.5393 63.546000 Cu 0.569991 0.254958 0.5 327 63.546 7.31939e-05 -3.54042 63.546000 Cu 0.649976 0.239957 3.43856e-17 329 63.546 0.000124195 -3.53978 63.546000 Cu 0.729956 0.225033 0.5 331 63.546 0.000100114 -3.53897 63.546000 Cu 0.709987 0.259959 0.5 332 63.546 4.45872e-05 -3.53872 63.546000 Cu 0.930044 0.25003 2.06795e-17 261 63.546 6.9911e-05 -3.54062 63.546000 Cu 0.989999 0.270017 0.5 264 63.546 4.81972e-05 -3.54084 63.546000 Cu 0.790008 0.24503 3.43856e-17 330 63.546 4.40343e-05 -3.53881 63.546000 Cu 0.870033 0.230065 0.5 335 63.546 0.000163036 -3.53919 63.546000 Cu 0.850045 0.265036 0.5 359 63.546 0.000128826 -3.54024 63.546000 Cu 0.0298597 0.324983 0 286 63.546 0.000285171 -3.54053 63.546000 Cu 0.0499368 0.289969 2.40459e-19 289 63.546 8.14547e-05 -3.54017 63.546000 Cu 0.190049 0.294877 2.40459e-19 290 63.546 0.000416225 -3.5387 63.546000 Cu 0.109976 0.309868 0.5 292 63.546 0.00043694 -3.53917 63.546000 Cu 0.170123 0.329757 4.80918e-19 317 63.546 0.00178705 -3.53744 63.546000 Cu 0.250168 0.314884 0.5 319 63.546 0.000595985 -3.53819 63.546000 Cu 0.270059 0.279962 0.5 296 63.546 7.83074e-05 -3.53918 63.546000 Cu 0.33008 0.300032 2.40459e-19 321 63.546 0.000243678 -3.54002 63.546000 Cu 0.469923 0.305073 2.83742e-17 322 63.546 0.000463689 -3.54126 63.546000 Cu 0.410022 0.285065 0.5 323 63.546 0.000296927 -3.54113 63.546000 Cu 0.389955 0.320137 0.5 324 63.546 0.00123833 -3.54113 63.546000 Cu 0.549937 0.289969 0.5 328 63.546 8.14547e-05 -3.54017 63.546000 Cu 0.52986 0.324983 0.5 351 63.546 0.000285171 -3.54053 63.546000 Cu 0.609976 0.309868 0 353 63.546 0.00043694 -3.53917 63.546000 Cu 0.690049 0.294877 0.5 355 63.546 0.000416225 -3.5387 63.546000 Cu 0.670123 0.329757 0.5 356 63.546 0.00178705 -3.53744 63.546000 Cu 0.750168 0.314884 6.56453e-17 354 63.546 0.000595985 -3.53819 63.546000 Cu 0.969923 0.305073 0.5 287 63.546 0.000463689 -3.54126 63.546000 Cu 0.770059 0.279962 0 357 63.546 7.83074e-05 -3.53918 63.546000 Cu 0.910022 0.285065 6.73285e-18 358 63.546 0.000296927 -3.54113 63.546000 Cu 0.83008 0.300032 0.5 360 63.546 0.000243678 -3.54002 63.546000 Cu 0.889955 0.320137 2.40459e-19 383 63.546 0.00123833 -3.54113 63.546000 Cu 0.00969907 0.360027 0 313 63.546 0.00103726 -3.5408 63.546000 Cu 0.150193 0.364563 1.29848e-17 314 63.546 0.00714243 -3.535 63.546000 Cu 0.0899566 0.344784 0.5 315 63.546 0.00127795 -3.5386 63.546000 Cu 0.0697914 0.379677 0.5 316 63.546 0.0034327 -3.53727 63.546000 Cu 0.230278 0.349769 0.5 320 63.546 0.00286735 -3.53663 63.546000 Cu 0.210439 0.384569 0.5 343 63.546 0.013545 -3.53209 63.546000 Cu 0.310154 0.335035 0 318 63.546 0.000589514 -3.54002 63.546000 Cu 0.290207 0.370107 4.4004e-17 345 63.546 0.00227004 -3.54059 63.546000 Cu 0.429568 0.375391 2.40459e-19 346 63.546 0.00737432 -3.54282 63.546000 Cu 0.369911 0.355281 0.5 347 63.546 0.00422441 -3.54236 63.546000 Cu 0.449785 0.340177 2.40459e-19 349 63.546 0.00216279 -3.54188 63.546000 Cu 0.589957 0.344784 0 350 63.546 0.00127795 -3.5386 63.546000 Cu 0.509699 0.360027 0.5 352 63.546 0.00103726 -3.5408 63.546000 Cu 0.569791 0.379677 0 375 63.546 0.0034327 -3.53727 63.546000 Cu 0.710439 0.384569 9.0653e-17 376 63.546 0.013545 -3.53209 63.546000 Cu 0.650193 0.364563 0.5 377 63.546 0.00714243 -3.535 63.546000 Cu 0.730278 0.349769 1.22634e-17 379 63.546 0.00286735 -3.53663 63.546000 Cu 0.949785 0.340177 0.5 288 63.546 0.00216279 -3.54188 63.546000 Cu 0.929568 0.375391 0.5 312 63.546 0.00737432 -3.54282 63.546000 Cu 0.869911 0.355281 0 380 63.546 0.00422441 -3.54236 63.546000 Cu 0.810154 0.335035 0.5 381 63.546 0.000589514 -3.54002 63.546000 Cu 0.790207 0.370107 0.5 382 63.546 0.00227004 -3.54059 63.546000 Cu 0.110301 0.433731 1.22634e-17 338 63.546 0.100173 -3.52132 63.546000 Cu 0.0494101 0.414551 0.5 339 63.546 0.00955134 -3.53492 63.546000 Cu 0.130133 0.399248 5.14582e-17 341 63.546 0.0259513 -3.52948 63.546000 Cu 0.190759 0.419202 0.5 344 63.546 0.0680787 -3.52016 63.546000 Cu 0.250968 0.440905 2.40459e-19 367 63.546 0.0821789 -3.53422 63.546000 Cu 0.270282 0.405294 4.80918e-19 342 63.546 0.0103974 -3.54058 63.546000 Cu 0.349715 0.390582 0.5 348 63.546 0.014546 -3.54288 63.546000 Cu 0.329466 0.426177 0.5 369 63.546 0.0482813 -3.54109 63.546000 Cu 0.409076 0.410818 0 371 63.546 0.0238944 -3.54205 63.546000 Cu 0.489341 0.395148 0.5 373 63.546 0.00360457 -3.54047 63.546000 Cu 0.468692 0.430454 0.5 374 63.546 0.0144252 -3.5382 63.546000 Cu 0.54941 0.414551 5.79506e-17 372 63.546 0.00955134 -3.53492 63.546000 Cu 0.630133 0.399248 0.5 378 63.546 0.0259513 -3.52948 63.546000 Cu 0.610301 0.433731 0.5 391 63.546 0.100173 -3.52132 63.546000 Cu 0.690759 0.419202 1.02916e-16 393 63.546 0.0680787 -3.52016 63.546000 Cu 0.750968 0.440905 0.5 396 63.546 0.0821789 -3.53422 63.546000 Cu 0.909076 0.410818 0.5 198 63.546 0.0238944 -3.54205 63.546000 Cu 0.849715 0.390582 1.29848e-17 202 63.546 0.014546 -3.54288 63.546000 Cu 0.989341 0.395148 2.40459e-19 311 63.546 0.00360457 -3.54047 63.546000 Cu 0.968692 0.430454 3.07787e-17 337 63.546 0.0144252 -3.5382 63.546000 Cu 0.829466 0.426177 7.11758e-17 394 63.546 0.0482813 -3.54109 63.546000 Cu 0.770282 0.405294 0.5 395 63.546 0.0103974 -3.54058 63.546000 Cu 0.0285941 0.449451 0.5 340 63.546 0.0309638 -3.52819 63.546000 Cu 0.00915278 0.484651 0.5 362 63.546 0.182484 -3.52629 63.546000 Cu 0.0897144 0.467843 1.00512e-16 363 63.546 0.495233 -3.48999 63.546000 Cu 0.233971 0.478271 2.90955e-17 364 63.546 5.65614 -3.47508 63.546000 Cu 0.171954 0.453476 0.5 365 63.546 0.470591 -3.48045 63.546000 Cu 0.150893 0.48634 0.5 366 63.546 7.7411 -3.27319 63.546000 Cu 0.388493 0.446731 1.99581e-17 368 63.546 0.0738225 -3.53643 63.546000 Cu 0.309122 0.462651 0.5 370 63.546 0.234851 -3.52717 63.546000 Cu 0.368229 0.483913 0 385 63.546 0.39472 -3.49857 63.546000 Cu 0.447586 0.46626 0.5 387 63.546 0.068875 -3.52731 63.546000 Cu 0.733971 0.478271 0.5 16 63.546 5.65614 -3.47508 63.546000 Cu 0.650893 0.48634 0 195 63.546 7.7411 -3.27319 63.546000 Cu 0.509153 0.484651 0 386 63.546 0.182484 -3.52629 63.546000 Cu 0.528594 0.449451 2.40459e-19 389 63.546 0.0309638 -3.52819 63.546000 Cu 0.671954 0.453476 7.69469e-17 390 63.546 0.470591 -3.48045 63.546000 Cu 0.589714 0.467843 0.5 392 63.546 0.495233 -3.48999 63.546000 Cu 0.868229 0.483913 0.5 1 63.546 0.39472 -3.49857 63.546000 Cu 0.888493 0.446731 0.5 5 63.546 0.0738225 -3.53643 63.546000 Cu 0.809122 0.462651 7.21377e-19 15 63.546 0.234851 -3.52717 63.546000 Cu 0.947586 0.46626 1.17825e-17 336 63.546 0.068875 -3.52731 63.546000 Cu 0.00916702 0.520072 0.5 2 63.546 0.182376 -3.52642 63.546000 Cu 0.0286393 0.555302 0.5 11 63.546 0.0335947 -3.52852 63.546000 Cu 0.0768872 0.502362 2.33245e-17 32 63.546 3.42395 -3.49427 63.546000 Cu 0.0897106 0.536872 1.63512e-17 33 63.546 0.496597 -3.49073 63.546000 Cu 0.150985 0.518351 0.5 34 63.546 7.73811 -3.27384 63.546000 Cu 0.23402 0.52646 2.40459e-19 35 63.546 5.6558 -3.47463 63.546000 Cu 0.172026 0.551209 0.5 38 63.546 0.455691 -3.48161 63.546000 Cu 0.285773 0.50233 0.5 384 63.546 4.68784 -3.57937 63.546000 Cu 0.368229 0.520779 0 14 63.546 0.400124 -3.49818 63.546000 Cu 0.447543 0.538448 0.5 20 63.546 0.0698208 -3.52717 63.546000 Cu 0.309155 0.54204 0.5 37 63.546 0.235588 -3.52601 63.546000 Cu 0.433429 0.502359 0.5 388 63.546 0.423114 -3.52527 63.546000 Cu 0.650985 0.518351 2.74123e-17 3 63.546 7.73811 -3.27384 63.546000 Cu 0.576887 0.502362 0.5 4 63.546 3.42395 -3.49427 63.546000 Cu 0.73402 0.52646 0.5 8 63.546 5.6558 -3.47463 63.546000 Cu 0.509167 0.520072 0 17 63.546 0.182376 -3.52642 63.546000 Cu 0.528639 0.555302 0 18 63.546 0.0335947 -3.52852 63.546000 Cu 0.589711 0.536872 0.5 19 63.546 0.496597 -3.49073 63.546000 Cu 0.672026 0.551209 3.60688e-17 21 63.546 0.455691 -3.48161 63.546000 Cu 0.785773 0.50233 5.12178e-17 194 63.546 4.68784 -3.57937 63.546000 Cu 0.809155 0.54204 0 6 63.546 0.235588 -3.52601 63.546000 Cu 0.868229 0.520779 0.5 7 63.546 0.400124 -3.49818 63.546000 Cu 0.947543 0.538448 8.75271e-17 9 63.546 0.0698208 -3.52717 63.546000 Cu 0.933429 0.502359 1.03397e-16 361 63.546 0.423114 -3.52527 63.546000 Cu 0.0496188 0.590188 0.5 13 63.546 0.00975356 -3.53469 63.546000 Cu 0.110433 0.570991 2.83742e-17 58 63.546 0.0991273 -3.52163 63.546000 Cu 0.130285 0.605486 4.90536e-17 59 63.546 0.0253222 -3.5295 63.546000 Cu 0.19096 0.585527 0.5 60 63.546 0.0673333 -3.52029 63.546000 Cu 0.251096 0.563829 4.28017e-17 36 63.546 0.0796213 -3.53442 63.546000 Cu 0.388445 0.557981 7.88705e-17 39 63.546 0.0769816 -3.53619 63.546000 Cu 0.409245 0.593916 5.07368e-17 40 63.546 0.0244836 -3.54187 63.546000 Cu 0.468733 0.574269 0.5 41 63.546 0.015477 -3.53775 63.546000 Cu 0.329561 0.578556 0.5 42 63.546 0.0482784 -3.54069 63.546000 Cu 0.489424 0.60958 0.5 46 63.546 0.00392969 -3.54053 63.546000 Cu 0.270433 0.599463 2.40459e-19 61 63.546 0.0099585 -3.54028 63.546000 Cu 0.69096 0.585527 2.40459e-19 22 63.546 0.0673333 -3.52029 63.546000 Cu 0.610433 0.570991 0.5 24 63.546 0.0991273 -3.52163 63.546000 Cu 0.549619 0.590188 2.40459e-19 43 63.546 0.00975356 -3.53469 63.546000 Cu 0.630285 0.605486 0.5 45 63.546 0.0253222 -3.5295 63.546000 Cu 0.751096 0.563829 0.5 23 63.546 0.0796213 -3.53442 63.546000 Cu 0.968733 0.574269 7.5985e-17 10 63.546 0.015477 -3.53775 63.546000 Cu 0.888445 0.557981 0.5 12 63.546 0.0769816 -3.53619 63.546000 Cu 0.829561 0.578556 0 25 63.546 0.0482784 -3.54069 63.546000 Cu 0.909245 0.593916 0.5 27 63.546 0.0244836 -3.54187 63.546000 Cu 0.770433 0.599463 0.5 28 63.546 0.0099585 -3.54028 63.546000 Cu 0.989424 0.60958 0 29 63.546 0.00392969 -3.54053 63.546000 Cu 0.00966754 0.644739 3.12597e-18 30 63.546 0.00113507 -3.54082 63.546000 Cu 0.210475 0.620175 0.5 64 63.546 0.0123336 -3.53224 63.546000 Cu 0.0698303 0.625089 0.5 82 63.546 0.00388809 -3.53753 63.546000 Cu 0.150133 0.640213 4.0878e-18 83 63.546 0.00721896 -3.53543 63.546000 Cu 0.230223 0.655021 0.5 85 63.546 0.00269645 -3.53671 63.546000 Cu 0.0898866 0.660019 0.5 86 63.546 0.00141094 -3.53862 63.546000 Cu 0.290173 0.634669 0 62 63.546 0.00192713 -3.54036 63.546000 Cu 0.349824 0.614176 0.5 63 63.546 0.0137625 -3.54265 63.546000 Cu 0.429561 0.629357 0 65 63.546 0.00805594 -3.54276 63.546000 Cu 0.449741 0.664616 2.40459e-19 66 63.546 0.00226701 -3.54192 63.546000 Cu 0.369848 0.649498 0.5 68 63.546 0.00424794 -3.54215 63.546000 Cu 0.56983 0.625089 4.4004e-17 44 63.546 0.00388809 -3.53753 63.546000 Cu 0.710475 0.620175 3.12597e-18 47 63.546 0.0123336 -3.53224 63.546000 Cu 0.730223 0.655021 0 48 63.546 0.00269645 -3.53671 63.546000 Cu 0.650133 0.640213 0.5 50 63.546 0.00721896 -3.53543 63.546000 Cu 0.509668 0.644739 0.5 67 63.546 0.00113507 -3.54082 63.546000 Cu 0.589887 0.660019 7.21377e-19 69 63.546 0.00141094 -3.53862 63.546000 Cu 0.849824 0.614176 5.38628e-17 26 63.546 0.0137625 -3.54265 63.546000 Cu 0.929561 0.629357 0.5 31 63.546 0.00805594 -3.54276 63.546000 Cu 0.790173 0.634669 0.5 49 63.546 0.00192713 -3.54036 63.546000 Cu 0.869848 0.649498 3.48665e-17 51 63.546 0.00424794 -3.54215 63.546000 Cu 0.949741 0.664616 0.5 53 63.546 0.00226701 -3.54192 63.546000 Cu 0.0298091 0.679838 0 55 63.546 0.000300522 -3.54039 63.546000 Cu 0.0499151 0.714915 6.49239e-18 56 63.546 9.10099e-05 -3.54033 63.546000 Cu 0.17007 0.675075 2.40459e-19 84 63.546 0.00214499 -3.53762 63.546000 Cu 0.109931 0.694991 0.5 108 63.546 0.000537105 -3.53902 63.546000 Cu 0.190006 0.710012 4.80918e-19 109 63.546 0.000533994 -3.53856 63.546000 Cu 0.250088 0.689957 0.5 90 63.546 0.00054198 -3.53864 63.546000 Cu 0.31007 0.669766 2.40459e-19 87 63.546 0.000580078 -3.53999 63.546000 Cu 0.330046 0.704836 7.21377e-19 88 63.546 0.000221292 -3.54051 63.546000 Cu 0.389935 0.684685 0.5 89 63.546 0.00133274 -3.54135 63.546000 Cu 0.469886 0.699774 2.40459e-19 91 63.546 0.000584625 -3.54121 63.546000 Cu 0.409979 0.719818 0.5 94 63.546 0.000387505 -3.54121 63.546000 Cu 0.609931 0.694991 4.54467e-17 70 63.546 0.000537105 -3.53902 63.546000 Cu 0.67007 0.675075 0.5 71 63.546 0.00214499 -3.53762 63.546000 Cu 0.529809 0.679838 0.5 72 63.546 0.000300522 -3.54039 63.546000 Cu 0.690006 0.710012 0.5 76 63.546 0.000533994 -3.53856 63.546000 Cu 0.549915 0.714915 0.5 93 63.546 9.10099e-05 -3.54033 63.546000 Cu 0.750088 0.689957 2.40459e-19 73 63.546 0.00054198 -3.53864 63.546000 Cu 0.889935 0.684685 0 52 63.546 0.00133274 -3.54135 63.546000 Cu 0.81007 0.669766 0.5 54 63.546 0.000580078 -3.53999 63.546000 Cu 0.969886 0.699774 0.5 57 63.546 0.000584625 -3.54121 63.546000 Cu 0.830046 0.704836 0.5 75 63.546 0.000221292 -3.54051 63.546000 Cu 0.909979 0.719818 2.3565e-17 77 63.546 0.000387505 -3.54121 63.546000 Cu 0.0100126 0.770011 0.5 81 63.546 5.00363e-05 -3.54088 63.546000 Cu 0.209993 0.744983 1.27443e-17 110 63.546 5.37418e-05 -3.5388 63.546000 Cu 0.129955 0.729996 0.5 112 63.546 0.000210638 -3.53931 63.546000 Cu 0.0699579 0.749993 0 132 63.546 8.87574e-05 -3.54066 63.546000 Cu 0.149962 0.765025 0.5 134 63.546 0.0001557 -3.54021 63.546000 Cu 0.489969 0.734901 0 92 63.546 5.10203e-05 -3.54112 63.546000 Cu 0.270032 0.724946 0.5 111 63.546 9.7774e-05 -3.53905 63.546000 Cu 0.350025 0.73989 0 113 63.546 0.000149797 -3.53977 63.546000 Cu 0.370042 0.774915 0 114 63.546 0.000235383 -3.53937 63.546000 Cu 0.430013 0.754918 0.5 115 63.546 9.32189e-05 -3.54045 63.546000 Cu 0.29002 0.75993 0.5 116 63.546 5.30677e-05 -3.53872 63.546000 Cu 0.629955 0.729996 9.61836e-19 95 63.546 0.000210638 -3.53931 63.546000 Cu 0.649962 0.765025 2.71719e-17 96 63.546 0.0001557 -3.54021 63.546000 Cu 0.709993 0.744983 0.5 97 63.546 5.37418e-05 -3.5388 63.546000 Cu 0.569958 0.749993 0.5 98 63.546 8.87574e-05 -3.54066 63.546000 Cu 0.510013 0.770011 0 117 63.546 5.00363e-05 -3.54088 63.546000 Cu 0.770032 0.724946 1.82749e-17 74 63.546 9.7774e-05 -3.53905 63.546000 Cu 0.930013 0.754918 0 78 63.546 9.32189e-05 -3.54045 63.546000 Cu 0.989969 0.734901 0.5 79 63.546 5.10203e-05 -3.54112 63.546000 Cu 0.850025 0.73989 0.5 80 63.546 0.000149797 -3.53977 63.546000 Cu 0.79002 0.75993 2.06795e-17 99 63.546 5.30677e-05 -3.53872 63.546000 Cu 0.870042 0.774915 0.5 101 63.546 0.000235383 -3.53937 63.546000 Cu 0.0301043 0.805134 0.5 105 63.546 0.00049605 -3.54126 63.546000 Cu 0.0899946 0.785094 4.30422e-17 133 63.546 0.000363749 -3.54111 63.546000 Cu 0.229961 0.779972 2.40459e-19 135 63.546 7.89802e-05 -3.53926 63.546000 Cu 0.249877 0.814956 4.49658e-17 136 63.546 0.000576893 -3.53835 63.546000 Cu 0.169946 0.800082 0.5 138 63.546 0.000252581 -3.54006 63.546000 Cu 0.110081 0.820225 6.15575e-17 158 63.546 0.00130714 -3.54116 63.546000 Cu 0.450087 0.789997 0.5 120 63.546 8.50869e-05 -3.54027 63.546000 Cu 0.309978 0.794909 0.5 137 63.546 0.000468873 -3.53882 63.546000 Cu 0.390061 0.809926 0 139 63.546 0.000505672 -3.53923 63.546000 Cu 0.470178 0.825078 0.5 141 63.546 0.000305846 -3.54062 63.546000 Cu 0.329923 0.829849 0.5 142 63.546 0.00191699 -3.53759 63.546000 Cu 0.729961 0.779972 0.5 102 63.546 7.89802e-05 -3.53926 63.546000 Cu 0.530104 0.805134 0 118 63.546 0.00049605 -3.54126 63.546000 Cu 0.589995 0.785094 0.5 119 63.546 0.000363749 -3.54111 63.546000 Cu 0.669946 0.800082 0 121 63.546 0.000252581 -3.54006 63.546000 Cu 0.749877 0.814956 0.5 123 63.546 0.000576893 -3.53835 63.546000 Cu 0.610081 0.820225 0.5 124 63.546 0.00130714 -3.54116 63.546000 Cu 0.809978 0.794909 1.80344e-17 100 63.546 0.000468873 -3.53882 63.546000 Cu 0.950087 0.789997 0 103 63.546 8.50869e-05 -3.54027 63.546000 Cu 0.970178 0.825078 2.88551e-18 104 63.546 0.000305846 -3.54062 63.546000 Cu 0.890061 0.809926 0.5 106 63.546 0.000505672 -3.53923 63.546000 Cu 0.829923 0.829849 7.38209e-17 125 63.546 0.00191699 -3.53759 63.546000 Cu 0.0502531 0.840301 0.5 107 63.546 0.00232828 -3.54199 63.546000 Cu 0.13013 0.855418 2.59696e-17 159 63.546 0.00415432 -3.54229 63.546000 Cu 0.189907 0.835141 0.5 160 63.546 0.000530319 -3.53996 63.546000 Cu 0.209821 0.870251 0.5 164 63.546 0.00193536 -3.54051 63.546000 Cu 0.0704122 0.875562 0.5 180 63.546 0.00782927 -3.54272 63.546000 Cu 0.41009 0.844901 6.7088e-17 140 63.546 0.00141011 -3.53861 63.546000 Cu 0.49033 0.860181 0.5 146 63.546 0.00113061 -3.54087 63.546000 Cu 0.269781 0.849898 1.00993e-17 161 63.546 0.00266638 -3.53675 63.546000 Cu 0.289522 0.884747 3.89543e-17 162 63.546 0.0124627 -3.53234 63.546000 Cu 0.349843 0.86471 0.5 163 63.546 0.00716679 -3.53526 63.546000 Cu 0.430161 0.879841 0 165 63.546 0.00366889 -3.53744 63.546000 Cu 0.689907 0.835141 0 122 63.546 0.000530319 -3.53996 63.546000 Cu 0.550253 0.840301 1.17825e-17 143 63.546 0.00232828 -3.54199 63.546000 Cu 0.570412 0.875562 2.40459e-18 144 63.546 0.00782927 -3.54272 63.546000 Cu 0.63013 0.855418 0.5 145 63.546 0.00415432 -3.54229 63.546000 Cu 0.709821 0.870251 2.40459e-19 147 63.546 0.00193536 -3.54051 63.546000 Cu 0.849843 0.86471 7.09354e-17 126 63.546 0.00716679 -3.53526 63.546000 Cu 0.91009 0.844901 0.5 127 63.546 0.00141011 -3.53861 63.546000 Cu 0.769781 0.849898 0.5 128 63.546 0.00266638 -3.53675 63.546000 Cu 0.99033 0.860181 9.13744e-18 129 63.546 0.00113061 -3.54087 63.546000 Cu 0.930161 0.879841 0.5 131 63.546 0.00366889 -3.53744 63.546000 Cu 0.789522 0.884747 0.5 149 63.546 0.0124627 -3.53234 63.546000 Cu 0.0105502 0.895346 1.70726e-17 130 63.546 0.00390744 -3.54043 63.546000 Cu 0.0312411 0.930669 3.55879e-17 155 63.546 0.015354 -3.53794 63.546000 Cu 0.15017 0.890749 0 181 63.546 0.0138825 -3.54255 63.546000 Cu 0.170418 0.926369 0 182 63.546 0.0474052 -3.54079 63.546000 Cu 0.229536 0.905462 0.5 183 63.546 0.00974152 -3.54034 63.546000 Cu 0.090745 0.91101 0.5 184 63.546 0.0243117 -3.5418 63.546000 Cu 0.248932 0.941102 0.5 188 63.546 0.0786279 -3.53441 63.546000 Cu 0.450365 0.914742 8.92103e-17 166 63.546 0.00986235 -3.53494 63.546000 Cu 0.369715 0.899444 0.5 168 63.546 0.025023 -3.52967 63.546000 Cu 0.309043 0.919413 2.40459e-19 185 63.546 0.0658744 -3.52055 63.546000 Cu 0.38954 0.933956 0.5 187 63.546 0.0979234 -3.52158 63.546000 Cu 0.729536 0.905462 1.13737e-16 148 63.546 0.00974152 -3.54034 63.546000 Cu 0.65017 0.890749 0.5 150 63.546 0.0138825 -3.54255 63.546000 Cu 0.51055 0.895346 0.5 167 63.546 0.00390744 -3.54043 63.546000 Cu 0.590745 0.91101 0 169 63.546 0.0243117 -3.5418 63.546000 Cu 0.670418 0.926369 0.5 171 63.546 0.0474052 -3.54079 63.546000 Cu 0.531241 0.930669 0.5 172 63.546 0.015354 -3.53794 63.546000 Cu 0.748932 0.941102 0 173 63.546 0.0786279 -3.53441 63.546000 Cu 0.869715 0.899444 7.28591e-17 151 63.546 0.025023 -3.52967 63.546000 Cu 0.88954 0.933956 0 152 63.546 0.0979234 -3.52158 63.546000 Cu 0.950365 0.914742 0.5 153 63.546 0.00986235 -3.53494 63.546000 Cu 0.809043 0.919413 0.5 154 63.546 0.0658744 -3.52055 63.546000 Cu 0.0524221 0.966488 0 156 63.546 0.0694733 -3.52691 63.546000 Cu 0.111509 0.94695 0.5 196 63.546 0.0761543 -3.53632 63.546000 Cu 0.190824 0.962891 0 197 63.546 0.234611 -3.52613 63.546000 Cu 0.131765 0.984159 0.5 200 63.546 0.401011 -3.49812 63.546000 Cu 0.32796 0.953732 2.40459e-19 186 63.546 0.454569 -3.48166 63.546000 Cu 0.471342 0.949645 0 189 63.546 0.0331104 -3.52826 63.546000 Cu 0.490817 0.984873 0 190 63.546 0.182394 -3.52651 63.546000 Cu 0.410288 0.968072 0.5 192 63.546 0.494663 -3.49086 63.546000 Cu 0.265975 0.978469 0.5 199 63.546 5.65925 -3.47437 63.546000 Cu 0.348985 0.986608 2.40459e-19 201 63.546 7.74426 -3.27519 63.546000 Cu 0.611509 0.94695 0 170 63.546 0.0761543 -3.53632 63.546000 Cu 0.690824 0.962891 0.5 176 63.546 0.234611 -3.52613 63.546000 Cu 0.552422 0.966488 0.5 191 63.546 0.0694733 -3.52691 63.546000 Cu 0.631765 0.984159 0 193 63.546 0.401011 -3.49812 63.546000 Cu 0.971342 0.949645 0.5 157 63.546 0.0331104 -3.52826 63.546000 Cu 0.765975 0.978469 0 174 63.546 5.65925 -3.47437 63.546000 Cu 0.82796 0.953732 0.5 175 63.546 0.454569 -3.48166 63.546000 Cu 0.910288 0.968072 0 177 63.546 0.494663 -3.49086 63.546000 Cu 0.990817 0.984873 0.5 178 63.546 0.182394 -3.52651 63.546000 Cu 0.848985 0.986608 0.5 179 63.546 7.74426 -3.27519