Number of particles = 402 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0925 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.3755 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60723 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 0.0429008 0.0446666 1 208 63.546 0.0696661 -3.53592 63.546000 Cu 0.0642821 0.00819417 4.62869e-17 211 63.546 0.361139 -3.50021 63.546000 Cu 0.198766 0.0135658 1 212 63.546 5.52696 -3.47787 63.546000 Cu 0.12279 0.0288494 0.5 213 63.546 0.256788 -3.52863 63.546000 Cu 0.180183 0.0502827 1.25756e-16 225 63.546 0.0870212 -3.5336 63.546000 Cu 0.281634 0.00560972 0.5 214 63.546 7.72259 -3.27833 63.546000 Cu 0.320452 0.0574591 1 226 63.546 0.102338 -3.52106 63.546000 Cu 0.259469 0.0380175 0.5 227 63.546 0.48349 -3.48246 63.546000 Cu 0.342265 0.0238848 1 229 63.546 0.482176 -3.48878 63.546000 Cu 0.484271 0.0255525 4.66475e-17 230 63.546 0.0577424 -3.52565 63.546000 Cu 0.423365 0.00744203 0.5 231 63.546 0.175976 -3.52492 63.546000 Cu 0.402672 0.042034 0.5 232 63.546 0.030275 -3.52734 63.546000 Cu 0.564282 0.00819417 0.5 233 63.546 0.361139 -3.50021 63.546000 Cu 0.542901 0.0446666 0.5 253 63.546 0.0696661 -3.53592 63.546000 Cu 0.62279 0.0288494 7.57421e-18 255 63.546 0.256788 -3.52863 63.546000 Cu 0.698766 0.0135658 0.5 257 63.546 5.52696 -3.47787 63.546000 Cu 0.680183 0.0502827 0.5 258 63.546 0.0870212 -3.5336 63.546000 Cu 0.781634 0.00560972 6.85286e-18 201 63.546 7.72259 -3.27833 63.546000 Cu 0.923365 0.00744203 6.85286e-18 202 63.546 0.175976 -3.52492 63.546000 Cu 0.842265 0.0238848 0.5 203 63.546 0.482176 -3.48878 63.546000 Cu 0.820452 0.0574591 0.5 205 63.546 0.102338 -3.52106 63.546000 Cu 0.902672 0.042034 1 207 63.546 0.030275 -3.52734 63.546000 Cu 0.984271 0.0255525 0.5 209 63.546 0.0577424 -3.52565 63.546000 Cu 0.759469 0.0380175 1.93683e-16 256 63.546 0.48349 -3.48246 63.546000 Cu 0.0211451 0.0800042 6.85286e-18 221 63.546 0.023952 -3.54165 63.546000 Cu 0.159695 0.0853892 1.06279e-16 222 63.546 0.0121761 -3.54098 63.546000 Cu 0.101287 0.0647739 0.5 223 63.546 0.0591991 -3.54127 63.546000 Cu 0.0799753 0.0999012 0.5 224 63.546 0.0172386 -3.5434 63.546000 Cu 0.239484 0.0717288 0.5 228 63.546 0.0712168 -3.51948 63.546000 Cu 0.219011 0.105859 0.5 245 63.546 0.0135361 -3.53256 63.546000 Cu 0.299599 0.0914179 1 247 63.546 0.027099 -3.5297 63.546000 Cu 0.440407 0.0954733 2.46462e-17 248 63.546 0.00332962 -3.54003 63.546000 Cu 0.380702 0.0763782 0.5 249 63.546 0.0105673 -3.53485 63.546000 Cu 0.359557 0.110732 0.5 250 63.546 0.00412993 -3.53725 63.546000 Cu 0.462069 0.060734 1 251 63.546 0.0118671 -3.53752 63.546000 Cu 0.499802 0.114923 0.5 277 63.546 0.0079068 -3.54261 63.546000 Cu 0.601287 0.0647739 1 252 63.546 0.0591991 -3.54127 63.546000 Cu 0.521145 0.0800042 0.5 254 63.546 0.023952 -3.54165 63.546000 Cu 0.579975 0.0999012 1 279 63.546 0.0172386 -3.5434 63.546000 Cu 0.719011 0.105859 1 280 63.546 0.0135361 -3.53256 63.546000 Cu 0.659695 0.0853892 0.5 281 63.546 0.0121761 -3.54098 63.546000 Cu 0.739484 0.0717288 2.03903e-16 283 63.546 0.0712168 -3.51948 63.546000 Cu 0.880702 0.0763782 6.85286e-18 204 63.546 0.0105673 -3.53485 63.546000 Cu 0.799599 0.0914179 0.5 206 63.546 0.027099 -3.5297 63.546000 Cu 0.962069 0.060734 0.5 210 63.546 0.0118671 -3.53752 63.546000 Cu 0.859557 0.110732 1 217 63.546 0.00412993 -3.53725 63.546000 Cu 0.999802 0.114923 1.84667e-16 218 63.546 0.0079068 -3.54261 63.546000 Cu 0.940407 0.0954733 0.5 219 63.546 0.00332962 -3.54003 63.546000 Cu 0.118139 0.154733 2.29631e-17 240 63.546 0.000593597 -3.54055 63.546000 Cu 0.0589625 0.134751 0.5 241 63.546 0.00464244 -3.54238 63.546000 Cu 0.0378764 0.169447 0.5 242 63.546 0.00121401 -3.54135 63.546000 Cu 0.138991 0.120123 1.13012e-17 243 63.546 0.00244952 -3.54103 63.546000 Cu 0.198388 0.140198 0.5 246 63.546 0.00279256 -3.53681 63.546000 Cu 0.177493 0.174645 0.5 269 63.546 0.000759521 -3.53904 63.546000 Cu 0.278841 0.125616 1.45473e-16 244 63.546 0.0074947 -3.53527 63.546000 Cu 0.257975 0.159964 1 271 63.546 0.00216213 -3.53762 63.546000 Cu 0.398118 0.164654 1 272 63.546 0.000348106 -3.53981 63.546000 Cu 0.338563 0.145132 0.5 273 63.546 0.00140794 -3.53827 63.546000 Cu 0.419282 0.13009 6.85286e-18 275 63.546 0.00116033 -3.54032 63.546000 Cu 0.478639 0.14966 0.5 278 63.546 0.00239406 -3.54167 63.546000 Cu 0.558963 0.134751 8.96883e-17 276 63.546 0.00464244 -3.54238 63.546000 Cu 0.638991 0.120123 0.5 282 63.546 0.00244952 -3.54103 63.546000 Cu 0.537876 0.169447 8.92074e-17 303 63.546 0.00121401 -3.54135 63.546000 Cu 0.677493 0.174645 6.85286e-18 304 63.546 0.000759521 -3.53904 63.546000 Cu 0.618139 0.154733 0.5 305 63.546 0.000593597 -3.54055 63.546000 Cu 0.698388 0.140198 2.40451e-19 307 63.546 0.00279256 -3.53681 63.546000 Cu 0.838563 0.145132 1 215 63.546 0.00140794 -3.53827 63.546000 Cu 0.778841 0.125616 0.5 216 63.546 0.0074947 -3.53527 63.546000 Cu 0.919282 0.13009 0.5 220 63.546 0.00116033 -3.54032 63.546000 Cu 0.898118 0.164654 0.5 237 63.546 0.000348106 -3.53981 63.546000 Cu 0.978639 0.14966 9.70221e-17 239 63.546 0.00239406 -3.54167 63.546000 Cu 0.757975 0.159964 0.5 308 63.546 0.00216213 -3.53762 63.546000 Cu 0.076612 0.2239 1 264 63.546 5.01249e-05 -3.54069 63.546000 Cu 0.0169868 0.204066 0.5 265 63.546 0.000404338 -3.54045 63.546000 Cu 0.0971784 0.189317 2.32035e-17 267 63.546 0.000217576 -3.54032 63.546000 Cu 0.237046 0.194406 1 268 63.546 0.000853837 -3.5392 63.546000 Cu 0.156736 0.209157 0.5 270 63.546 0.000437482 -3.53993 63.546000 Cu 0.216524 0.2289 1.33571e-16 295 63.546 0.000322141 -3.53964 63.546000 Cu 0.317544 0.179578 0.5 274 63.546 0.000392341 -3.53875 63.546000 Cu 0.356659 0.233708 6.85286e-18 296 63.546 0.000226022 -3.53953 63.546000 Cu 0.296815 0.214061 0.5 297 63.546 0.000102977 -3.53943 63.546000 Cu 0.377161 0.199182 1 299 63.546 0.000246563 -3.53957 63.546000 Cu 0.457532 0.184295 0.5 301 63.546 0.00081236 -3.54039 63.546000 Cu 0.436842 0.218874 0.5 302 63.546 0.000416048 -3.5401 63.546000 Cu 0.516987 0.204066 6.85286e-18 300 63.546 0.000404338 -3.54045 63.546000 Cu 0.597178 0.189317 0.5 306 63.546 0.000217576 -3.54032 63.546000 Cu 0.576612 0.2239 0.5 329 63.546 5.01249e-05 -3.54069 63.546000 Cu 0.656736 0.209157 6.85286e-18 331 63.546 0.000437482 -3.53993 63.546000 Cu 0.737046 0.194406 0.5 332 63.546 0.000853837 -3.5392 63.546000 Cu 0.716524 0.2289 0.5 333 63.546 0.000322141 -3.53964 63.546000 Cu 0.796815 0.214061 6.85286e-18 234 63.546 0.000102977 -3.53943 63.546000 Cu 0.817544 0.179578 1 235 63.546 0.000392341 -3.53875 63.546000 Cu 0.957532 0.184295 8.59613e-17 236 63.546 0.00081236 -3.54039 63.546000 Cu 0.877161 0.199182 0.5 238 63.546 0.000246563 -3.53957 63.546000 Cu 0.856659 0.233708 0.5 261 63.546 0.000226022 -3.53953 63.546000 Cu 0.936842 0.218874 2.48867e-17 263 63.546 0.000416048 -3.5401 63.546000 Cu 0.0562352 0.258518 2.98159e-17 291 63.546 0.000266994 -3.54107 63.546000 Cu 0.196075 0.263426 6.85286e-18 292 63.546 0.000231675 -3.53966 63.546000 Cu 0.136352 0.243716 0.5 293 63.546 0.00040153 -3.54041 63.546000 Cu 0.115784 0.278315 0.5 294 63.546 0.000850142 -3.54064 63.546000 Cu 0.035526 0.29316 1 288 63.546 0.00115119 -3.54138 63.546000 Cu 0.276394 0.248557 0.5 298 63.546 2.76246e-05 -3.53922 63.546000 Cu 0.2558 0.283048 0.5 321 63.546 0.000338062 -3.53889 63.546000 Cu 0.3362 0.268212 6.85286e-18 323 63.546 0.00062639 -3.53901 63.546000 Cu 0.476102 0.273272 3.70295e-17 324 63.546 0.000161117 -3.5407 63.546000 Cu 0.416452 0.253437 0.5 325 63.546 0.000402731 -3.53996 63.546000 Cu 0.39588 0.287966 0.5 326 63.546 0.000854659 -3.53913 63.546000 Cu 0.496565 0.238666 5.59049e-17 327 63.546 9.22152e-05 -3.54084 63.546000 Cu 0.636352 0.243716 1 328 63.546 0.00040153 -3.54041 63.546000 Cu 0.556235 0.258518 0.5 330 63.546 0.000266994 -3.54107 63.546000 Cu 0.615784 0.278315 6.85286e-18 355 63.546 0.000850142 -3.54064 63.546000 Cu 0.696075 0.263426 0.5 357 63.546 0.000231675 -3.53966 63.546000 Cu 0.535526 0.29316 0.5 353 63.546 0.00115119 -3.54138 63.546000 Cu 0.776394 0.248557 6.85286e-18 259 63.546 2.76246e-05 -3.53922 63.546000 Cu 0.916452 0.253437 1.45473e-16 260 63.546 0.000402731 -3.53996 63.546000 Cu 0.8362 0.268212 0.5 262 63.546 0.00062639 -3.53901 63.546000 Cu 0.996565 0.238666 0.5 266 63.546 9.22152e-05 -3.54084 63.546000 Cu 0.89588 0.287966 1 287 63.546 0.000854659 -3.53913 63.546000 Cu 0.976102 0.273272 0.5 289 63.546 0.000161117 -3.5407 63.546000 Cu 0.7558 0.283048 1 356 63.546 0.000338062 -3.53889 63.546000 Cu 0.0143717 0.327865 1 315 63.546 0.00447638 -3.54203 63.546000 Cu 0.153999 0.33255 1 316 63.546 0.00129805 -3.54016 63.546000 Cu 0.0947955 0.312959 0.5 317 63.546 0.00233212 -3.5415 63.546000 Cu 0.0730938 0.3477 0.5 318 63.546 0.00749937 -3.54199 63.546000 Cu 0.175302 0.297974 2.63294e-17 319 63.546 0.000409029 -3.53983 63.546000 Cu 0.234823 0.317514 0.5 322 63.546 0.00130817 -3.53847 63.546000 Cu 0.213172 0.351934 0.5 345 63.546 0.0037934 -3.53701 63.546000 Cu 0.315456 0.302669 1 320 63.546 0.00201323 -3.538 63.546000 Cu 0.294324 0.337039 6.85286e-18 347 63.546 0.007178 -3.53568 63.546000 Cu 0.434074 0.342502 6.85286e-18 348 63.546 0.0027704 -3.54068 63.546000 Cu 0.375014 0.322435 0.5 349 63.546 0.00308639 -3.53729 63.546000 Cu 0.45531 0.307878 1 351 63.546 0.000631737 -3.54056 63.546000 Cu 0.594795 0.312959 6.85286e-18 352 63.546 0.00233212 -3.5415 63.546000 Cu 0.514372 0.327865 0.5 354 63.546 0.00447638 -3.54203 63.546000 Cu 0.675302 0.297974 0.5 358 63.546 0.000409029 -3.53983 63.546000 Cu 0.573094 0.3477 3.84722e-17 377 63.546 0.00749937 -3.54199 63.546000 Cu 0.653999 0.33255 0.5 379 63.546 0.00129805 -3.54016 63.546000 Cu 0.734823 0.317514 3.00564e-18 381 63.546 0.00130817 -3.53847 63.546000 Cu 0.713172 0.351934 6.85286e-18 378 63.546 0.0037934 -3.53701 63.546000 Cu 0.875014 0.322435 2.17608e-17 284 63.546 0.00308639 -3.53729 63.546000 Cu 0.815456 0.302669 0.5 285 63.546 0.00201323 -3.538 63.546000 Cu 0.794324 0.337039 0.5 286 63.546 0.007178 -3.53568 63.546000 Cu 0.95531 0.307878 0.5 290 63.546 0.000631737 -3.54056 63.546000 Cu 0.934074 0.342502 0.5 313 63.546 0.0027704 -3.54068 63.546000 Cu 0.108707 0.401953 1 340 63.546 0.0130952 -3.5369 63.546000 Cu 0.0503746 0.382635 0.5 341 63.546 0.0235603 -3.54124 63.546000 Cu 0.131728 0.367182 7.57421e-17 343 63.546 0.00365158 -3.53961 63.546000 Cu 0.190658 0.386305 0.5 346 63.546 0.00945078 -3.53426 63.546000 Cu 0.272385 0.371247 6.85286e-18 344 63.546 0.025679 -3.5292 63.546000 Cu 0.353565 0.356785 0.5 350 63.546 0.013563 -3.5325 63.546000 Cu 0.250225 0.405216 6.85286e-18 369 63.546 0.0986858 -3.52095 63.546000 Cu 0.331705 0.390902 0.5 371 63.546 0.0720013 -3.51998 63.546000 Cu 0.412034 0.377226 1 373 63.546 0.0114369 -3.54062 63.546000 Cu 0.492372 0.362707 0.5 375 63.546 0.0155267 -3.54279 63.546000 Cu 0.469662 0.397838 0.5 376 63.546 0.0558083 -3.54099 63.546000 Cu 0.550375 0.382635 1.60862e-16 374 63.546 0.0235603 -3.54124 63.546000 Cu 0.631728 0.367182 0.5 380 63.546 0.00365158 -3.53961 63.546000 Cu 0.608707 0.401953 0.5 393 63.546 0.0130952 -3.5369 63.546000 Cu 0.690658 0.386305 1.20226e-19 395 63.546 0.00945078 -3.53426 63.546000 Cu 0.831705 0.390902 3.198e-17 309 63.546 0.0720013 -3.51998 63.546000 Cu 0.772385 0.371247 0.5 310 63.546 0.025679 -3.5292 63.546000 Cu 0.853565 0.356785 1.03394e-17 311 63.546 0.013563 -3.5325 63.546000 Cu 0.992372 0.362707 6.85286e-18 312 63.546 0.0155267 -3.54279 63.546000 Cu 0.912034 0.377226 0.5 314 63.546 0.0114369 -3.54062 63.546000 Cu 0.969662 0.397838 9.25737e-18 339 63.546 0.0558083 -3.54099 63.546000 Cu 0.750225 0.405216 0.5 396 63.546 0.0986858 -3.52095 63.546000 Cu 0.0274367 0.418001 0.5 342 63.546 0.0719101 -3.53547 63.546000 Cu 0.00549121 0.454506 0.5 363 63.546 0.384394 -3.50082 63.546000 Cu 0.085644 0.43718 6.85286e-18 365 63.546 0.0670169 -3.52582 63.546000 Cu 0.227722 0.438805 8.17534e-17 366 63.546 0.479315 -3.48816 63.546000 Cu 0.167587 0.420674 0.5 367 63.546 0.0306472 -3.52675 63.546000 Cu 0.146503 0.455312 0.5 368 63.546 0.184506 -3.5254 63.546000 Cu 0.390288 0.412302 1 370 63.546 0.079451 -3.53464 63.546000 Cu 0.310754 0.424644 0.5 372 63.546 0.471378 -3.48445 63.546000 Cu 0.288304 0.457048 0.5 385 63.546 7.72163 -3.2803 63.546000 Cu 0.371063 0.448992 1 387 63.546 5.57144 -3.47782 63.546000 Cu 0.447295 0.433754 0.5 389 63.546 0.242458 -3.52812 63.546000 Cu 0.505491 0.454506 1 388 63.546 0.384394 -3.50082 63.546000 Cu 0.527437 0.418001 1 391 63.546 0.0719101 -3.53547 63.546000 Cu 0.667587 0.420674 1 392 63.546 0.0306472 -3.52675 63.546000 Cu 0.585644 0.43718 0.5 394 63.546 0.0670169 -3.52582 63.546000 Cu 0.646503 0.455312 8.03107e-17 400 63.546 0.184506 -3.5254 63.546000 Cu 0.727722 0.438805 0.5 401 63.546 0.479315 -3.48816 63.546000 Cu 0.788304 0.457048 1 334 63.546 7.72163 -3.2803 63.546000 Cu 0.810754 0.424644 1 335 63.546 0.471378 -3.48445 63.546000 Cu 0.947295 0.433754 8.86063e-17 336 63.546 0.242458 -3.52812 63.546000 Cu 0.890288 0.412302 0.5 337 63.546 0.079451 -3.53464 63.546000 Cu 0.871063 0.448992 0.5 338 63.546 5.57144 -3.47782 63.546000 Cu 0.0831988 0.508249 1 1 63.546 0.0654098 -3.52718 63.546000 Cu 0.163915 0.524829 0.5 2 63.546 0.033011 -3.52809 63.546000 Cu 0.023763 0.527357 0.5 7 63.546 0.07576 -3.5352 63.546000 Cu 0.225189 0.50674 4.59262e-17 32 63.546 0.545311 -3.48922 63.546000 Cu 0.0701601 0.472702 1.51484e-17 362 63.546 0.425278 -3.52778 63.546000 Cu 0.145101 0.490169 0.5 382 63.546 0.195694 -3.52602 63.546000 Cu 0.213346 0.472748 3.75104e-17 383 63.546 3.30751 -3.49354 63.546000 Cu 0.00436021 0.490808 0.5 364 63.546 0.373152 -3.49885 63.546000 Cu 0.42274 0.472619 0.5 390 63.546 4.56667 -3.58138 63.546000 Cu 0.444565 0.511535 0.5 16 63.546 0.268571 -3.52828 63.546000 Cu 0.307398 0.520908 0.5 34 63.546 0.55817 -3.4746 63.546000 Cu 0.369708 0.496049 1 384 63.546 5.55368 -3.47565 63.546000 Cu 0.286472 0.48861 0.5 386 63.546 7.71662 -3.26616 63.546000 Cu 0.50436 0.490808 6.85286e-18 397 63.546 0.373152 -3.49885 63.546000 Cu 0.725189 0.50674 0.5 4 63.546 0.545311 -3.48922 63.546000 Cu 0.523763 0.527357 3.33025e-17 14 63.546 0.07576 -3.5352 63.546000 Cu 0.583199 0.508249 0.5 15 63.546 0.0654098 -3.52718 63.546000 Cu 0.663915 0.524829 6.85286e-18 17 63.546 0.033011 -3.52809 63.546000 Cu 0.645101 0.490169 1 398 63.546 0.195694 -3.52602 63.546000 Cu 0.57016 0.472702 0.5 399 63.546 0.425278 -3.52778 63.546000 Cu 0.713346 0.472748 0.5 402 63.546 3.30751 -3.49354 63.546000 Cu 0.92274 0.472619 6.85286e-18 361 63.546 4.56667 -3.58138 63.546000 Cu 0.807398 0.520908 1.05799e-17 3 63.546 0.55817 -3.4746 63.546000 Cu 0.944565 0.511535 1.44271e-18 5 63.546 0.268571 -3.52828 63.546000 Cu 0.786472 0.48861 1.08203e-18 359 63.546 7.71662 -3.26616 63.546000 Cu 0.869708 0.496049 0.5 360 63.546 5.55368 -3.47565 63.546000 Cu 0.103771 0.54349 2.38047e-17 9 63.546 0.0133762 -3.53777 63.546000 Cu 0.123583 0.578286 7.06927e-17 10 63.546 0.00374672 -3.5409 63.546000 Cu 0.184312 0.559201 0.5 11 63.546 0.0112254 -3.53512 63.546000 Cu 0.0437845 0.562766 0.5 12 63.546 0.0265758 -3.54226 63.546000 Cu 0.24548 0.540319 6.85286e-18 33 63.546 0.113643 -3.52075 63.546000 Cu 0.386353 0.533008 7.64635e-17 35 63.546 0.104173 -3.53156 63.546000 Cu 0.404973 0.568193 1 36 63.546 0.0143242 -3.54029 63.546000 Cu 0.464454 0.547529 0.5 37 63.546 0.062726 -3.54079 63.546000 Cu 0.325841 0.554607 0.5 38 63.546 0.0831913 -3.51796 63.546000 Cu 0.483849 0.582707 0.5 42 63.546 0.0185228 -3.54306 63.546000 Cu 0.264612 0.574289 6.69657e-17 58 63.546 0.0303189 -3.52944 63.546000 Cu 0.684312 0.559201 1.25756e-16 18 63.546 0.0112254 -3.53512 63.546000 Cu 0.74548 0.540319 0.5 19 63.546 0.113643 -3.52075 63.546000 Cu 0.603771 0.54349 0.5 20 63.546 0.0133762 -3.53777 63.546000 Cu 0.543784 0.562766 1 39 63.546 0.0265758 -3.54226 63.546000 Cu 0.623583 0.578286 0.5 41 63.546 0.00374672 -3.5409 63.546000 Cu 0.964454 0.547529 1 6 63.546 0.062726 -3.54079 63.546000 Cu 0.886353 0.533008 0.5 8 63.546 0.104173 -3.53156 63.546000 Cu 0.825841 0.554607 1.44271e-18 21 63.546 0.0831913 -3.51796 63.546000 Cu 0.904973 0.568193 0.5 23 63.546 0.0143242 -3.54029 63.546000 Cu 0.764612 0.574289 0.5 24 63.546 0.0303189 -3.52944 63.546000 Cu 0.983849 0.582707 3.61879e-17 25 63.546 0.0185228 -3.54306 63.546000 Cu 0.203606 0.593593 0.5 13 63.546 0.00460759 -3.53759 63.546000 Cu 0.00293109 0.617585 6.85286e-18 26 63.546 0.00543393 -3.54264 63.546000 Cu 0.0631766 0.597738 0.5 27 63.546 0.00885946 -3.54308 63.546000 Cu 0.142872 0.612947 2.92148e-17 29 63.546 0.00112041 -3.54084 63.546000 Cu 0.082421 0.632509 0.5 31 63.546 0.00284038 -3.54207 63.546000 Cu 0.222714 0.62802 0.5 82 63.546 0.00178421 -3.53865 63.546000 Cu 0.344462 0.588737 0.5 60 63.546 0.0158395 -3.53136 63.546000 Cu 0.283511 0.608502 6.82881e-17 59 63.546 0.00856693 -3.53501 63.546000 Cu 0.423713 0.602955 8.4759e-17 61 63.546 0.00294918 -3.54069 63.546000 Cu 0.442687 0.63759 6.85286e-18 62 63.546 0.000826326 -3.54024 63.546000 Cu 0.363178 0.623084 0.5 64 63.546 0.00342969 -3.5366 63.546000 Cu 0.302597 0.642859 1 83 63.546 0.00266979 -3.53761 63.546000 Cu 0.563177 0.597738 1 40 63.546 0.00885946 -3.54308 63.546000 Cu 0.703606 0.593593 1 43 63.546 0.00460759 -3.53759 63.546000 Cu 0.722714 0.62802 6.85286e-18 44 63.546 0.00178421 -3.53865 63.546000 Cu 0.642872 0.612947 0.5 46 63.546 0.00112041 -3.54084 63.546000 Cu 0.502931 0.617585 0.5 63 63.546 0.00543393 -3.54264 63.546000 Cu 0.582421 0.632509 6.85286e-18 65 63.546 0.00284038 -3.54207 63.546000 Cu 0.844462 0.588737 1 22 63.546 0.0158395 -3.53136 63.546000 Cu 0.923713 0.602955 0.5 28 63.546 0.00294918 -3.54069 63.546000 Cu 0.783511 0.608502 0.5 45 63.546 0.00856693 -3.53501 63.546000 Cu 0.863178 0.623084 6.85286e-18 47 63.546 0.00342969 -3.5366 63.546000 Cu 0.942687 0.63759 0.5 49 63.546 0.000826326 -3.54024 63.546000 Cu 0.802597 0.642859 0.5 50 63.546 0.00266979 -3.53761 63.546000 Cu 0.162208 0.647537 1 30 63.546 0.000481011 -3.54057 63.546000 Cu 0.0222227 0.65229 1 51 63.546 0.00186099 -3.5414 63.546000 Cu 0.0421392 0.686901 1 52 63.546 0.000626092 -3.54072 63.546000 Cu 0.102023 0.66716 0.5 53 63.546 0.000985549 -3.54088 63.546000 Cu 0.182051 0.682067 6.1796e-17 55 63.546 0.000278187 -3.53974 63.546000 Cu 0.122208 0.701721 0.5 57 63.546 0.000441311 -3.53999 63.546000 Cu 0.242184 0.662479 0.5 86 63.546 0.000825903 -3.53908 63.546000 Cu 0.322241 0.677279 6.85286e-18 84 63.546 0.000968384 -3.53867 63.546000 Cu 0.382405 0.657519 0.5 85 63.546 0.000932874 -3.53829 63.546000 Cu 0.462201 0.672157 1.05919e-16 87 63.546 0.000407081 -3.54039 63.546000 Cu 0.402325 0.691999 0.5 90 63.546 0.000372191 -3.53962 63.546000 Cu 0.26228 0.696938 0.5 108 63.546 0.000251947 -3.5392 63.546000 Cu 0.662208 0.647537 0.5 67 63.546 0.000481011 -3.54057 63.546000 Cu 0.602023 0.66716 6.85286e-18 66 63.546 0.000985549 -3.54088 63.546000 Cu 0.522223 0.65229 0.5 68 63.546 0.00186099 -3.5414 63.546000 Cu 0.742184 0.662479 6.85286e-18 69 63.546 0.000825903 -3.53908 63.546000 Cu 0.682051 0.682067 0.5 72 63.546 0.000278187 -3.53974 63.546000 Cu 0.542139 0.686901 0.5 89 63.546 0.000626092 -3.54072 63.546000 Cu 0.622208 0.701721 1 91 63.546 0.000441311 -3.53999 63.546000 Cu 0.882405 0.657519 6.85286e-18 48 63.546 0.000932874 -3.53829 63.546000 Cu 0.962201 0.672157 0.5 54 63.546 0.000407081 -3.54039 63.546000 Cu 0.76228 0.696938 6.85286e-18 70 63.546 0.000251947 -3.5392 63.546000 Cu 0.822241 0.677279 0.5 71 63.546 0.000968384 -3.53867 63.546000 Cu 0.902325 0.691999 1 73 63.546 0.000372191 -3.53962 63.546000 Cu 0.20243 0.716563 6.85286e-18 56 63.546 0.000113909 -3.53929 63.546000 Cu 0.0625474 0.721461 1 77 63.546 0.000181901 -3.54028 63.546000 Cu 0.0830245 0.756024 1.21428e-17 78 63.546 4.16343e-05 -3.54084 63.546000 Cu 0.142753 0.736245 0.5 79 63.546 0.000281646 -3.53995 63.546000 Cu 0.00294166 0.741263 0.5 80 63.546 5.30912e-05 -3.54071 63.546000 Cu 0.222962 0.751039 1 132 63.546 0.000244066 -3.53928 63.546000 Cu 0.482418 0.706716 1 88 63.546 6.14504e-05 -3.5403 63.546000 Cu 0.342516 0.711737 1 109 63.546 0.000325097 -3.53933 63.546000 Cu 0.363054 0.746222 6.85286e-18 110 63.546 0.000229583 -3.5399 63.546000 Cu 0.422779 0.726503 0.5 111 63.546 0.000213188 -3.54 63.546000 Cu 0.282752 0.731395 0.5 112 63.546 1.3735e-05 -3.53914 63.546000 Cu 0.443218 0.761042 0.5 116 63.546 0.000340434 -3.54071 63.546000 Cu 0.642753 0.736245 7.61028e-17 92 63.546 0.000281646 -3.53995 63.546000 Cu 0.70243 0.716563 0.5 93 63.546 0.000113909 -3.53929 63.546000 Cu 0.562547 0.721461 0.5 94 63.546 0.000181901 -3.54028 63.546000 Cu 0.722962 0.751039 0.5 98 63.546 0.000244066 -3.53928 63.546000 Cu 0.502942 0.741263 6.85286e-18 113 63.546 5.30912e-05 -3.54071 63.546000 Cu 0.583025 0.756024 0.5 115 63.546 4.16343e-05 -3.54084 63.546000 Cu 0.982418 0.706716 0.5 75 63.546 6.14504e-05 -3.5403 63.546000 Cu 0.922779 0.726503 1 74 63.546 0.000213188 -3.54 63.546000 Cu 0.842516 0.711737 0.5 76 63.546 0.000325097 -3.53933 63.546000 Cu 0.782752 0.731395 1.064e-16 95 63.546 1.3735e-05 -3.53914 63.546000 Cu 0.863054 0.746222 0.5 97 63.546 0.000229583 -3.5399 63.546000 Cu 0.943218 0.761042 1 99 63.546 0.000340434 -3.54071 63.546000 Cu 0.163099 0.770758 0.5 81 63.546 0.000368323 -3.53986 63.546000 Cu 0.0233056 0.775841 0.5 101 63.546 0.000289252 -3.54103 63.546000 Cu 0.10337 0.790583 1 103 63.546 0.000184364 -3.54041 63.546000 Cu 0.183525 0.805242 0.5 105 63.546 0.000826394 -3.53868 63.546000 Cu 0.043859 0.810445 0.5 106 63.546 0.00118688 -3.54118 63.546000 Cu 0.243292 0.785498 1 133 63.546 0.000785726 -3.53886 63.546000 Cu 0.303185 0.765861 0.5 134 63.546 5.92241e-05 -3.53911 63.546000 Cu 0.38342 0.780729 1 135 63.546 0.000248869 -3.53978 63.546000 Cu 0.404096 0.815247 6.49218e-18 136 63.546 0.000390994 -3.5398 63.546000 Cu 0.463674 0.795612 0.5 137 63.546 0.000893213 -3.54059 63.546000 Cu 0.323638 0.800311 0.5 138 63.546 0.000492303 -3.53888 63.546000 Cu 0.263882 0.819915 4.65273e-17 158 63.546 0.00229788 -3.53759 63.546000 Cu 0.523306 0.775841 1 114 63.546 0.000289252 -3.54103 63.546000 Cu 0.663099 0.770758 1 117 63.546 0.000368323 -3.53986 63.546000 Cu 0.683525 0.805242 6.85286e-18 118 63.546 0.000826394 -3.53868 63.546000 Cu 0.743292 0.785498 0.5 119 63.546 0.000785726 -3.53886 63.546000 Cu 0.60337 0.790583 0.5 120 63.546 0.000184364 -3.54041 63.546000 Cu 0.543859 0.810445 0 139 63.546 0.00118688 -3.54118 63.546000 Cu 0.803185 0.765861 3.73902e-17 96 63.546 5.92241e-05 -3.53911 63.546000 Cu 0.963674 0.795612 1 100 63.546 0.000893213 -3.54059 63.546000 Cu 0.88342 0.780729 0.5 102 63.546 0.000248869 -3.53978 63.546000 Cu 0.823638 0.800311 1.31046e-17 121 63.546 0.000492303 -3.53888 63.546000 Cu 0.904096 0.815247 0.5 123 63.546 0.000390994 -3.5398 63.546000 Cu 0.763882 0.819915 0.5 124 63.546 0.00229788 -3.53759 63.546000 Cu 0.124001 0.825142 1 104 63.546 0.000642065 -3.54023 63.546000 Cu 0.204088 0.83966 0.5 107 63.546 0.00340415 -3.53657 63.546000 Cu 0.00506048 0.864984 1 126 63.546 0.00854257 -3.54296 63.546000 Cu 0.0645903 0.845133 0.5 127 63.546 0.00486722 -3.54234 63.546000 Cu 0.144268 0.859744 1 129 63.546 0.00256153 -3.54067 63.546000 Cu 0.084897 0.879987 0.5 131 63.546 0.0169153 -3.54329 63.546000 Cu 0.224065 0.873988 0.5 180 63.546 0.0154738 -3.53171 63.546000 Cu 0.484455 0.830228 0.5 142 63.546 0.00240409 -3.54167 63.546000 Cu 0.284325 0.854251 6.85286e-18 159 63.546 0.0080511 -3.53546 63.546000 Cu 0.344383 0.834757 0.5 160 63.546 0.00141013 -3.53852 63.546000 Cu 0.424864 0.849815 1 161 63.546 0.00155257 -3.54083 63.546000 Cu 0.364773 0.869167 0.5 164 63.546 0.00393766 -3.5375 63.546000 Cu 0.56459 0.845133 2.47665e-17 140 63.546 0.00486722 -3.54234 63.546000 Cu 0.624001 0.825142 0.5 141 63.546 0.000642065 -3.54023 63.546000 Cu 0.704088 0.83966 1.11088e-16 143 63.546 0.00340415 -3.53657 63.546000 Cu 0.724065 0.873988 6.85286e-18 144 63.546 0.0154738 -3.53171 63.546000 Cu 0.644268 0.859744 0.5 146 63.546 0.00256153 -3.54067 63.546000 Cu 0.50506 0.864984 0.5 163 63.546 0.00854257 -3.54296 63.546000 Cu 0.584897 0.879987 1.16619e-17 165 63.546 0.0169153 -3.54329 63.546000 Cu 0.844383 0.834757 5.10959e-17 122 63.546 0.00141013 -3.53852 63.546000 Cu 0.984455 0.830228 6.85286e-18 125 63.546 0.00240409 -3.54167 63.546000 Cu 0.924864 0.849815 0.5 128 63.546 0.00155257 -3.54083 63.546000 Cu 0.784325 0.854251 0.5 145 63.546 0.0080511 -3.53546 63.546000 Cu 0.864773 0.869167 6.2878e-17 147 63.546 0.00393766 -3.5375 63.546000 Cu 0.164276 0.894478 1.20226e-19 130 63.546 0.0128425 -3.5409 63.546000 Cu 0.0256461 0.899951 1 151 63.546 0.0270132 -3.54224 63.546000 Cu 0.0464611 0.935351 6.85286e-18 152 63.546 0.0768314 -3.53509 63.546000 Cu 0.10537 0.915157 0.5 153 63.546 0.0604822 -3.54091 63.546000 Cu 0.183785 0.929643 1 155 63.546 0.0990933 -3.53182 63.546000 Cu 0.243791 0.908085 0.5 184 63.546 0.0843301 -3.51791 63.546000 Cu 0.44532 0.884462 6.54027e-17 162 63.546 0.00432572 -3.54075 63.546000 Cu 0.304408 0.888442 1.53408e-16 181 63.546 0.0294269 -3.52881 63.546000 Cu 0.324496 0.922391 3.3062e-17 182 63.546 0.112766 -3.52044 63.546000 Cu 0.385221 0.90354 0.5 183 63.546 0.0103191 -3.5348 63.546000 Cu 0.466209 0.919255 2.04384e-18 185 63.546 0.0147219 -3.53743 63.546000 Cu 0.406351 0.937917 0.5 188 63.546 0.0330158 -3.52792 63.546000 Cu 0.60537 0.915157 6.85286e-18 166 63.546 0.0604822 -3.54091 63.546000 Cu 0.664276 0.894478 0.5 167 63.546 0.0128425 -3.5409 63.546000 Cu 0.525646 0.899951 0.5 168 63.546 0.0270132 -3.54224 63.546000 Cu 0.743791 0.908085 7.86275e-17 169 63.546 0.0843301 -3.51791 63.546000 Cu 0.683785 0.929643 0.5 172 63.546 0.0990933 -3.53182 63.546000 Cu 0.546461 0.935351 0.5 187 63.546 0.0768314 -3.53509 63.546000 Cu 0.885221 0.90354 5.74678e-17 148 63.546 0.0103191 -3.5348 63.546000 Cu 0.94532 0.884462 0.5 149 63.546 0.00432572 -3.54075 63.546000 Cu 0.804408 0.888442 0.5 150 63.546 0.0294269 -3.52881 63.546000 Cu 0.966209 0.919255 0.5 154 63.546 0.0147219 -3.53743 63.546000 Cu 0.824496 0.922391 0.5 171 63.546 0.112766 -3.52044 63.546000 Cu 0.906351 0.937917 6.85286e-18 173 63.546 0.0330158 -3.52792 63.546000 Cu 0.200556 0.966574 1.55692e-16 156 63.546 5.56788 -3.47635 63.546000 Cu 0.12572 0.951124 0.5 157 63.546 0.259955 -3.52789 63.546000 Cu 0.0658628 0.971894 1.78174e-16 177 63.546 0.381101 -3.50021 63.546000 Cu 0.147189 0.989973 0.5 178 63.546 4.53645 -3.58188 63.546000 Cu 0.487141 0.954508 2.40451e-19 186 63.546 0.0735588 -3.52779 63.546000 Cu 0.262818 0.941758 0.5 195 63.546 0.563282 -3.47609 63.546000 Cu 0.345156 0.955972 1.52446e-16 196 63.546 0.546561 -3.49008 63.546000 Cu 0.356599 0.989968 1 197 63.546 3.31322 -3.49265 63.546000 Cu 0.425083 0.97259 0.5 198 63.546 0.198296 -3.5266 63.546000 Cu 0.283683 0.974084 0.5 199 63.546 7.70792 -3.26615 63.546000 Cu 0.499773 0.990036 4.66475e-17 200 63.546 0.413977 -3.52824 63.546000 Cu 0.62572 0.951124 2.40451e-19 189 63.546 0.259955 -3.52789 63.546000 Cu 0.647189 0.989973 4.46037e-17 190 63.546 4.53645 -3.58188 63.546000 Cu 0.700556 0.966574 0.5 191 63.546 5.56788 -3.47635 63.546000 Cu 0.565863 0.971894 0.5 192 63.546 0.381101 -3.50021 63.546000 Cu 0.999773 0.990036 0.5 179 63.546 0.413977 -3.52824 63.546000 Cu 0.762818 0.941758 1.91038e-16 170 63.546 0.563282 -3.47609 63.546000 Cu 0.925083 0.97259 1 174 63.546 0.198296 -3.5266 63.546000 Cu 0.987141 0.954508 0.5 175 63.546 0.0735588 -3.52779 63.546000 Cu 0.845156 0.955972 0.5 176 63.546 0.546561 -3.49008 63.546000 Cu 0.783683 0.974084 6.85286e-18 193 63.546 7.70792 -3.26615 63.546000 Cu 0.856599 0.989968 0.5 194 63.546 3.31322 -3.49265