Number of particles = 400 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.056 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.7266 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62136 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 0.124463 0.0431427 1.84904e-16 208 63.546 0.362567 -3.50383 63.546000 Cu 0.0628871 0.0231093 0.5 209 63.546 0.296769 -3.48617 63.546000 Cu 0.142403 0.00493819 1 211 63.546 3.79316 -3.48661 63.546000 Cu 0.200432 0.0285979 0.5 213 63.546 5.11301 -3.36268 63.546000 Cu 0.279497 0.0203061 1.05625e-16 212 63.546 7.41819 -3.19346 63.546000 Cu 0.354322 0.00495083 0.5 214 63.546 3.36665 -3.42074 63.546000 Cu 0.342133 0.0385597 0.5 227 63.546 0.417151 -3.48807 63.546000 Cu 0.421363 0.0223362 8.41888e-17 229 63.546 0.159574 -3.51737 63.546000 Cu 0.562887 0.0231093 2.87416e-17 230 63.546 0.296769 -3.48617 63.546000 Cu 0.496663 0.00493904 0.5 231 63.546 0.333542 -3.5109 63.546000 Cu 0.484255 0.0404779 0.5 232 63.546 0.0495208 -3.50642 63.546000 Cu 0.642403 0.00493819 0.5 233 63.546 3.79316 -3.48661 63.546000 Cu 0.624463 0.0431427 0.5 253 63.546 0.362567 -3.50383 63.546000 Cu 0.700432 0.0285979 1 255 63.546 5.11301 -3.36268 63.546000 Cu 0.779497 0.0203061 0.5 257 63.546 7.41819 -3.19346 63.546000 Cu 0.854322 0.00495083 1.3784e-16 201 63.546 3.36665 -3.42074 63.546000 Cu 0.996663 0.00493904 1 202 63.546 0.333542 -3.5109 63.546000 Cu 0.921363 0.0223362 0.5 203 63.546 0.159574 -3.51737 63.546000 Cu 0.984255 0.0404779 1.70054e-17 207 63.546 0.0495208 -3.50642 63.546000 Cu 0.842133 0.0385597 1 256 63.546 0.417151 -3.48807 63.546000 Cu 0.0442213 0.0594238 0.5 210 63.546 0.0793918 -3.50914 63.546000 Cu 0.103298 0.0795618 7.3291e-17 221 63.546 0.0860107 -3.51604 63.546000 Cu 0.181943 0.0650553 0.5 223 63.546 0.0721415 -3.48963 63.546000 Cu 0.241015 0.0866291 2.87416e-17 222 63.546 0.057015 -3.5074 63.546000 Cu 0.260724 0.0526153 1.31493e-16 225 63.546 0.381958 -3.45927 63.546000 Cu 0.322187 0.0724426 0.5 228 63.546 0.107188 -3.5019 63.546000 Cu 0.403242 0.0570392 2.05143e-16 226 63.546 0.0406798 -3.51015 63.546000 Cu 0.463607 0.0758122 0.5 249 63.546 0.00921736 -3.51292 63.546000 Cu 0.544221 0.0594238 1.19876e-16 251 63.546 0.0793918 -3.50914 63.546000 Cu 0.603298 0.0795618 0.5 254 63.546 0.0860107 -3.51604 63.546000 Cu 0.681943 0.0650553 1 252 63.546 0.0721415 -3.48963 63.546000 Cu 0.760724 0.0526153 0.5 258 63.546 0.381958 -3.45927 63.546000 Cu 0.741015 0.0866291 0.5 281 63.546 0.057015 -3.5074 63.546000 Cu 0.963607 0.0758122 1.60833e-16 204 63.546 0.00921736 -3.51292 63.546000 Cu 0.903242 0.0570392 0.5 205 63.546 0.0406798 -3.51015 63.546000 Cu 0.822187 0.0724426 1 283 63.546 0.107188 -3.5019 63.546000 Cu 0.0818301 0.115172 3.59269e-19 218 63.546 0.022073 -3.51863 63.546000 Cu 0.0229253 0.0951005 0.5 219 63.546 0.0325518 -3.51652 63.546000 Cu 0.161283 0.100624 0.5 224 63.546 0.0119166 -3.51369 63.546000 Cu 0.140685 0.135607 0.5 241 63.546 0.00226554 -3.51761 63.546000 Cu 0.00151816 0.13038 0.5 220 63.546 0.00922304 -3.51884 63.546000 Cu 0.382397 0.0916598 1 247 63.546 0.0221829 -3.51244 63.546000 Cu 0.220735 0.121125 1 243 63.546 0.00838953 -3.51501 63.546000 Cu 0.361304 0.126227 1 244 63.546 0.00782951 -3.51545 63.546000 Cu 0.301319 0.106616 0.5 245 63.546 0.0205994 -3.51261 63.546000 Cu 0.522925 0.0951005 3.83221e-18 248 63.546 0.0325518 -3.51652 63.546000 Cu 0.442165 0.110863 0.5 250 63.546 0.00347 -3.51612 63.546000 Cu 0.501518 0.13038 0 275 63.546 0.00922304 -3.51884 63.546000 Cu 0.58183 0.115172 0.5 277 63.546 0.022073 -3.51863 63.546000 Cu 0.640685 0.135607 1 276 63.546 0.00226554 -3.51761 63.546000 Cu 0.661283 0.100624 1 279 63.546 0.0119166 -3.51369 63.546000 Cu 0.720735 0.121125 0.5 282 63.546 0.00838953 -3.51501 63.546000 Cu 0.882397 0.0916598 0.5 206 63.546 0.0221829 -3.51244 63.546000 Cu 0.801319 0.106616 1 280 63.546 0.0205994 -3.51261 63.546000 Cu 0.861304 0.126227 0.5 216 63.546 0.00782951 -3.51545 63.546000 Cu 0.942165 0.110863 1 217 63.546 0.00347 -3.51612 63.546000 Cu 0.0606871 0.150338 1 239 63.546 0.00558501 -3.51904 63.546000 Cu 0.119942 0.17046 0.5 242 63.546 0.000574665 -3.51801 63.546000 Cu 0.200137 0.155764 1.02871e-16 240 63.546 0.00148121 -3.51687 63.546000 Cu 0.280549 0.141073 0.5 246 63.546 0.00421767 -3.51581 63.546000 Cu 0.259786 0.175686 0.5 269 63.546 0.00105849 -3.51703 63.546000 Cu 0.34028 0.160835 1 271 63.546 0.00201613 -3.51678 63.546000 Cu 0.39995 0.180526 0.5 274 63.546 0.000358287 -3.51775 63.546000 Cu 0.480377 0.165404 6.46685e-18 272 63.546 0.00205958 -3.51873 63.546000 Cu 0.42093 0.14575 0.5 273 63.546 0.00132058 -3.51731 63.546000 Cu 0.560687 0.150338 0.5 278 63.546 0.00558501 -3.51904 63.546000 Cu 0.619942 0.17046 8.67037e-17 303 63.546 0.000574665 -3.51801 63.546000 Cu 0.759786 0.175686 1.00476e-16 304 63.546 0.00105849 -3.51703 63.546000 Cu 0.700137 0.155764 0.5 305 63.546 0.00148121 -3.51687 63.546000 Cu 0.780549 0.141073 1 307 63.546 0.00421767 -3.51581 63.546000 Cu 0.92093 0.14575 8.01171e-17 215 63.546 0.00132058 -3.51731 63.546000 Cu 0.89995 0.180526 1.26463e-16 235 63.546 0.000358287 -3.51775 63.546000 Cu 0.980377 0.165404 0.5 237 63.546 0.00205958 -3.51873 63.546000 Cu 0.84028 0.160835 0.5 308 63.546 0.00201613 -3.51678 63.546000 Cu 0.0398064 0.185278 1.87539e-16 236 63.546 0.00146059 -3.51865 63.546000 Cu 0.0190817 0.220134 1.24547e-17 263 63.546 0.000380423 -3.51845 63.546000 Cu 0.158874 0.225194 1 264 63.546 0.000203145 -3.51774 63.546000 Cu 0.0992467 0.205253 0.5 265 63.546 0.000219272 -3.51813 63.546000 Cu 0.179452 0.190454 2.3101e-16 267 63.546 0.000281767 -3.51753 63.546000 Cu 0.319489 0.195501 5.10163e-17 268 63.546 0.000577463 -3.51734 63.546000 Cu 0.239136 0.210358 0.5 270 63.546 0.000292586 -3.51743 63.546000 Cu 0.379196 0.215277 0.5 297 63.546 0.000197279 -3.51783 63.546000 Cu 0.459565 0.200275 5.9519e-17 299 63.546 0.000441881 -3.51842 63.546000 Cu 0.599247 0.205253 6.46685e-18 300 63.546 0.000219272 -3.51813 63.546000 Cu 0.539806 0.185278 0.5 301 63.546 0.00146059 -3.51865 63.546000 Cu 0.519082 0.220134 0.5 302 63.546 0.000380423 -3.51845 63.546000 Cu 0.679452 0.190454 0.5 306 63.546 0.000281767 -3.51753 63.546000 Cu 0.658874 0.225194 0.5 329 63.546 0.000203145 -3.51774 63.546000 Cu 0.739136 0.210358 6.46685e-18 331 63.546 0.000292586 -3.51743 63.546000 Cu 0.879196 0.215277 1 234 63.546 0.000197279 -3.51783 63.546000 Cu 0.959565 0.200275 0.5 238 63.546 0.000441881 -3.51842 63.546000 Cu 0.819489 0.195501 0.5 332 63.546 0.000577463 -3.51734 63.546000 Cu 0.0787376 0.24005 0.5 266 63.546 0.000180149 -3.51816 63.546000 Cu 0.13864 0.259926 9.46076e-17 291 63.546 0.000106203 -3.5179 63.546000 Cu 0.278777 0.264895 3.59269e-19 292 63.546 2.88034e-05 -3.51767 63.546000 Cu 0.218707 0.245048 0.5 293 63.546 0.000136349 -3.51762 63.546000 Cu 0.298902 0.230183 2.89811e-17 295 63.546 0.000143563 -3.5175 63.546000 Cu 0.358809 0.250019 0.5 298 63.546 0.00012477 -3.51788 63.546000 Cu 0.43894 0.235097 7.66441e-18 296 63.546 0.000137035 -3.5183 63.546000 Cu 0.418758 0.269898 7.04168e-17 323 63.546 9.42295e-05 -3.51826 63.546000 Cu 0.498712 0.254966 0.5 325 63.546 7.84281e-05 -3.51849 63.546000 Cu 0.578738 0.24005 2.28735e-16 327 63.546 0.000180149 -3.51816 63.546000 Cu 0.718707 0.245048 2.29094e-16 328 63.546 0.000136349 -3.51762 63.546000 Cu 0.63864 0.259926 0.5 330 63.546 0.000106203 -3.5179 63.546000 Cu 0.798902 0.230183 0.5 333 63.546 0.000143563 -3.5175 63.546000 Cu 0.778777 0.264895 0.5 357 63.546 2.88034e-05 -3.51767 63.546000 Cu 0.858809 0.250019 1.06583e-17 259 63.546 0.00012477 -3.51788 63.546000 Cu 0.998712 0.254966 1 260 63.546 7.84281e-05 -3.51849 63.546000 Cu 0.93894 0.235097 0.5 261 63.546 0.000137035 -3.5183 63.546000 Cu 0.918758 0.269898 0.5 262 63.546 9.42295e-05 -3.51826 63.546000 Cu 0.118673 0.294674 1 288 63.546 0.000147293 -3.5179 63.546000 Cu 0.0586543 0.274846 0.5 289 63.546 7.37363e-05 -3.51839 63.546000 Cu 0.038558 0.309666 0.5 290 63.546 0.000370606 -3.5185 63.546000 Cu 0.198752 0.279763 0.5 294 63.546 6.28788e-05 -3.51766 63.546000 Cu 0.178649 0.314456 0.5 317 63.546 0.00044629 -3.51739 63.546000 Cu 0.258836 0.299598 1 319 63.546 0.00026515 -3.51752 63.546000 Cu 0.39875 0.304691 0 320 63.546 0.000183016 -3.5181 63.546000 Cu 0.338845 0.284758 0.5 321 63.546 0.000113271 -3.51772 63.546000 Cu 0.558654 0.274846 1.19517e-16 324 63.546 7.37363e-05 -3.51839 63.546000 Cu 0.478732 0.289806 0.5 326 63.546 0.000283745 -3.51855 63.546000 Cu 0.538558 0.309666 4.21543e-17 351 63.546 0.000370606 -3.5185 63.546000 Cu 0.678649 0.314456 2.27537e-18 352 63.546 0.00044629 -3.51739 63.546000 Cu 0.618673 0.294674 0.5 353 63.546 0.000147293 -3.5179 63.546000 Cu 0.698752 0.279763 6.46685e-18 355 63.546 6.28788e-05 -3.51766 63.546000 Cu 0.758836 0.299598 0.5 358 63.546 0.00026515 -3.51752 63.546000 Cu 0.89875 0.304691 0.5 285 63.546 0.000183016 -3.5181 63.546000 Cu 0.978732 0.289806 6.46685e-18 287 63.546 0.000283745 -3.51855 63.546000 Cu 0.838845 0.284758 1.79635e-16 356 63.546 0.000113271 -3.51772 63.546000 Cu 0.0182525 0.344525 0.5 313 63.546 0.00193339 -3.5189 63.546000 Cu 0.0984573 0.329417 0 315 63.546 0.000384756 -3.51782 63.546000 Cu 0.158406 0.349109 0.5 318 63.546 0.00194317 -3.51678 63.546000 Cu 0.238655 0.334274 1 316 63.546 0.000783926 -3.51702 63.546000 Cu 0.318775 0.319487 0.5 322 63.546 0.000262041 -3.51752 63.546000 Cu 0.298624 0.354174 0.5 345 63.546 0.00144216 -3.51673 63.546000 Cu 0.378635 0.33947 1 347 63.546 0.000560625 -3.51804 63.546000 Cu 0.518253 0.344525 6.46685e-18 348 63.546 0.00193339 -3.5189 63.546000 Cu 0.458566 0.324657 0.5 349 63.546 0.00139818 -3.51873 63.546000 Cu 0.43815 0.359584 0.5 350 63.546 0.00543731 -3.51907 63.546000 Cu 0.598457 0.329417 0.5 354 63.546 0.000384756 -3.51782 63.546000 Cu 0.658406 0.349109 6.46685e-18 377 63.546 0.00194317 -3.51678 63.546000 Cu 0.798624 0.354174 1.29217e-16 378 63.546 0.00144216 -3.51673 63.546000 Cu 0.738655 0.334274 0.5 379 63.546 0.000783926 -3.51702 63.546000 Cu 0.958566 0.324657 2.64662e-17 284 63.546 0.00139818 -3.51873 63.546000 Cu 0.878635 0.33947 0.5 286 63.546 0.000560625 -3.51804 63.546000 Cu 0.93815 0.359584 1 311 63.546 0.00543731 -3.51907 63.546000 Cu 0.818775 0.319487 3.84418e-17 381 63.546 0.000262041 -3.51752 63.546000 Cu 0.0779175 0.36418 1.19756e-19 312 63.546 0.00126046 -3.51748 63.546000 Cu 0.0572005 0.399026 1 339 63.546 0.00362856 -3.51657 63.546000 Cu 0.198128 0.4033 2.87416e-18 340 63.546 0.0190868 -3.51265 63.546000 Cu 0.137803 0.383693 0.5 341 63.546 0.00730527 -3.51558 63.546000 Cu 0.218352 0.368854 1 343 63.546 0.00397732 -3.51569 63.546000 Cu 0.358352 0.374298 1.53169e-16 344 63.546 0.00235217 -3.51748 63.546000 Cu 0.27845 0.388781 0.5 346 63.546 0.00822495 -3.51487 63.546000 Cu 0.41753 0.394727 0.5 371 63.546 0.022133 -3.51885 63.546000 Cu 0.497512 0.379524 1.16523e-16 373 63.546 0.009115 -3.51911 63.546000 Cu 0.577918 0.36418 0.5 375 63.546 0.00126046 -3.51748 63.546000 Cu 0.5572 0.399026 0.5 376 63.546 0.00362856 -3.51657 63.546000 Cu 0.637803 0.383693 2.23705e-16 374 63.546 0.00730527 -3.51558 63.546000 Cu 0.718352 0.368854 0.5 380 63.546 0.00397732 -3.51569 63.546000 Cu 0.698128 0.4033 0.5 393 63.546 0.0190868 -3.51265 63.546000 Cu 0.77845 0.388781 4.02262e-16 395 63.546 0.00822495 -3.51487 63.546000 Cu 0.91753 0.394727 6.46685e-18 309 63.546 0.022133 -3.51885 63.546000 Cu 0.858352 0.374298 0.5 310 63.546 0.00235217 -3.51748 63.546000 Cu 0.997512 0.379524 0.5 314 63.546 0.009115 -3.51911 63.546000 Cu 0.036419 0.434055 1 336 63.546 0.00861572 -3.51351 63.546000 Cu 0.117308 0.418239 0.5 342 63.546 0.0217077 -3.51279 63.546000 Cu 0.177788 0.43747 3.1975e-17 365 63.546 0.101184 -3.50164 63.546000 Cu 0.0969635 0.452827 0.5 363 63.546 0.0405778 -3.51045 63.546000 Cu 0.318175 0.444815 9.84398e-17 366 63.546 0.0706177 -3.48981 63.546000 Cu 0.258794 0.423271 0.5 367 63.546 0.0558369 -3.50712 63.546000 Cu 0.338353 0.409259 1.57001e-16 369 63.546 0.0119901 -3.51347 63.546000 Cu 0.396671 0.43031 0.5 372 63.546 0.0843937 -3.51647 63.546000 Cu 0.476786 0.414784 1.95443e-16 370 63.546 0.0321738 -3.51711 63.546000 Cu 0.455959 0.45044 1.31732e-16 387 63.546 0.0784586 -3.50972 63.546000 Cu 0.536419 0.434055 0.5 389 63.546 0.00861572 -3.51351 63.546000 Cu 0.596964 0.452827 3.20229e-16 388 63.546 0.0405778 -3.51045 63.546000 Cu 0.617308 0.418239 1.64066e-17 391 63.546 0.0217077 -3.51279 63.546000 Cu 0.758794 0.423271 2.78075e-16 392 63.546 0.0558369 -3.50712 63.546000 Cu 0.677788 0.43747 0.5 394 63.546 0.101184 -3.50164 63.546000 Cu 0.818175 0.444815 0.5 16 63.546 0.0706177 -3.48981 63.546000 Cu 0.896671 0.43031 4.37111e-17 335 63.546 0.0843937 -3.51647 63.546000 Cu 0.976786 0.414784 0.5 337 63.546 0.0321738 -3.51711 63.546000 Cu 0.955959 0.45044 0.5 338 63.546 0.0784586 -3.50972 63.546000 Cu 0.838353 0.409259 0.5 396 63.546 0.0119901 -3.51347 63.546000 Cu 0.0160163 0.469363 0 361 63.546 0.0447797 -3.50664 63.546000 Cu 0.158092 0.471322 1 362 63.546 0.407401 -3.48745 63.546000 Cu 0.0788135 0.487525 0.5 364 63.546 0.155374 -3.51733 63.546000 Cu 0.239463 0.457273 0.5 368 63.546 0.376263 -3.459 63.546000 Cu 0.220686 0.489566 0.5 382 63.546 7.41912 -3.19354 63.546000 Cu 0.299773 0.481245 2.89811e-17 383 63.546 5.11285 -3.36359 63.546000 Cu 0.375784 0.466712 0.5 385 63.546 0.358631 -3.50424 63.546000 Cu 0.4373 0.486724 1.50414e-16 384 63.546 0.290004 -3.48607 63.546000 Cu 0.516016 0.469363 0.5 390 63.546 0.0447797 -3.50664 63.546000 Cu 0.578813 0.487525 7.73627e-17 397 63.546 0.155374 -3.51733 63.546000 Cu 0.799773 0.481245 0.5 5 63.546 5.11285 -3.36359 63.546000 Cu 0.720686 0.489566 1.60114e-16 398 63.546 7.41912 -3.19354 63.546000 Cu 0.658092 0.471322 0.5 399 63.546 0.407401 -3.48745 63.546000 Cu 0.739463 0.457273 1.29457e-16 400 63.546 0.376263 -3.459 63.546000 Cu 0.875784 0.466712 7.99973e-17 334 63.546 0.358631 -3.50424 63.546000 Cu 0.9373 0.486724 0.5 360 63.546 0.290004 -3.48607 63.546000 Cu 0.00333391 0.50489 6.45487e-17 1 63.546 0.33748 -3.51089 63.546000 Cu 0.0787069 0.5223 0.5 2 63.546 0.160115 -3.51725 63.546000 Cu 0.0158621 0.540442 0 9 63.546 0.0484905 -3.50625 63.546000 Cu 0.145728 0.504916 1 32 63.546 3.36199 -3.42051 63.546000 Cu 0.157988 0.538508 1 33 63.546 0.413439 -3.4878 63.546000 Cu 0.220553 0.520256 0.5 34 63.546 7.4237 -3.19354 63.546000 Cu 0.299673 0.528561 1 35 63.546 5.11372 -3.36315 63.546000 Cu 0.37564 0.543106 0.5 37 63.546 0.360349 -3.50359 63.546000 Cu 0.357623 0.504893 0.5 386 63.546 3.79303 -3.48668 63.546000 Cu 0.437193 0.523062 0 14 63.546 0.297132 -3.48605 63.546000 Cu 0.503334 0.50489 0.5 15 63.546 0.33748 -3.51089 63.546000 Cu 0.578707 0.5223 2.44303e-17 17 63.546 0.160115 -3.51725 63.546000 Cu 0.515862 0.540442 0.5 20 63.546 0.0484905 -3.50625 63.546000 Cu 0.720553 0.520256 1.23589e-16 3 63.546 7.4237 -3.19354 63.546000 Cu 0.645728 0.504916 0.5 4 63.546 3.36199 -3.42051 63.546000 Cu 0.657988 0.538508 0.5 19 63.546 0.413439 -3.4878 63.546000 Cu 0.799673 0.528561 0.5 8 63.546 5.11372 -3.36315 63.546000 Cu 0.87564 0.543106 5.5567e-17 6 63.546 0.360349 -3.50359 63.546000 Cu 0.937193 0.523062 0.5 7 63.546 0.297132 -3.48605 63.546000 Cu 0.857623 0.504893 1.43708e-18 359 63.546 3.79303 -3.48668 63.546000 Cu 0.0365143 0.575783 1.24307e-16 10 63.546 0.00924708 -3.51286 63.546000 Cu 0.096859 0.556998 0.5 11 63.546 0.0413388 -3.51025 63.546000 Cu 0.177938 0.572391 1.71252e-16 58 63.546 0.105592 -3.50188 63.546000 Cu 0.318211 0.565013 1.42271e-16 36 63.546 0.0725986 -3.48981 63.546000 Cu 0.239405 0.552564 0.5 38 63.546 0.379039 -3.4594 63.546000 Cu 0.259117 0.586571 0.5 60 63.546 0.0551328 -3.50739 63.546000 Cu 0.396829 0.579545 0.5 42 63.546 0.0825047 -3.51598 63.546000 Cu 0.455895 0.559375 0 39 63.546 0.0809944 -3.50904 63.546000 Cu 0.536514 0.575783 0.5 41 63.546 0.00924708 -3.51286 63.546000 Cu 0.596859 0.556998 1.25625e-16 18 63.546 0.0413388 -3.51025 63.546000 Cu 0.739405 0.552564 6.28721e-17 21 63.546 0.379039 -3.4594 63.546000 Cu 0.759117 0.586571 1.55683e-17 22 63.546 0.0551328 -3.50739 63.546000 Cu 0.677938 0.572391 0.5 24 63.546 0.105592 -3.50188 63.546000 Cu 0.955895 0.559375 0.5 12 63.546 0.0809944 -3.50904 63.546000 Cu 0.818211 0.565013 0.5 23 63.546 0.0725986 -3.48981 63.546000 Cu 0.896829 0.579545 2.38914e-16 25 63.546 0.0825047 -3.51598 63.546000 Cu 0.117753 0.591622 0.5 13 63.546 0.0225855 -3.51254 63.546000 Cu 0.0579106 0.610838 1.71372e-16 29 63.546 0.00361619 -3.51624 63.546000 Cu 0.138732 0.626189 0.5 82 63.546 0.00754122 -3.51551 63.546000 Cu 0.19876 0.606564 6.46685e-18 59 63.546 0.0195375 -3.51264 63.546000 Cu 0.338784 0.600591 1.51133e-16 61 63.546 0.011399 -3.5137 63.546000 Cu 0.359299 0.635568 1.54965e-16 62 63.546 0.00227261 -3.51757 63.546000 Cu 0.279278 0.621084 0.5 64 63.546 0.0080163 -3.51511 63.546000 Cu 0.477189 0.595061 1.30175e-16 40 63.546 0.0331317 -3.51654 63.546000 Cu 0.557911 0.610838 0.5 46 63.546 0.00361619 -3.51624 63.546000 Cu 0.418236 0.615137 0.5 63 63.546 0.021994 -3.51875 63.546000 Cu 0.498466 0.630351 6.46685e-18 65 63.546 0.00903325 -3.51887 63.546000 Cu 0.617753 0.591622 1.39157e-16 43 63.546 0.0225855 -3.51254 63.546000 Cu 0.638732 0.626189 8.86198e-17 44 63.546 0.00754122 -3.51551 63.546000 Cu 0.69876 0.606564 0.5 45 63.546 0.0195375 -3.51264 63.546000 Cu 0.779278 0.621084 1.75323e-16 47 63.546 0.0080163 -3.51511 63.546000 Cu 0.998466 0.630351 0.5 31 63.546 0.00903325 -3.51887 63.546000 Cu 0.918236 0.615137 2.68254e-17 26 63.546 0.021994 -3.51875 63.546000 Cu 0.977189 0.595061 0.5 27 63.546 0.0331317 -3.51654 63.546000 Cu 0.838784 0.600591 0.5 28 63.546 0.011399 -3.5137 63.546000 Cu 0.859299 0.635568 0.5 49 63.546 0.00227261 -3.51757 63.546000 Cu 0.0789731 0.645717 1.55204e-16 30 63.546 0.00137287 -3.51732 63.546000 Cu 0.0194715 0.665376 0.5 53 63.546 0.00201507 -3.5187 63.546000 Cu 0.099892 0.680486 6.46685e-18 55 63.546 0.000344068 -3.5178 63.546000 Cu 0.159599 0.660798 0.5 86 63.546 0.00198745 -3.5168 63.546000 Cu 0.219411 0.64104 6.34709e-17 83 63.546 0.00429497 -3.51592 63.546000 Cu 0.240079 0.675649 3.25498e-16 84 63.546 0.00112168 -3.51703 63.546000 Cu 0.299804 0.655722 0.5 85 63.546 0.00146719 -3.51686 63.546000 Cu 0.379957 0.670424 2.76637e-17 87 63.546 0.00067855 -3.51798 63.546000 Cu 0.519471 0.665376 1.44187e-16 66 63.546 0.00201507 -3.5187 63.546000 Cu 0.578973 0.645717 0.5 67 63.546 0.00137287 -3.51732 63.546000 Cu 0.43924 0.650302 0.5 68 63.546 0.00557337 -3.51898 63.546000 Cu 0.599892 0.680486 0.5 72 63.546 0.000344068 -3.5178 63.546000 Cu 0.719411 0.64104 0.5 50 63.546 0.00429497 -3.51592 63.546000 Cu 0.659599 0.660798 1 69 63.546 0.00198745 -3.5168 63.546000 Cu 0.740079 0.675649 0.5 71 63.546 0.00112168 -3.51703 63.546000 Cu 0.799804 0.655722 1 48 63.546 0.00146719 -3.51686 63.546000 Cu 0.93924 0.650302 1.45025e-16 51 63.546 0.00557337 -3.51898 63.546000 Cu 0.879957 0.670424 0.5 54 63.546 0.00067855 -3.51798 63.546000 Cu 0.120403 0.715252 7.59256e-17 56 63.546 0.000143178 -3.51786 63.546000 Cu 0.0401323 0.700249 0.5 57 63.546 0.000427448 -3.5185 63.546000 Cu 0.180231 0.695468 0.5 108 63.546 0.000565176 -3.51741 63.546000 Cu 0.320298 0.690423 0.5 90 63.546 0.0002623 -3.51751 63.546000 Cu 0.260453 0.710333 1.58079e-17 109 63.546 0.000256705 -3.51741 63.546000 Cu 0.340649 0.725165 0.5 111 63.546 0.000113702 -3.51778 63.546000 Cu 0.400415 0.705228 1.67779e-16 88 63.546 0.000228535 -3.51817 63.546000 Cu 0.459988 0.685256 0.5 89 63.546 0.00128124 -3.5187 63.546000 Cu 0.540132 0.700249 2.24184e-16 91 63.546 0.000427448 -3.5185 63.546000 Cu 0.480506 0.720121 0.5 94 63.546 0.000269358 -3.51844 63.546000 Cu 0.680231 0.695468 3.60467e-17 70 63.546 0.000565176 -3.51741 63.546000 Cu 0.760453 0.710333 0.5 76 63.546 0.000256705 -3.51741 63.546000 Cu 0.620403 0.715252 0.5 93 63.546 0.000143178 -3.51786 63.546000 Cu 0.959988 0.685256 6.46685e-18 52 63.546 0.00128124 -3.5187 63.546000 Cu 0.820298 0.690423 1 73 63.546 0.0002623 -3.51751 63.546000 Cu 0.840649 0.725165 0 74 63.546 0.000113702 -3.51778 63.546000 Cu 0.900415 0.705228 0.5 75 63.546 0.000228535 -3.51817 63.546000 Cu 0.980506 0.720121 0 77 63.546 0.000269358 -3.51844 63.546000 Cu 0.000714802 0.754955 1 78 63.546 4.72699e-05 -3.51845 63.546000 Cu 0.0606149 0.735077 0.5 79 63.546 0.000152539 -3.51828 63.546000 Cu 0.080595 0.769889 0.5 81 63.546 7.03959e-05 -3.51826 63.546000 Cu 0.140629 0.750018 4.73038e-17 132 63.546 0.000126197 -3.51791 63.546000 Cu 0.280746 0.745036 7.62849e-17 110 63.546 0.000105938 -3.51763 63.546000 Cu 0.200616 0.730172 0.5 112 63.546 0.000162502 -3.51751 63.546000 Cu 0.360778 0.759911 0.5 116 63.546 0.000105135 -3.51799 63.546000 Cu 0.220593 0.764891 0.5 134 63.546 2.83347e-05 -3.51764 63.546000 Cu 0.560615 0.735077 1.40474e-16 92 63.546 0.000152539 -3.51828 63.546000 Cu 0.420765 0.740037 1 113 63.546 0.000172707 -3.51823 63.546000 Cu 0.500715 0.754955 0.5 115 63.546 4.72699e-05 -3.51845 63.546000 Cu 0.580595 0.769889 1 117 63.546 7.03959e-05 -3.51826 63.546000 Cu 0.700616 0.730172 7.78417e-17 95 63.546 0.000162502 -3.51751 63.546000 Cu 0.720593 0.764891 1 96 63.546 2.83347e-05 -3.51764 63.546000 Cu 0.780746 0.745036 0.5 97 63.546 0.000105938 -3.51763 63.546000 Cu 0.640629 0.750018 0.5 98 63.546 0.000126197 -3.51791 63.546000 Cu 0.920765 0.740037 0.5 80 63.546 0.000172707 -3.51823 63.546000 Cu 0.860778 0.759911 1 99 63.546 0.000105135 -3.51799 63.546000 Cu 0.0206318 0.789794 2.3592e-17 103 63.546 0.000225219 -3.51853 63.546000 Cu 0.100626 0.804694 0.5 105 63.546 0.000288333 -3.51814 63.546000 Cu 0.160494 0.784761 2.19514e-16 133 63.546 0.000187976 -3.51773 63.546000 Cu 0.300645 0.77975 1.6251e-16 135 63.546 0.000132521 -3.51767 63.546000 Cu 0.320764 0.814451 1.80832e-17 136 63.546 0.00047647 -3.5174 63.546000 Cu 0.38074 0.794676 0.5 137 63.546 0.000133445 -3.51785 63.546000 Cu 0.240588 0.799583 0.5 138 63.546 0.000322897 -3.51748 63.546000 Cu 0.440695 0.774844 1 114 63.546 7.95975e-05 -3.51833 63.546000 Cu 0.520632 0.789794 0.5 120 63.546 0.000225219 -3.51853 63.546000 Cu 0.460853 0.809667 1 139 63.546 0.000410118 -3.51845 63.546000 Cu 0.600626 0.804694 1 118 63.546 0.000288333 -3.51814 63.546000 Cu 0.660494 0.784761 0.5 119 63.546 0.000187976 -3.51773 63.546000 Cu 0.740588 0.799583 1 121 63.546 0.000322897 -3.51748 63.546000 Cu 0.88074 0.794676 1 100 63.546 0.000133445 -3.51785 63.546000 Cu 0.940695 0.774844 0.5 101 63.546 7.95975e-05 -3.51833 63.546000 Cu 0.800645 0.77975 0.5 102 63.546 0.000132521 -3.51767 63.546000 Cu 0.960853 0.809667 0.5 106 63.546 0.000410118 -3.51845 63.546000 Cu 0.820764 0.814451 0.5 123 63.546 0.00047647 -3.5174 63.546000 Cu 0.0408963 0.82466 2.15083e-16 104 63.546 0.00137701 -3.51879 63.546000 Cu 0.120885 0.839487 0.5 107 63.546 0.000596022 -3.51806 63.546000 Cu 0.0614536 0.859609 1.14487e-16 129 63.546 0.00581792 -3.51902 63.546000 Cu 0.180647 0.819481 7.52071e-17 158 63.546 0.00032292 -3.51749 63.546000 Cu 0.200947 0.854189 2.29693e-16 159 63.546 0.00143356 -3.5168 63.546000 Cu 0.260795 0.834269 0.5 160 63.546 0.000989181 -3.51707 63.546000 Cu 0.341113 0.849116 2.19154e-17 161 63.546 0.00196164 -3.51679 63.546000 Cu 0.481271 0.844532 0 140 63.546 0.00192137 -3.51885 63.546000 Cu 0.540896 0.82466 0.5 141 63.546 0.00137701 -3.51879 63.546000 Cu 0.40099 0.829422 0.5 142 63.546 0.000375766 -3.51778 63.546000 Cu 0.561454 0.859609 0.5 146 63.546 0.00581792 -3.51902 63.546000 Cu 0.760795 0.834269 2.39513e-19 122 63.546 0.000989181 -3.51707 63.546000 Cu 0.680647 0.819481 0.5 124 63.546 0.00032292 -3.51749 63.546000 Cu 0.620885 0.839487 1 143 63.546 0.000596022 -3.51806 63.546000 Cu 0.700947 0.854189 0.5 145 63.546 0.00143356 -3.5168 63.546000 Cu 0.90099 0.829422 1 125 63.546 0.000375766 -3.51778 63.546000 Cu 0.981271 0.844532 0.5 127 63.546 0.00192137 -3.51885 63.546000 Cu 0.841113 0.849116 0.5 128 63.546 0.00196164 -3.51679 63.546000 Cu 0.0822702 0.894746 1.62629e-16 130 63.546 0.0219508 -3.51883 63.546000 Cu 0.00217683 0.879538 0.5 131 63.546 0.00868698 -3.51895 63.546000 Cu 0.141344 0.874327 0.5 180 63.546 0.00222529 -3.5175 63.546000 Cu 0.361909 0.883714 1.22271e-16 162 63.546 0.00721593 -3.51556 63.546000 Cu 0.281278 0.868867 0.5 164 63.546 0.00414095 -3.5158 63.546000 Cu 0.221343 0.888809 2.50411e-16 181 63.546 0.00780907 -3.51501 63.546000 Cu 0.301706 0.903333 0.5 183 63.546 0.0185836 -3.51273 63.546000 Cu 0.421666 0.864188 0.5 163 63.546 0.00124462 -3.51737 63.546000 Cu 0.502177 0.879538 2.28735e-17 165 63.546 0.00868698 -3.51895 63.546000 Cu 0.58227 0.894746 0.5 167 63.546 0.0219508 -3.51883 63.546000 Cu 0.442612 0.899044 0.5 168 63.546 0.00367236 -3.51651 63.546000 Cu 0.641344 0.874327 0 144 63.546 0.00222529 -3.5175 63.546000 Cu 0.781278 0.868867 2.39513e-19 147 63.546 0.00414095 -3.5158 63.546000 Cu 0.721343 0.888809 0.5 150 63.546 0.00780907 -3.51501 63.546000 Cu 0.921666 0.864188 1.13769e-17 126 63.546 0.00124462 -3.51737 63.546000 Cu 0.801706 0.903333 1 148 63.546 0.0185836 -3.51273 63.546000 Cu 0.861909 0.883714 0.5 149 63.546 0.00721593 -3.51556 63.546000 Cu 0.942612 0.899044 3.44899e-17 151 63.546 0.00367236 -3.51651 63.546000 Cu 0.0230995 0.914804 0.5 153 63.546 0.0320561 -3.51703 63.546000 Cu 0.103246 0.930326 8.02368e-17 155 63.546 0.0829475 -3.51632 63.546000 Cu 0.0440017 0.95047 0.5 157 63.546 0.0788006 -3.50949 63.546000 Cu 0.16154 0.909284 0.5 184 63.546 0.011597 -3.51355 63.546000 Cu 0.181753 0.944842 0.5 195 63.546 0.0706817 -3.48986 63.546000 Cu 0.241103 0.923308 1.62629e-16 182 63.546 0.0546753 -3.50724 63.546000 Cu 0.382554 0.918266 6.75426e-17 185 63.546 0.021744 -3.51283 63.546000 Cu 0.322155 0.937506 0.5 188 63.546 0.100243 -3.50172 63.546000 Cu 0.523099 0.914804 4.86211e-17 166 63.546 0.0320561 -3.51703 63.546000 Cu 0.463521 0.934076 0.5 187 63.546 0.00880978 -3.51338 63.546000 Cu 0.544002 0.95047 1 189 63.546 0.0788006 -3.50949 63.546000 Cu 0.40302 0.952857 2.1652e-16 186 63.546 0.0413648 -3.51042 63.546000 Cu 0.66154 0.909284 0 169 63.546 0.011597 -3.51355 63.546000 Cu 0.681753 0.944842 7.66441e-18 170 63.546 0.0706817 -3.48986 63.546000 Cu 0.741103 0.923308 0.5 171 63.546 0.0546753 -3.50724 63.546000 Cu 0.603246 0.930326 0.5 172 63.546 0.0829475 -3.51632 63.546000 Cu 0.963521 0.934076 1 152 63.546 0.00880978 -3.51338 63.546000 Cu 0.882554 0.918266 0.5 154 63.546 0.021744 -3.51283 63.546000 Cu 0.822155 0.937506 1 173 63.546 0.100243 -3.50172 63.546000 Cu 0.90302 0.952857 0.5 175 63.546 0.0413648 -3.51042 63.546000 Cu 0.124203 0.966745 1 156 63.546 0.35756 -3.50389 63.546000 Cu 0.0627009 0.986777 0.5 178 63.546 0.292451 -3.48593 63.546000 Cu 0.260486 0.957311 1 196 63.546 0.375003 -3.45939 63.546000 Cu 0.279328 0.989611 6.46685e-18 197 63.546 7.42508 -3.19408 63.546000 Cu 0.341893 0.971363 0.5 198 63.546 0.406118 -3.4875 63.546000 Cu 0.200221 0.981279 0.5 199 63.546 5.1171 -3.36359 63.546000 Cu 0.562701 0.986777 1.98077e-16 190 63.546 0.292451 -3.48593 63.546000 Cu 0.483983 0.969404 0.5 192 63.546 0.0457668 -3.50649 63.546000 Cu 0.421179 0.987555 2.95319e-16 200 63.546 0.155264 -3.51721 63.546000 Cu 0.760486 0.957311 0.5 176 63.546 0.375003 -3.45939 63.546000 Cu 0.624203 0.966745 0.5 191 63.546 0.35756 -3.50389 63.546000 Cu 0.700221 0.981279 1.19756e-19 193 63.546 5.1171 -3.36359 63.546000 Cu 0.779328 0.989611 0.5 194 63.546 7.42508 -3.19408 63.546000 Cu 0.841893 0.971363 4.29926e-17 174 63.546 0.406118 -3.4875 63.546000 Cu 0.983983 0.969404 5.1136e-17 177 63.546 0.0457668 -3.50649 63.546000 Cu 0.921179 0.987555 0.5 179 63.546 0.155264 -3.51721