Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.3782 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.7391 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61414 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 0.151243 0.00463235 1.01741e-16 214 63.546 2.17906 -3.52696 63.546000 Cu 0.0511177 0.00412994 0.5 215 63.546 8.13516 -3.4787 63.546000 Cu 0.0806721 0.0358068 3.14988e-19 222 63.546 0.808918 -3.41885 63.546000 Cu 0.166583 0.0306512 0.5 224 63.546 0.568204 -3.47207 63.546000 Cu 0.348829 0.00460554 3.23238e-16 216 63.546 6.78972 -3.23353 63.546000 Cu 0.252341 0.00460028 0.5 217 63.546 1.13507 -3.51273 63.546000 Cu 0.26142 0.0288598 5.76728e-17 226 63.546 0.634191 -3.50615 63.546000 Cu 0.368181 0.0251578 0.5 228 63.546 3.71446 -3.44771 63.546000 Cu 0.466842 0.0203539 2.34141e-17 230 63.546 9.32798 -3.28907 63.546000 Cu 0.580672 0.0358068 1.94993e-19 231 63.546 0.808918 -3.41885 63.546000 Cu 0.551118 0.00412994 0.5 232 63.546 8.13516 -3.4787 63.546000 Cu 0.485969 0.0424852 0.5 233 63.546 0.746983 -3.46323 63.546000 Cu 0.651243 0.00463235 6.07627e-17 234 63.546 2.17906 -3.52696 63.546000 Cu 0.76142 0.0288598 1.42735e-16 235 63.546 0.634191 -3.50615 63.546000 Cu 0.752341 0.00460028 0.5 236 63.546 1.13507 -3.51273 63.546000 Cu 0.666583 0.0306512 0.5 237 63.546 0.568204 -3.47207 63.546000 Cu 0.848829 0.00460554 3.58502e-16 211 63.546 6.78972 -3.23353 63.546000 Cu 0.966842 0.0203539 1.42495e-18 212 63.546 9.32798 -3.28907 63.546000 Cu 0.868181 0.0251578 0.5 213 63.546 3.71446 -3.44771 63.546000 Cu 0.985969 0.0424852 0.5 220 63.546 0.746983 -3.46323 63.546000 Cu 0.00162697 0.0659888 2.99989e-20 219 63.546 0.0467156 -3.54623 63.546000 Cu 0.0975613 0.061374 0.5 225 63.546 0.0759845 -3.51726 63.546000 Cu 0.0191511 0.0903072 0.5 241 63.546 0.00549059 -3.54293 63.546000 Cu 0.114831 0.0859551 1 243 63.546 0.0128996 -3.53447 63.546000 Cu 0.189495 0.0569992 2.10592e-17 223 63.546 0.104247 -3.50863 63.546000 Cu 0.383244 0.0477729 1.56489e-16 227 63.546 0.0676901 -3.5343 63.546000 Cu 0.284157 0.0521596 0.5 229 63.546 0.124401 -3.54239 63.546000 Cu 0.210714 0.0813013 0.5 245 63.546 0.0189726 -3.53147 63.546000 Cu 0.30629 0.0761899 1.3261e-16 247 63.546 0.00656928 -3.53929 63.546000 Cu 0.403611 0.07099 0.5 249 63.546 0.0295814 -3.54761 63.546000 Cu 0.501627 0.0659888 1 251 63.546 0.0467156 -3.54623 63.546000 Cu 0.519151 0.0903072 0.5 254 63.546 0.00549059 -3.54293 63.546000 Cu 0.597561 0.061374 0.5 253 63.546 0.0759845 -3.51726 63.546000 Cu 0.42325 0.0950589 1.79993e-19 248 63.546 0.00823795 -3.54376 63.546000 Cu 0.614831 0.0859551 2.6999e-19 252 63.546 0.0128996 -3.53447 63.546000 Cu 0.689495 0.0569992 2.24992e-19 255 63.546 0.104247 -3.50863 63.546000 Cu 0.784157 0.0521596 0.5 257 63.546 0.124401 -3.54239 63.546000 Cu 0.710714 0.0813013 0.5 258 63.546 0.0189726 -3.53147 63.546000 Cu 0.883244 0.0477729 2.35806e-16 218 63.546 0.0676901 -3.5343 63.546000 Cu 0.903611 0.07099 0.5 221 63.546 0.0295814 -3.54761 63.546000 Cu 0.80629 0.0761899 1.40455e-16 256 63.546 0.00656928 -3.53929 63.546000 Cu 0.92325 0.0950589 1 239 63.546 0.00823795 -3.54376 63.546000 Cu 0.0380924 0.114702 1.06946e-17 240 63.546 0.00207731 -3.53873 63.546000 Cu 0.134122 0.110048 0.5 246 63.546 0.00319566 -3.53843 63.546000 Cu 0.0578127 0.138911 0.5 263 63.546 0.000558062 -3.5388 63.546000 Cu 0.153953 0.134086 2.99989e-20 265 63.546 0.000377218 -3.54001 63.546000 Cu 0.230628 0.105234 3.15438e-17 244 63.546 0.00163445 -3.53835 63.546000 Cu 0.327138 0.100162 0.5 250 63.546 0.00272128 -3.53999 63.546000 Cu 0.25038 0.129202 0.5 267 63.546 0.000577113 -3.54088 63.546000 Cu 0.346684 0.124276 7.59572e-17 269 63.546 0.00144756 -3.54077 63.546000 Cu 0.442531 0.119396 0.5 271 63.546 0.000898292 -3.53995 63.546000 Cu 0.538092 0.114702 3.29988e-19 273 63.546 0.00207731 -3.53873 63.546000 Cu 0.557813 0.138911 0.5 276 63.546 0.000558062 -3.5388 63.546000 Cu 0.653953 0.134086 1 274 63.546 0.000377218 -3.54001 63.546000 Cu 0.634122 0.110048 0.5 275 63.546 0.00319566 -3.53843 63.546000 Cu 0.730628 0.105234 2.84539e-17 277 63.546 0.00163445 -3.53835 63.546000 Cu 0.75038 0.129202 0.5 279 63.546 0.000577113 -3.54088 63.546000 Cu 0.846684 0.124276 1.43995e-18 238 63.546 0.00144756 -3.54077 63.546000 Cu 0.942531 0.119396 0.5 242 63.546 0.000898292 -3.53995 63.546000 Cu 0.827138 0.100162 0.5 278 63.546 0.00272128 -3.53999 63.546000 Cu 0.0775427 0.163051 1.49994e-20 262 63.546 8.00193e-05 -3.53974 63.546000 Cu 0.173678 0.158199 0.5 268 63.546 6.51149e-05 -3.54053 63.546000 Cu 0.0970797 0.187189 0.5 284 63.546 1.38945e-05 -3.54007 63.546000 Cu 0.193235 0.182347 2.20042e-17 286 63.546 4.08583e-05 -3.54011 63.546000 Cu 0.26984 0.15332 8.99966e-20 266 63.546 0.000194844 -3.54098 63.546000 Cu 0.36595 0.14847 0.5 272 63.546 0.000178204 -3.54031 63.546000 Cu 0.289309 0.177502 0.5 288 63.546 3.06182e-05 -3.54018 63.546000 Cu 0.385355 0.172669 4.64983e-19 290 63.546 2.6219e-05 -3.53991 63.546000 Cu 0.461904 0.143686 1 270 63.546 0.000265835 -3.53902 63.546000 Cu 0.481412 0.167864 0.5 292 63.546 6.36847e-05 -3.53949 63.546000 Cu 0.577543 0.163051 1 294 63.546 8.00193e-05 -3.53974 63.546000 Cu 0.59708 0.187189 0.5 297 63.546 1.38945e-05 -3.54007 63.546000 Cu 0.693235 0.182347 1.4359e-16 295 63.546 4.08583e-05 -3.54011 63.546000 Cu 0.673678 0.158199 0.5 296 63.546 6.51149e-05 -3.54053 63.546000 Cu 0.76984 0.15332 4.49983e-20 298 63.546 0.000194844 -3.54098 63.546000 Cu 0.789309 0.177502 0.5 299 63.546 3.06182e-05 -3.54018 63.546000 Cu 0.885355 0.172669 9.03566e-17 259 63.546 2.6219e-05 -3.53991 63.546000 Cu 0.86595 0.14847 0.5 260 63.546 0.000178204 -3.54031 63.546000 Cu 0.961904 0.143686 1.08746e-16 261 63.546 0.000265835 -3.53902 63.546000 Cu 0.981412 0.167864 0.5 264 63.546 6.36847e-05 -3.53949 63.546000 Cu 0.000942357 0.192018 5.84978e-19 282 63.546 1.94307e-05 -3.53989 63.546000 Cu 0.116562 0.211324 5.76728e-17 283 63.546 4.03318e-05 -3.54002 63.546000 Cu 0.020412 0.216159 0.5 285 63.546 2.62692e-05 -3.53999 63.546000 Cu 0.135875 0.235466 0.5 306 63.546 9.38607e-06 -3.53987 63.546000 Cu 0.308753 0.20166 2.03842e-17 287 63.546 2.00674e-05 -3.53977 63.546000 Cu 0.212682 0.206487 0.5 289 63.546 4.29344e-05 -3.53987 63.546000 Cu 0.231979 0.230634 2.15542e-17 308 63.546 5.64042e-06 -3.53983 63.546000 Cu 0.328102 0.225806 0.5 310 63.546 1.04533e-05 -3.53987 63.546000 Cu 0.500942 0.192018 2.99989e-20 291 63.546 1.94307e-05 -3.53989 63.546000 Cu 0.404839 0.196838 0.5 293 63.546 2.09922e-05 -3.53981 63.546000 Cu 0.424256 0.220983 1.18946e-17 312 63.546 1.52882e-05 -3.53996 63.546000 Cu 0.520412 0.216159 0.5 314 63.546 2.62692e-05 -3.53999 63.546000 Cu 0.616562 0.211324 1.66344e-17 316 63.546 4.03318e-05 -3.54002 63.546000 Cu 0.731979 0.230634 1.25395e-17 317 63.546 5.64042e-06 -3.53983 63.546000 Cu 0.712682 0.206487 0.5 318 63.546 4.29344e-05 -3.53987 63.546000 Cu 0.635875 0.235466 0.5 319 63.546 9.38607e-06 -3.53987 63.546000 Cu 0.924256 0.220983 4.79982e-19 280 63.546 1.52882e-05 -3.53996 63.546000 Cu 0.904839 0.196838 0.5 281 63.546 2.09922e-05 -3.53981 63.546000 Cu 0.808753 0.20166 5.17331e-17 320 63.546 2.00674e-05 -3.53977 63.546000 Cu 0.828102 0.225806 0.5 321 63.546 1.04533e-05 -3.53987 63.546000 Cu 0.0397554 0.240299 1.64994e-19 304 63.546 2.28798e-05 -3.53995 63.546000 Cu 0.155126 0.259602 1 305 63.546 7.2404e-06 -3.53972 63.546000 Cu 0.0590221 0.264424 0.5 307 63.546 1.12919e-05 -3.53969 63.546000 Cu 0.17439 0.283728 0.5 328 63.546 2.41366e-05 -3.53991 63.546000 Cu 0.347402 0.249941 1 309 63.546 3.24331e-06 -3.54 63.546000 Cu 0.251243 0.254768 0.5 311 63.546 5.57943e-06 -3.53989 63.546000 Cu 0.270521 0.278912 2.36241e-17 330 63.546 1.72688e-05 -3.54001 63.546000 Cu 0.366688 0.274077 0.5 332 63.546 6.17963e-06 -3.54004 63.546000 Cu 0.539755 0.240299 1 313 63.546 2.28798e-05 -3.53995 63.546000 Cu 0.443585 0.245124 0.5 315 63.546 1.26639e-05 -3.54001 63.546000 Cu 0.462853 0.269245 8.99966e-20 334 63.546 5.00666e-06 -3.5398 63.546000 Cu 0.559022 0.264424 0.5 336 63.546 1.12919e-05 -3.53969 63.546000 Cu 0.655126 0.259602 1 338 63.546 7.2404e-06 -3.53972 63.546000 Cu 0.770521 0.278912 5.76728e-17 339 63.546 1.72688e-05 -3.54001 63.546000 Cu 0.751243 0.254768 0.5 340 63.546 5.57943e-06 -3.53989 63.546000 Cu 0.67439 0.283728 0.5 341 63.546 2.41366e-05 -3.53991 63.546000 Cu 0.847402 0.249941 5.03981e-17 300 63.546 3.24331e-06 -3.54 63.546000 Cu 0.962853 0.269245 5.76728e-17 301 63.546 5.00666e-06 -3.5398 63.546000 Cu 0.943585 0.245124 0.5 302 63.546 1.26639e-05 -3.54001 63.546000 Cu 0.866688 0.274077 0.5 303 63.546 6.17963e-06 -3.54004 63.546000 Cu 0.00133624 0.317508 1 323 63.546 2.50783e-05 -3.53978 63.546000 Cu 0.0782055 0.288549 3.41987e-18 326 63.546 1.84044e-05 -3.53979 63.546000 Cu 0.0974353 0.312695 0.5 329 63.546 6.00055e-06 -3.53966 63.546000 Cu 0.193523 0.307877 1 327 63.546 3.17816e-05 -3.53996 63.546000 Cu 0.385945 0.298203 1 331 63.546 1.05068e-05 -3.54006 63.546000 Cu 0.28973 0.303044 0.5 333 63.546 9.87197e-06 -3.54004 63.546000 Cu 0.21273 0.332028 0.5 349 63.546 6.07039e-05 -3.5402 63.546000 Cu 0.308931 0.327169 3.63736e-17 351 63.546 1.82742e-05 -3.5403 63.546000 Cu 0.578206 0.288549 7.9347e-18 335 63.546 1.84044e-05 -3.53979 63.546000 Cu 0.482121 0.293368 0.5 337 63.546 3.08815e-05 -3.53987 63.546000 Cu 0.40513 0.322328 0.5 353 63.546 1.25508e-05 -3.53998 63.546000 Cu 0.501336 0.317508 5.76728e-17 355 63.546 2.50783e-05 -3.53978 63.546000 Cu 0.597435 0.312695 0.5 357 63.546 6.00055e-06 -3.53966 63.546000 Cu 0.693523 0.307877 2.47491e-17 359 63.546 3.17816e-05 -3.53996 63.546000 Cu 0.78973 0.303044 0.5 361 63.546 9.87197e-06 -3.54004 63.546000 Cu 0.71273 0.332028 0.5 362 63.546 6.07039e-05 -3.5402 63.546000 Cu 0.885945 0.298203 2.39391e-17 322 63.546 1.05068e-05 -3.54006 63.546000 Cu 0.982121 0.293368 0.5 324 63.546 3.08815e-05 -3.53987 63.546000 Cu 0.90513 0.322328 0.5 325 63.546 1.25508e-05 -3.53998 63.546000 Cu 0.808931 0.327169 6.64775e-17 360 63.546 1.82742e-05 -3.5403 63.546000 Cu 0.0397102 0.365814 7.79971e-19 344 63.546 0.000233917 -3.53908 63.546000 Cu 0.0205319 0.341635 0.5 345 63.546 9.52683e-05 -3.53937 63.546000 Cu 0.116652 0.336847 7.04974e-19 347 63.546 3.52227e-05 -3.53965 63.546000 Cu 0.135732 0.361026 0.5 350 63.546 0.000238098 -3.54032 63.546000 Cu 0.23193 0.356177 3.59986e-19 348 63.546 0.000211344 -3.54085 63.546000 Cu 0.32819 0.351299 0.5 354 63.546 5.84547e-05 -3.54032 63.546000 Cu 0.251086 0.380268 0.5 371 63.546 0.000480687 -3.54076 63.546000 Cu 0.347559 0.375378 5.76728e-17 373 63.546 0.000442848 -3.53975 63.546000 Cu 0.424374 0.346442 2.24992e-19 352 63.546 0.000108693 -3.53948 63.546000 Cu 0.520532 0.341635 0.5 358 63.546 9.52683e-05 -3.53937 63.546000 Cu 0.443769 0.370566 0.5 375 63.546 0.000740376 -3.53873 63.546000 Cu 0.53971 0.365814 8.89767e-17 377 63.546 0.000233917 -3.53908 63.546000 Cu 0.616652 0.336847 6.14977e-19 356 63.546 3.52227e-05 -3.53965 63.546000 Cu 0.635732 0.361026 0.5 379 63.546 0.000238098 -3.54032 63.546000 Cu 0.73193 0.356177 1 381 63.546 0.000211344 -3.54085 63.546000 Cu 0.751086 0.380268 0.5 383 63.546 0.000480687 -3.54076 63.546000 Cu 0.847559 0.375378 1 342 63.546 0.000442848 -3.53975 63.546000 Cu 0.924374 0.346442 1 343 63.546 0.000108693 -3.53948 63.546000 Cu 0.943769 0.370566 0.5 346 63.546 0.000740376 -3.53873 63.546000 Cu 0.82819 0.351299 0.5 382 63.546 5.84547e-05 -3.54032 63.546000 Cu 0.0776395 0.41443 2.92489e-18 366 63.546 0.00906558 -3.54386 63.546000 Cu 0.058692 0.390091 0.5 367 63.546 0.00102096 -3.54006 63.546000 Cu 0.154639 0.385212 1 369 63.546 0.00172265 -3.54079 63.546000 Cu 0.173895 0.409304 0.5 372 63.546 0.00285343 -3.54006 63.546000 Cu 0.270544 0.404226 1 370 63.546 0.00206015 -3.53829 63.546000 Cu 0.367042 0.399423 0.5 376 63.546 0.00361308 -3.53832 63.546000 Cu 0.290186 0.42818 0.5 392 63.546 0.0200335 -3.53133 63.546000 Cu 0.385933 0.423551 1.03631e-16 394 63.546 0.0120843 -3.53443 63.546000 Cu 0.46304 0.394791 7.16823e-17 374 63.546 0.00167644 -3.53893 63.546000 Cu 0.558692 0.390091 0.5 380 63.546 0.00102096 -3.54006 63.546000 Cu 0.481649 0.419204 0.5 396 63.546 0.00610021 -3.54325 63.546000 Cu 0.57764 0.41443 1 398 63.546 0.00906558 -3.54386 63.546000 Cu 0.654639 0.385212 1 378 63.546 0.00172265 -3.54079 63.546000 Cu 0.673895 0.409304 0.5 400 63.546 0.00285343 -3.54006 63.546000 Cu 0.770544 0.404226 5.99977e-20 402 63.546 0.00206015 -3.53829 63.546000 Cu 0.790186 0.42818 0.5 403 63.546 0.0200335 -3.53133 63.546000 Cu 0.885933 0.423551 5.76728e-17 363 63.546 0.0120843 -3.53443 63.546000 Cu 0.867042 0.399423 0.5 364 63.546 0.00361308 -3.53832 63.546000 Cu 0.96304 0.394791 4.19984e-19 365 63.546 0.00167644 -3.53893 63.546000 Cu 0.981649 0.419204 0.5 368 63.546 0.00610021 -3.54325 63.546000 Cu 0.11747 0.461644 1 387 63.546 0.0701164 -3.53357 63.546000 Cu 0.0971019 0.438457 0.5 388 63.546 0.0280425 -3.54734 63.546000 Cu 0.0145916 0.466979 0.5 389 63.546 0.676355 -3.46512 63.546000 Cu 0.194583 0.433265 1 390 63.546 0.00748364 -3.53924 63.546000 Cu 0.311062 0.452531 3.61936e-17 391 63.546 0.0999344 -3.50899 63.546000 Cu 0.216492 0.457303 0.5 393 63.546 0.123733 -3.54236 63.546000 Cu 0.514592 0.466979 0.5 210 63.546 0.676355 -3.46512 63.546000 Cu 0.498924 0.44354 8.99966e-20 395 63.546 0.0528465 -3.54609 63.546000 Cu 0.402941 0.448165 0.5 397 63.546 0.07736 -3.5174 63.546000 Cu 0.419714 0.473785 6.89974e-19 411 63.546 0.726342 -3.42791 63.546000 Cu 0.597102 0.438457 0.5 401 63.546 0.0280425 -3.54734 63.546000 Cu 0.716492 0.457303 0.5 12 63.546 0.123733 -3.54236 63.546000 Cu 0.61747 0.461644 1 205 63.546 0.0701164 -3.53357 63.546000 Cu 0.694583 0.433265 1.23655e-16 399 63.546 0.00748364 -3.53924 63.546000 Cu 0.998924 0.44354 4.45783e-17 386 63.546 0.0528465 -3.54609 63.546000 Cu 0.811062 0.452531 8.99966e-20 5 63.546 0.0999344 -3.50899 63.546000 Cu 0.919714 0.473785 7.24473e-18 384 63.546 0.726342 -3.42791 63.546000 Cu 0.902941 0.448165 0.5 385 63.546 0.07736 -3.5174 63.546000 Cu 0.0335337 0.520766 3.89985e-19 4 63.546 9.28969 -3.28828 63.546000 Cu 0.151247 0.504938 1 7 63.546 6.81529 -3.23381 63.546000 Cu 0.0340309 0.489009 5.3998e-19 406 63.546 9.2175 -3.28719 63.546000 Cu 0.132439 0.484279 0.5 407 63.546 3.65489 -3.44997 63.546000 Cu 0.333627 0.478869 0.5 410 63.546 0.516991 -3.47623 63.546000 Cu 0.247638 0.504932 0.5 9 63.546 1.13048 -3.5125 63.546000 Cu 0.238801 0.480668 1 408 63.546 0.611374 -3.50833 63.546000 Cu 0.348758 0.504949 1.10396e-17 409 63.546 2.17582 -3.52675 63.546000 Cu 0.533534 0.520766 1 14 63.546 9.28969 -3.28828 63.546000 Cu 0.448899 0.504673 0.5 209 63.546 8.12325 -3.47789 63.546000 Cu 0.534031 0.489009 2.12092e-17 412 63.546 9.2175 -3.28719 63.546000 Cu 0.651247 0.504938 1 1 63.546 6.81529 -3.23381 63.546000 Cu 0.747638 0.504932 0.5 3 63.546 1.13048 -3.5125 63.546000 Cu 0.632439 0.484279 0.5 10 63.546 3.65489 -3.44997 63.546000 Cu 0.738801 0.480668 6.19477e-17 203 63.546 0.611374 -3.50833 63.546000 Cu 0.833627 0.478869 0.5 2 63.546 0.516991 -3.47623 63.546000 Cu 0.848758 0.504949 1.95443e-17 404 63.546 2.17582 -3.52675 63.546000 Cu 0.948899 0.504673 0.5 405 63.546 8.12325 -3.47789 63.546000 Cu 0.132155 0.525559 0.5 6 63.546 3.68868 -3.44865 63.546000 Cu 0.0143032 0.542841 0.5 24 63.546 0.726165 -3.46343 63.546000 Cu 0.117074 0.548156 7.62721e-17 26 63.546 0.0681049 -3.53356 63.546000 Cu 0.0966981 0.571346 0.5 27 63.546 0.0282659 -3.54764 63.546000 Cu 0.238698 0.52919 2.5499e-19 8 63.546 0.62076 -3.50725 63.546000 Cu 0.333577 0.53098 0.5 13 63.546 0.555166 -3.47365 63.546000 Cu 0.216182 0.552521 0.5 29 63.546 0.125009 -3.54245 63.546000 Cu 0.310795 0.557331 1 30 63.546 0.103972 -3.50852 63.546000 Cu 0.402614 0.561689 0.5 32 63.546 0.078651 -3.5172 63.546000 Cu 0.419526 0.536114 1.02941e-16 11 63.546 0.784403 -3.4214 63.546000 Cu 0.514303 0.542841 0.5 17 63.546 0.726165 -3.46343 63.546000 Cu 0.498602 0.56632 5.54979e-19 34 63.546 0.0481427 -3.54649 63.546000 Cu 0.596698 0.571346 0.5 36 63.546 0.0282659 -3.54764 63.546000 Cu 0.617074 0.548156 1 15 63.546 0.0681049 -3.53356 63.546000 Cu 0.632155 0.525559 0.5 16 63.546 3.68868 -3.44865 63.546000 Cu 0.738698 0.52919 1 18 63.546 0.62076 -3.50725 63.546000 Cu 0.716182 0.552521 0.5 21 63.546 0.125009 -3.54245 63.546000 Cu 0.810795 0.557331 8.29019e-17 19 63.546 0.103972 -3.50852 63.546000 Cu 0.833577 0.53098 0.5 20 63.546 0.555166 -3.47365 63.546000 Cu 0.919526 0.536114 1 22 63.546 0.784403 -3.4214 63.546000 Cu 0.998602 0.56632 1.05611e-16 23 63.546 0.0481427 -3.54649 63.546000 Cu 0.902614 0.561689 0.5 25 63.546 0.078651 -3.5172 63.546000 Cu 0.19411 0.576535 7.26123e-17 28 63.546 0.00699614 -3.53937 63.546000 Cu 0.0771317 0.595369 1.11506e-16 46 63.546 0.00845758 -3.54389 63.546000 Cu 0.173351 0.600473 0.5 49 63.546 0.00274572 -3.54004 63.546000 Cu 0.385499 0.58626 1.32745e-17 31 63.546 0.0121742 -3.53431 63.546000 Cu 0.289708 0.581636 0.5 33 63.546 0.0203561 -3.5312 63.546000 Cu 0.269912 0.605546 1.36495e-16 50 63.546 0.00205408 -3.53835 63.546000 Cu 0.366448 0.610355 0.5 52 63.546 0.00358001 -3.53845 63.546000 Cu 0.577132 0.595369 1 35 63.546 0.00845758 -3.54389 63.546000 Cu 0.481187 0.590613 0.5 37 63.546 0.00555881 -3.54312 63.546000 Cu 0.462461 0.614981 1 54 63.546 0.0016635 -3.53876 63.546000 Cu 0.69411 0.576535 8.90967e-18 38 63.546 0.00699614 -3.53937 63.546000 Cu 0.769912 0.605546 7.42772e-17 39 63.546 0.00205408 -3.53835 63.546000 Cu 0.789708 0.581636 0.5 40 63.546 0.0203561 -3.5312 63.546000 Cu 0.673351 0.600473 0.5 41 63.546 0.00274572 -3.54004 63.546000 Cu 0.885499 0.58626 1 42 63.546 0.0121742 -3.53431 63.546000 Cu 0.962461 0.614981 1 43 63.546 0.0016635 -3.53876 63.546000 Cu 0.981187 0.590613 0.5 44 63.546 0.00555881 -3.54312 63.546000 Cu 0.866448 0.610355 0.5 45 63.546 0.00358001 -3.53845 63.546000 Cu 0.0580474 0.619666 0.5 47 63.546 0.0010189 -3.53997 63.546000 Cu 0.153967 0.624533 4.03485e-17 48 63.546 0.00181047 -3.54063 63.546000 Cu 0.039016 0.643915 1 66 63.546 0.000217422 -3.53897 63.546000 Cu 0.134987 0.648679 0.5 68 63.546 0.000286928 -3.54017 63.546000 Cu 0.34693 0.634361 7.00924e-17 51 63.546 0.000569279 -3.53994 63.546000 Cu 0.250401 0.629466 0.5 53 63.546 0.000449803 -3.54077 63.546000 Cu 0.231124 0.653514 2.18092e-17 70 63.546 0.000427571 -3.54079 63.546000 Cu 0.327389 0.658402 0.5 72 63.546 4.87564e-05 -3.5405 63.546000 Cu 0.539016 0.643915 5.06831e-17 55 63.546 0.000217422 -3.53897 63.546000 Cu 0.558047 0.619666 0.5 56 63.546 0.0010189 -3.53997 63.546000 Cu 0.443088 0.639164 0.5 57 63.546 0.000740456 -3.53872 63.546000 Cu 0.423674 0.663264 5.76728e-17 74 63.546 0.000232849 -3.53967 63.546000 Cu 0.653967 0.624533 4.02735e-17 58 63.546 0.00181047 -3.54063 63.546000 Cu 0.731124 0.653514 1.70094e-17 59 63.546 0.000427571 -3.54079 63.546000 Cu 0.750401 0.629466 0.5 60 63.546 0.000449803 -3.54077 63.546000 Cu 0.634987 0.648679 0.5 61 63.546 0.000286928 -3.54017 63.546000 Cu 0.84693 0.634361 1 62 63.546 0.000569279 -3.53994 63.546000 Cu 0.923674 0.663264 5.99977e-19 63 63.546 0.000232849 -3.53967 63.546000 Cu 0.943088 0.639164 0.5 64 63.546 0.000740456 -3.53872 63.546000 Cu 0.827389 0.658402 0.5 65 63.546 4.87564e-05 -3.5405 63.546000 Cu 0.115834 0.672848 1.07696e-16 67 63.546 7.21021e-05 -3.53997 63.546000 Cu 0.0198006 0.668063 0.5 69 63.546 0.000202154 -3.53945 63.546000 Cu 0.0964384 0.696995 0.5 88 63.546 0.000108355 -3.53989 63.546000 Cu 0.19248 0.701782 1 90 63.546 2.21396e-05 -3.53976 63.546000 Cu 0.000337849 0.692179 4.44133e-17 86 63.546 0.000111911 -3.53994 63.546000 Cu 0.307954 0.682475 1 71 63.546 0.000116378 -3.54022 63.546000 Cu 0.211857 0.677649 0.5 73 63.546 0.000102708 -3.54017 63.546000 Cu 0.28852 0.706575 0.5 92 63.546 8.04405e-05 -3.53997 63.546000 Cu 0.384597 0.71141 5.76728e-17 94 63.546 3.36271e-05 -3.54015 63.546000 Cu 0.40418 0.687333 0.5 77 63.546 3.35778e-05 -3.54008 63.546000 Cu 0.500338 0.692179 5.58429e-17 75 63.546 0.000111911 -3.53994 63.546000 Cu 0.519801 0.668063 0.5 76 63.546 0.000202154 -3.53945 63.546000 Cu 0.596438 0.696995 0.5 81 63.546 0.000108355 -3.53989 63.546000 Cu 0.615834 0.672848 3.17838e-17 78 63.546 7.21021e-05 -3.53997 63.546000 Cu 0.69248 0.701782 1 79 63.546 2.21396e-05 -3.53976 63.546000 Cu 0.711857 0.677649 0.5 80 63.546 0.000102708 -3.54017 63.546000 Cu 0.78852 0.706575 0.5 85 63.546 8.04405e-05 -3.53997 63.546000 Cu 0.807954 0.682475 5.4253e-17 82 63.546 0.000116378 -3.54022 63.546000 Cu 0.884597 0.71141 3.44987e-19 83 63.546 3.36271e-05 -3.54015 63.546000 Cu 0.90418 0.687333 0.5 84 63.546 3.35778e-05 -3.54008 63.546000 Cu 0.0769144 0.721099 2.99989e-20 87 63.546 6.76903e-05 -3.53997 63.546000 Cu 0.172991 0.725901 0.5 93 63.546 3.05075e-05 -3.53978 63.546000 Cu 0.0573277 0.745186 0.5 108 63.546 3.40695e-05 -3.54005 63.546000 Cu 0.153406 0.750015 1 111 63.546 5.98226e-05 -3.53996 63.546000 Cu 0.268993 0.730695 1.19995e-19 91 63.546 1.12649e-05 -3.5398 63.546000 Cu 0.365028 0.735505 0.5 97 63.546 5.01893e-05 -3.53999 63.546000 Cu 0.249439 0.754811 0.5 113 63.546 1.27401e-05 -3.53984 63.546000 Cu 0.3455 0.759599 1 114 63.546 4.67999e-05 -3.53981 63.546000 Cu 0.461177 0.740341 3.23988e-18 95 63.546 7.47544e-06 -3.54011 63.546000 Cu 0.480738 0.716265 0.5 96 63.546 1.42675e-05 -3.54014 63.546000 Cu 0.576914 0.721099 1.29415e-16 98 63.546 6.76903e-05 -3.53997 63.546000 Cu 0.557328 0.745186 0.5 101 63.546 3.40695e-05 -3.54005 63.546000 Cu 0.653406 0.750015 2.99989e-19 99 63.546 5.98226e-05 -3.53996 63.546000 Cu 0.672991 0.725901 0.5 100 63.546 3.05075e-05 -3.53978 63.546000 Cu 0.768993 0.730695 1 102 63.546 1.12649e-05 -3.5398 63.546000 Cu 0.749439 0.754811 0.5 105 63.546 1.27401e-05 -3.53984 63.546000 Cu 0.980738 0.716265 0.5 89 63.546 1.42675e-05 -3.54014 63.546000 Cu 0.8455 0.759599 1 103 63.546 4.67999e-05 -3.53981 63.546000 Cu 0.865028 0.735505 0.5 104 63.546 5.01893e-05 -3.53999 63.546000 Cu 0.961177 0.740341 2.5499e-19 106 63.546 7.47544e-06 -3.54011 63.546000 Cu 0.0376793 0.769258 1 107 63.546 1.5047e-05 -3.53992 63.546000 Cu 0.133823 0.774104 0.5 110 63.546 5.60033e-05 -3.54011 63.546000 Cu 0.0181031 0.793324 0.5 128 63.546 0.000165292 -3.5401 63.546000 Cu 0.11433 0.798176 9.95963e-18 130 63.546 1.62417e-05 -3.54021 63.546000 Cu 0.229977 0.778927 9.32215e-17 112 63.546 7.07758e-05 -3.54003 63.546000 Cu 0.326001 0.783712 0.5 117 63.546 1.91069e-05 -3.54 63.546000 Cu 0.21048 0.803023 0.5 133 63.546 7.78032e-05 -3.54006 63.546000 Cu 0.306607 0.807844 1 134 63.546 9.2138e-05 -3.53991 63.546000 Cu 0.422032 0.788505 2.00992e-17 115 63.546 0.000114278 -3.53993 63.546000 Cu 0.441579 0.764415 0.5 116 63.546 4.9771e-05 -3.53982 63.546000 Cu 0.537679 0.769258 1.73753e-16 118 63.546 1.5047e-05 -3.53992 63.546000 Cu 0.518103 0.793324 0.5 121 63.546 0.000165292 -3.5401 63.546000 Cu 0.61433 0.798176 1.36525e-16 119 63.546 1.62417e-05 -3.54021 63.546000 Cu 0.633823 0.774104 0.5 120 63.546 5.60033e-05 -3.54011 63.546000 Cu 0.729977 0.778927 1 122 63.546 7.07758e-05 -3.54003 63.546000 Cu 0.71048 0.803023 0.5 125 63.546 7.78032e-05 -3.54006 63.546000 Cu 0.806607 0.807844 1.34995e-19 123 63.546 9.2138e-05 -3.53991 63.546000 Cu 0.941579 0.764415 0.5 109 63.546 4.9771e-05 -3.53982 63.546000 Cu 0.826001 0.783712 0.5 124 63.546 1.91069e-05 -3.54 63.546000 Cu 0.922032 0.788505 1 126 63.546 0.000114278 -3.53993 63.546000 Cu 0.0949195 0.822246 0.5 131 63.546 3.10676e-05 -3.54001 63.546000 Cu 0.191101 0.827101 2.39991e-19 132 63.546 6.48076e-05 -3.54029 63.546000 Cu 0.075592 0.846307 1 150 63.546 0.000181297 -3.53944 63.546000 Cu 0.171852 0.851164 0.5 153 63.546 6.10293e-05 -3.54034 63.546000 Cu 0.383414 0.836731 5.3998e-19 135 63.546 6.47015e-05 -3.53949 63.546000 Cu 0.28734 0.831943 0.5 137 63.546 0.000123765 -3.5401 63.546000 Cu 0.268175 0.856036 4.64983e-19 154 63.546 0.000313898 -3.54095 63.546000 Cu 0.402667 0.812628 0.5 136 63.546 3.32369e-05 -3.53962 63.546000 Cu 0.498746 0.817415 9.96263e-17 138 63.546 9.70966e-05 -3.53984 63.546000 Cu 0.575592 0.846307 5.76728e-17 139 63.546 0.000181297 -3.53944 63.546000 Cu 0.594919 0.822246 0.5 140 63.546 3.10676e-05 -3.54001 63.546000 Cu 0.479493 0.841508 0.5 141 63.546 0.000133086 -3.53922 63.546000 Cu 0.691101 0.827101 1 142 63.546 6.48076e-05 -3.54029 63.546000 Cu 0.768175 0.856036 5.76728e-17 143 63.546 0.000313898 -3.54095 63.546000 Cu 0.78734 0.831943 0.5 144 63.546 0.000123765 -3.5401 63.546000 Cu 0.671852 0.851164 0.5 145 63.546 6.10293e-05 -3.54034 63.546000 Cu 0.998746 0.817415 2.99989e-20 127 63.546 9.70966e-05 -3.53984 63.546000 Cu 0.902667 0.812628 0.5 129 63.546 3.32369e-05 -3.53962 63.546000 Cu 0.883414 0.836731 5.47179e-17 146 63.546 6.47015e-05 -3.53949 63.546000 Cu 0.979493 0.841508 0.5 148 63.546 0.000133086 -3.53922 63.546000 Cu 0.0562219 0.870387 0.5 151 63.546 0.000862484 -3.53873 63.546000 Cu 0.152452 0.875178 1.75793e-17 152 63.546 0.000539207 -3.53972 63.546000 Cu 0.0369482 0.894565 1 170 63.546 0.00153009 -3.53904 63.546000 Cu 0.132911 0.899187 0.5 172 63.546 0.00367379 -3.53827 63.546000 Cu 0.345407 0.885025 1 155 63.546 0.00216612 -3.54095 63.546000 Cu 0.36437 0.860878 0.5 156 63.546 0.000340416 -3.54039 63.546000 Cu 0.248928 0.88007 0.5 157 63.546 0.000469264 -3.54081 63.546000 Cu 0.22936 0.903976 1 174 63.546 0.00239604 -3.5381 63.546000 Cu 0.460304 0.865652 1.34995e-19 158 63.546 0.000221343 -3.53894 63.546000 Cu 0.536948 0.894565 1.98083e-16 159 63.546 0.00153009 -3.53904 63.546000 Cu 0.556222 0.870387 0.5 160 63.546 0.000862484 -3.53873 63.546000 Cu 0.441335 0.889889 0.5 161 63.546 0.00117321 -3.54011 63.546000 Cu 0.652452 0.875178 5.00981e-18 162 63.546 0.000539207 -3.53972 63.546000 Cu 0.72936 0.903976 5.76728e-17 163 63.546 0.00239604 -3.5381 63.546000 Cu 0.748928 0.88007 0.5 164 63.546 0.000469264 -3.54081 63.546000 Cu 0.632911 0.899187 0.5 165 63.546 0.00367379 -3.53827 63.546000 Cu 0.960304 0.865652 2.99989e-20 147 63.546 0.000221343 -3.53894 63.546000 Cu 0.86437 0.860878 0.5 149 63.546 0.000340416 -3.54039 63.546000 Cu 0.845407 0.885025 8.45068e-17 166 63.546 0.00216612 -3.54095 63.546000 Cu 0.941335 0.889889 0.5 168 63.546 0.00117321 -3.54011 63.546000 Cu 0.113958 0.923289 1 171 63.546 0.0118217 -3.53442 63.546000 Cu 0.0182611 0.918941 0.5 173 63.546 0.00615574 -3.54343 63.546000 Cu 0.0968836 0.947881 0.5 192 63.546 0.0772435 -3.51772 63.546000 Cu 0.188729 0.952256 1.01246e-17 194 63.546 0.0964539 -3.50865 63.546000 Cu 0.000919316 0.943231 1.19995e-19 190 63.546 0.0538552 -3.54628 63.546000 Cu 0.305217 0.932954 5.76728e-17 175 63.546 0.00829436 -3.53911 63.546000 Cu 0.326016 0.909057 0.5 176 63.546 0.00271106 -3.5401 63.546000 Cu 0.209623 0.927904 0.5 177 63.546 0.0203316 -3.53115 63.546000 Cu 0.402738 0.938148 0.5 181 63.546 0.0280164 -3.54724 63.546000 Cu 0.422285 0.914179 8.62618e-17 178 63.546 0.00962201 -3.54403 63.546000 Cu 0.500919 0.943231 3.49787e-17 179 63.546 0.0538552 -3.54628 63.546000 Cu 0.518261 0.918941 0.5 180 63.546 0.00615574 -3.54343 63.546000 Cu 0.596884 0.947881 0.5 185 63.546 0.0772435 -3.51772 63.546000 Cu 0.613958 0.923289 1 182 63.546 0.0118217 -3.53442 63.546000 Cu 0.688729 0.952256 5.76728e-17 183 63.546 0.0964539 -3.50865 63.546000 Cu 0.709623 0.927904 0.5 184 63.546 0.0203316 -3.53115 63.546000 Cu 0.805217 0.932954 1.20355e-16 186 63.546 0.00829436 -3.53911 63.546000 Cu 0.922285 0.914179 2.99989e-19 167 63.546 0.00962201 -3.54403 63.546000 Cu 0.826016 0.909057 0.5 169 63.546 0.00271106 -3.5401 63.546000 Cu 0.902738 0.938148 0.5 188 63.546 0.0280164 -3.54724 63.546000 Cu 0.0801241 0.973489 2.08132e-16 191 63.546 0.704254 -3.43114 63.546000 Cu 0.166265 0.978557 0.5 197 63.546 0.505066 -3.4778 63.546000 Cu 0.26107 0.980328 1.21885e-16 195 63.546 0.60603 -3.50902 63.546000 Cu 0.283213 0.956965 0.5 196 63.546 0.126214 -3.54198 63.546000 Cu 0.382252 0.961276 1.02671e-16 198 63.546 0.0721548 -3.53288 63.546000 Cu 0.367294 0.9839 0.5 201 63.546 3.62525 -3.45082 63.546000 Cu 0.465612 0.988617 5.76728e-17 199 63.546 9.16131 -3.28543 63.546000 Cu 0.485193 0.96664 0.5 200 63.546 0.657409 -3.46546 63.546000 Cu 0.580124 0.973489 5.76728e-17 202 63.546 0.704254 -3.43114 63.546000 Cu 0.783213 0.956965 0.5 189 63.546 0.126214 -3.54198 63.546000 Cu 0.666265 0.978557 0.5 204 63.546 0.505066 -3.4778 63.546000 Cu 0.76107 0.980328 1.72239e-16 206 63.546 0.60603 -3.50902 63.546000 Cu 0.882252 0.961276 7.37522e-17 187 63.546 0.0721548 -3.53288 63.546000 Cu 0.985193 0.96664 0.5 193 63.546 0.657409 -3.46546 63.546000 Cu 0.867294 0.9839 0.5 207 63.546 3.62525 -3.45082 63.546000 Cu 0.965612 0.988617 1.50789e-16 208 63.546 9.16131 -3.28543