Number of particles = 408 A = 1 Angstrom (basic length-scale) H0(1,1) = 15.0149 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 90.5517 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.63373 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 0.125659 0.0148178 0.5 209 63.546 7.6257 -3.01427 63.546000 Cu 0.272656 0.00204424 0.5 210 63.546 9.20523 -2.98987 63.546000 Cu 0.0585957 0.0554632 1.90755e-15 212 63.546 0.071934 -3.2801 63.546000 Cu 0.149336 0.0315915 2.5099e-15 215 63.546 2.8075 -3.18145 63.546000 Cu 0.301592 0.0452488 1.43015e-15 216 63.546 0.479006 -3.22371 63.546000 Cu 0.273093 0.0275618 0.5 217 63.546 9.20273 -2.99079 63.546000 Cu 0.176459 0.0502419 0.5 218 63.546 0.0984591 -3.2886 63.546000 Cu 0.00533014 0.0148443 1.19205e-15 206 63.546 2.93269 -3.2719 63.546000 Cu 0.0239738 0.0355305 0.5 213 63.546 0.827326 -3.22685 63.546000 Cu 0.383703 0.0148123 3.56613e-16 219 63.546 7.3541 -3.14775 63.546000 Cu 0.523974 0.0355305 1.7913e-15 220 63.546 0.827326 -3.22685 63.546000 Cu 0.50533 0.0148443 0.5 221 63.546 2.93269 -3.2719 63.546000 Cu 0.416382 0.0393186 0.5 222 63.546 0.491752 -3.1789 63.546000 Cu 0.625659 0.0148178 1.66957e-15 223 63.546 7.6257 -3.01427 63.546000 Cu 0.649336 0.0315915 0.5 226 63.546 2.8075 -3.18145 63.546000 Cu 0.558596 0.0554632 0.5 239 63.546 0.071934 -3.2801 63.546000 Cu 0.676459 0.0502419 1.90779e-15 241 63.546 0.0984591 -3.2886 63.546000 Cu 0.772656 0.00204424 3.55659e-16 205 63.546 9.20523 -2.98987 63.546000 Cu 0.883703 0.0148123 0.5 207 63.546 7.3541 -3.14775 63.546000 Cu 0.916382 0.0393186 1.31355e-15 211 63.546 0.491752 -3.1789 63.546000 Cu 0.773093 0.0275618 9.56936e-16 224 63.546 9.20273 -2.99079 63.546000 Cu 0.801592 0.0452488 0.5 243 63.546 0.479006 -3.22371 63.546000 Cu 0.119804 0.0940861 2.38661e-15 230 63.546 0.00264611 -3.28298 63.546000 Cu 0.0902151 0.0748106 0.5 231 63.546 0.00692144 -3.27939 63.546000 Cu 0.208316 0.0695326 2.02869e-15 233 63.546 0.0173419 -3.28566 63.546000 Cu 0.326702 0.0644328 0.5 235 63.546 0.0414246 -3.28751 63.546000 Cu 0.23763 0.0891082 0.5 236 63.546 0.00460734 -3.2832 63.546000 Cu 0.266146 0.108702 2.38542e-15 251 63.546 0.000347659 -3.28249 63.546000 Cu 0.00134877 0.0990742 0.5 232 63.546 0.00139445 -3.28233 63.546000 Cu 0.35452 0.0843035 2.14768e-15 234 63.546 0.00389647 -3.28193 63.546000 Cu 0.443786 0.0601706 1.78951e-15 237 63.546 0.0563161 -3.28436 63.546000 Cu 0.590215 0.0748106 2.14696e-15 238 63.546 0.00692144 -3.27939 63.546000 Cu 0.47208 0.079788 0.5 240 63.546 0.0174432 -3.2812 63.546000 Cu 0.383524 0.103948 0.5 253 63.546 0.00227325 -3.28194 63.546000 Cu 0.501349 0.0990742 2.5062e-15 255 63.546 0.00139445 -3.28233 63.546000 Cu 0.619804 0.0940861 0.5 257 63.546 0.00264611 -3.28298 63.546000 Cu 0.943786 0.0601706 0.5 214 63.546 0.0563161 -3.28436 63.546000 Cu 0.883524 0.103948 2.50692e-15 227 63.546 0.00227325 -3.28194 63.546000 Cu 0.85452 0.0843035 0.5 228 63.546 0.00389647 -3.28193 63.546000 Cu 0.97208 0.079788 2.26726e-15 229 63.546 0.0174432 -3.2812 63.546000 Cu 0.826702 0.0644328 2.14875e-15 242 63.546 0.0414246 -3.28751 63.546000 Cu 0.708316 0.0695326 0.5 244 63.546 0.0173419 -3.28566 63.546000 Cu 0.73763 0.0891082 2.26691e-15 259 63.546 0.00460734 -3.2832 63.546000 Cu 0.766146 0.108702 0.5 260 63.546 0.000347659 -3.28249 63.546000 Cu 0.177225 0.133051 2.14457e-15 248 63.546 0.000118443 -3.2831 63.546000 Cu 0.148555 0.113537 0.5 249 63.546 0.000918746 -3.28368 63.546000 Cu 0.0594516 0.137921 0.5 250 63.546 0.000148143 -3.28334 63.546000 Cu 0.294827 0.128235 0.5 254 63.546 0.000259418 -3.2826 63.546000 Cu 0.0883076 0.157403 2.26619e-15 265 63.546 4.46999e-05 -3.28312 63.546000 Cu 0.206069 0.152552 0.5 267 63.546 1.49564e-05 -3.28291 63.546000 Cu 0.323789 0.147716 2.26691e-15 269 63.546 0.000145372 -3.28284 63.546000 Cu 0.0305813 0.118458 2.62591e-15 247 63.546 0.000278189 -3.28357 63.546000 Cu 0.412641 0.123399 2.50489e-15 252 63.546 0.000494176 -3.28262 63.546000 Cu 0.648555 0.113537 2.62674e-15 256 63.546 0.000918746 -3.28368 63.546000 Cu 0.530581 0.118458 0.5 258 63.546 0.000278189 -3.28357 63.546000 Cu 0.470503 0.162281 2.50859e-15 270 63.546 2.65171e-05 -3.28313 63.546000 Cu 0.441584 0.142826 0.5 271 63.546 2.71675e-05 -3.2831 63.546000 Cu 0.559452 0.137921 2.38554e-15 273 63.546 0.000148143 -3.28334 63.546000 Cu 0.588308 0.157403 0.5 276 63.546 4.46999e-05 -3.28312 63.546000 Cu 0.677225 0.133051 0.5 275 63.546 0.000118443 -3.2831 63.546000 Cu 0.941584 0.142826 2.62698e-15 245 63.546 2.71675e-05 -3.2831 63.546000 Cu 0.912641 0.123399 0.5 246 63.546 0.000494176 -3.28262 63.546000 Cu 0.970503 0.162281 0.5 263 63.546 2.65171e-05 -3.28313 63.546000 Cu 0.706069 0.152552 2.26607e-15 274 63.546 1.49564e-05 -3.28291 63.546000 Cu 0.794827 0.128235 2.38649e-15 277 63.546 0.000259418 -3.2826 63.546000 Cu 0.823789 0.147716 0.5 278 63.546 0.000145372 -3.28284 63.546000 Cu 0.234962 0.172035 2.5099e-15 266 63.546 1.42426e-05 -3.28292 63.546000 Cu 0.11724 0.176888 0.5 268 63.546 1.07917e-05 -3.28303 63.546000 Cu 0.0575015 0.220726 1.78689e-15 280 63.546 2.74491e-05 -3.28303 63.546000 Cu 0.146185 0.196377 2.02845e-15 283 63.546 1.20898e-05 -3.28303 63.546000 Cu 0.293004 0.210995 1.90922e-15 284 63.546 6.97241e-06 -3.2831 63.546000 Cu 0.263886 0.191516 0.5 285 63.546 4.84399e-05 -3.28301 63.546000 Cu 0.175236 0.21586 0.5 286 63.546 1.10559e-05 -3.28304 63.546000 Cu 0.0284781 0.201241 0.5 281 63.546 9.3504e-06 -3.28314 63.546000 Cu 0.352706 0.167177 0.5 272 63.546 5.48491e-05 -3.28296 63.546000 Cu 0.381656 0.186636 2.02916e-15 287 63.546 2.93634e-05 -3.28313 63.546000 Cu 0.528478 0.201241 1.66861e-15 288 63.546 9.3504e-06 -3.28314 63.546000 Cu 0.499484 0.181749 0.5 289 63.546 5.50967e-05 -3.28316 63.546000 Cu 0.410739 0.206116 0.5 290 63.546 7.21669e-06 -3.28318 63.546000 Cu 0.61724 0.176888 1.90576e-15 291 63.546 1.07917e-05 -3.28303 63.546000 Cu 0.646185 0.196377 0.5 294 63.546 1.20898e-05 -3.28303 63.546000 Cu 0.557502 0.220726 0.5 307 63.546 2.74491e-05 -3.28303 63.546000 Cu 0.675236 0.21586 1.90719e-15 309 63.546 1.10559e-05 -3.28304 63.546000 Cu 0.852706 0.167177 2.26452e-15 261 63.546 5.48491e-05 -3.28296 63.546000 Cu 0.999484 0.181749 2.62805e-15 262 63.546 5.50967e-05 -3.28316 63.546000 Cu 0.881656 0.186636 0.5 264 63.546 2.93634e-05 -3.28313 63.546000 Cu 0.910739 0.206116 2.02606e-15 279 63.546 7.21669e-06 -3.28318 63.546000 Cu 0.763886 0.191516 2.26595e-15 292 63.546 4.84399e-05 -3.28301 63.546000 Cu 0.734962 0.172035 0.5 293 63.546 1.42426e-05 -3.28292 63.546000 Cu 0.793004 0.210995 0.5 311 63.546 6.97241e-06 -3.2831 63.546000 Cu 0.116021 0.259709 1.90982e-15 298 63.546 1.56875e-05 -3.28316 63.546000 Cu 0.0867003 0.240215 0.5 299 63.546 2.21718e-05 -3.28308 63.546000 Cu 0.204382 0.235345 2.14947e-15 301 63.546 2.7324e-05 -3.28301 63.546000 Cu 0.3221 0.230484 0.5 303 63.546 1.83445e-05 -3.28306 63.546000 Cu 0.233644 0.254838 0.5 304 63.546 2.7723e-05 -3.2831 63.546000 Cu 0.262994 0.274353 1.66957e-15 319 63.546 2.19415e-05 -3.28317 63.546000 Cu 0.351257 0.249976 1.66897e-15 302 63.546 7.83936e-05 -3.28313 63.546000 Cu 0.439797 0.225606 1.79094e-15 305 63.546 1.23755e-05 -3.28308 63.546000 Cu 0.5867 0.240215 1.90898e-15 306 63.546 2.21718e-05 -3.28308 63.546000 Cu 0.468954 0.245092 0.5 308 63.546 6.03582e-05 -3.28316 63.546000 Cu 0.380694 0.269474 0.5 321 63.546 9.7971e-06 -3.2832 63.546000 Cu 0.498346 0.264587 1.42908e-15 323 63.546 9.95802e-06 -3.28317 63.546000 Cu 0.616021 0.259709 0.5 325 63.546 1.56875e-05 -3.28316 63.546000 Cu 0.939797 0.225606 0.5 282 63.546 1.23755e-05 -3.28308 63.546000 Cu 0.880694 0.269474 1.66885e-15 295 63.546 9.7971e-06 -3.2832 63.546000 Cu 0.851257 0.249976 0.5 296 63.546 7.83936e-05 -3.28313 63.546000 Cu 0.968954 0.245092 1.42717e-15 297 63.546 6.03582e-05 -3.28316 63.546000 Cu 0.998346 0.264587 0.5 300 63.546 9.95802e-06 -3.28317 63.546000 Cu 0.8221 0.230484 2.02749e-15 310 63.546 1.83445e-05 -3.28306 63.546000 Cu 0.704382 0.235345 0.5 312 63.546 2.7324e-05 -3.28301 63.546000 Cu 0.733644 0.254838 1.78689e-15 327 63.546 2.7723e-05 -3.2831 63.546000 Cu 0.762994 0.274353 0.5 328 63.546 2.19415e-05 -3.28317 63.546000 Cu 0.174721 0.298728 1.43063e-15 316 63.546 1.09528e-05 -3.28307 63.546000 Cu 0.145359 0.279216 0.5 317 63.546 6.10003e-06 -3.28316 63.546000 Cu 0.0569963 0.303597 0.5 318 63.546 2.33507e-05 -3.28312 63.546000 Cu 0.292329 0.293853 0.5 322 63.546 2.26434e-05 -3.28306 63.546000 Cu 0.0864055 0.323106 1.55213e-15 333 63.546 3.60163e-06 -3.28313 63.546000 Cu 0.204075 0.318231 0.5 335 63.546 6.6413e-06 -3.28309 63.546000 Cu 0.321701 0.313348 1.19002e-15 337 63.546 1.05821e-05 -3.28316 63.546000 Cu 0.0277031 0.284091 1.30794e-15 315 63.546 6.32587e-06 -3.28307 63.546000 Cu 0.410095 0.288966 1.55117e-15 320 63.546 3.93384e-05 -3.28307 63.546000 Cu 0.645359 0.279216 1.42729e-15 324 63.546 6.10003e-06 -3.28316 63.546000 Cu 0.527703 0.284091 0.5 326 63.546 6.32587e-06 -3.28307 63.546000 Cu 0.46878 0.32798 9.48701e-16 338 63.546 2.57837e-05 -3.28315 63.546000 Cu 0.439378 0.308468 0.5 339 63.546 1.71015e-05 -3.28314 63.546000 Cu 0.556996 0.303597 1.43075e-15 341 63.546 2.33507e-05 -3.28312 63.546000 Cu 0.586406 0.323106 0.5 344 63.546 3.60163e-06 -3.28313 63.546000 Cu 0.351057 0.332859 0.5 340 63.546 4.12088e-06 -3.28315 63.546000 Cu 0.674721 0.298728 0.5 343 63.546 1.09528e-05 -3.28307 63.546000 Cu 0.939378 0.308468 1.67016e-15 313 63.546 1.71015e-05 -3.28314 63.546000 Cu 0.910095 0.288966 0.5 314 63.546 3.93384e-05 -3.28307 63.546000 Cu 0.96878 0.32798 0.5 331 63.546 2.57837e-05 -3.28315 63.546000 Cu 0.704075 0.318231 1.18871e-15 342 63.546 6.6413e-06 -3.28309 63.546000 Cu 0.792329 0.293853 1.66825e-15 345 63.546 2.26434e-05 -3.28306 63.546000 Cu 0.821701 0.313348 0.5 346 63.546 1.05821e-05 -3.28316 63.546000 Cu 0.851057 0.332859 1.55141e-15 329 63.546 4.12088e-06 -3.28315 63.546000 Cu 0.233382 0.337736 9.4894e-16 334 63.546 4.74583e-06 -3.28305 63.546000 Cu 0.115759 0.342616 0.5 336 63.546 2.28788e-05 -3.28307 63.546000 Cu 0.056718 0.386496 1.07139e-15 348 63.546 4.97124e-05 -3.28318 63.546000 Cu 0.144994 0.362111 1.31224e-15 351 63.546 2.66193e-05 -3.28307 63.546000 Cu 0.292053 0.376754 1.31164e-15 352 63.546 2.54163e-05 -3.28296 63.546000 Cu 0.262729 0.357241 0.5 353 63.546 1.62393e-05 -3.28299 63.546000 Cu 0.174392 0.381604 0.5 354 63.546 8.99754e-05 -3.28294 63.546000 Cu 0.0272879 0.366998 0.5 349 63.546 5.03581e-05 -3.28324 63.546000 Cu 0.380349 0.352367 1.4317e-15 355 63.546 1.40861e-05 -3.28308 63.546000 Cu 0.527288 0.366998 1.19026e-15 356 63.546 5.03581e-05 -3.28324 63.546000 Cu 0.49806 0.347483 0.5 357 63.546 1.71611e-05 -3.28314 63.546000 Cu 0.409655 0.371891 0.5 358 63.546 4.10782e-05 -3.28314 63.546000 Cu 0.615759 0.342616 1.3108e-15 359 63.546 2.28788e-05 -3.28307 63.546000 Cu 0.644994 0.362111 0.5 362 63.546 2.66193e-05 -3.28307 63.546000 Cu 0.556718 0.386496 0.5 375 63.546 4.97124e-05 -3.28318 63.546000 Cu 0.674392 0.381604 1.19038e-15 377 63.546 8.99754e-05 -3.28294 63.546000 Cu 0.99806 0.347483 1.19086e-15 330 63.546 1.71611e-05 -3.28314 63.546000 Cu 0.880349 0.352367 0.5 332 63.546 1.40861e-05 -3.28308 63.546000 Cu 0.909655 0.371891 1.1905e-15 347 63.546 4.10782e-05 -3.28314 63.546000 Cu 0.762729 0.357241 1.43159e-15 360 63.546 1.62393e-05 -3.28299 63.546000 Cu 0.733382 0.337736 0.5 361 63.546 4.74583e-06 -3.28305 63.546000 Cu 0.792053 0.376754 0.5 379 63.546 2.54163e-05 -3.28296 63.546000 Cu 0.115912 0.425467 1.07032e-15 366 63.546 0.00248158 -3.28186 63.546000 Cu 0.0862029 0.405965 0.5 367 63.546 0.000562353 -3.28264 63.546000 Cu 0.203846 0.401118 1.19169e-15 369 63.546 0.000250791 -3.2827 63.546000 Cu 0.321383 0.396286 0.5 371 63.546 6.71131e-05 -3.28319 63.546000 Cu 0.232995 0.420691 0.5 372 63.546 0.000491838 -3.28259 63.546000 Cu 0.262012 0.44033 1.0696e-15 387 63.546 0.00479804 -3.28316 63.546000 Cu 0.350595 0.415846 1.06972e-15 370 63.546 0.000895149 -3.28389 63.546000 Cu 0.438935 0.391414 1.1905e-15 373 63.546 0.000216628 -3.28338 63.546000 Cu 0.586203 0.405965 1.06984e-15 374 63.546 0.000562353 -3.28264 63.546000 Cu 0.46843 0.410922 0.5 376 63.546 0.000351196 -3.2836 63.546000 Cu 0.379772 0.435329 0.5 389 63.546 0.0024717 -3.28314 63.546000 Cu 0.498213 0.430336 1.19014e-15 391 63.546 0.00175931 -3.28244 63.546000 Cu 0.615912 0.425467 0.5 393 63.546 0.00248158 -3.28186 63.546000 Cu 0.938935 0.391414 0.5 350 63.546 0.000216628 -3.28338 63.546000 Cu 0.879772 0.435329 1.3114e-15 363 63.546 0.0024717 -3.28314 63.546000 Cu 0.850595 0.415846 0.5 364 63.546 0.000895149 -3.28389 63.546000 Cu 0.96843 0.410922 1.4329e-15 365 63.546 0.000351196 -3.2836 63.546000 Cu 0.998213 0.430336 0.5 368 63.546 0.00175931 -3.28244 63.546000 Cu 0.821383 0.396286 1.3114e-15 378 63.546 6.71131e-05 -3.28319 63.546000 Cu 0.703846 0.401118 0.5 380 63.546 0.000250791 -3.2827 63.546000 Cu 0.732995 0.420691 1.31152e-15 395 63.546 0.000491838 -3.28259 63.546000 Cu 0.762012 0.44033 0.5 396 63.546 0.00479804 -3.28316 63.546000 Cu 0.173406 0.465069 1.4317e-15 384 63.546 0.0438422 -3.28738 63.546000 Cu 0.145281 0.445171 0.5 385 63.546 0.00474854 -3.28175 63.546000 Cu 0.0563057 0.469336 0.5 386 63.546 0.0558099 -3.28416 63.546000 Cu 0.291758 0.459939 0.5 390 63.546 0.0174254 -3.28559 63.546000 Cu 0.0839306 0.490223 9.54788e-16 399 63.546 0.495658 -3.17859 63.546000 Cu 0.198719 0.48425 0.5 400 63.546 0.479236 -3.22375 63.546000 Cu 0.323948 0.479263 1.3114e-15 401 63.546 0.105866 -3.28821 63.546000 Cu 0.0277976 0.449671 1.18979e-15 383 63.546 0.017567 -3.28156 63.546000 Cu 0.409714 0.454638 1.4317e-15 388 63.546 0.00779939 -3.27968 63.546000 Cu 0.645281 0.445171 1.55237e-15 392 63.546 0.00474854 -3.28175 63.546000 Cu 0.527798 0.449671 0.5 394 63.546 0.017567 -3.28156 63.546000 Cu 0.476488 0.494006 1.19301e-15 402 63.546 0.833759 -3.22618 63.546000 Cu 0.441654 0.474029 0.5 403 63.546 0.0738689 -3.27986 63.546000 Cu 0.556306 0.469336 1.19217e-15 405 63.546 0.0558099 -3.28416 63.546000 Cu 0.583931 0.490223 0.5 408 63.546 0.495658 -3.17859 63.546000 Cu 0.351172 0.49792 0.5 404 63.546 2.79379 -3.18156 63.546000 Cu 0.673406 0.465069 0.5 407 63.546 0.0438422 -3.28738 63.546000 Cu 0.823948 0.479263 0.5 1 63.546 0.105866 -3.28821 63.546000 Cu 0.791758 0.459939 1.19098e-15 8 63.546 0.0174254 -3.28559 63.546000 Cu 0.941654 0.474029 1.31104e-15 381 63.546 0.0738689 -3.27986 63.546000 Cu 0.909714 0.454638 0.5 382 63.546 0.00779939 -3.27968 63.546000 Cu 0.976488 0.494006 0.5 398 63.546 0.833759 -3.22618 63.546000 Cu 0.698719 0.48425 9.52879e-16 406 63.546 0.479236 -3.22375 63.546000 Cu 0.851172 0.49792 1.42991e-15 397 63.546 2.79379 -3.18156 63.546000 Cu 0.116715 0.514703 0.5 5 63.546 7.35433 -3.14798 63.546000 Cu 0.227396 0.501933 5.96385e-16 6 63.546 9.22083 -2.99073 63.546000 Cu 0.227777 0.527455 4.76678e-16 7 63.546 9.1836 -2.98975 63.546000 Cu 0.0844313 0.539183 7.15017e-16 21 63.546 0.4938 -3.17935 63.546000 Cu 0.19933 0.545132 0.5 24 63.546 0.476548 -3.22285 63.546000 Cu 0.324489 0.550141 1.07342e-15 25 63.546 0.0974615 -3.28853 63.546000 Cu 0.374781 0.514707 1.43266e-15 9 63.546 7.62783 -3.01465 63.546000 Cu 0.476856 0.535408 1.07306e-15 10 63.546 0.830258 -3.22819 63.546000 Cu 0.495101 0.514712 0.5 11 63.546 2.92856 -3.27182 63.546000 Cu 0.351561 0.53151 0.5 12 63.546 2.78633 -3.18165 63.546000 Cu 0.616715 0.514703 2.36907e-16 13 63.546 7.35433 -3.14798 63.546000 Cu 0.584431 0.539183 0.5 16 63.546 0.4938 -3.17935 63.546000 Cu 0.442431 0.55536 0.5 27 63.546 0.0748839 -3.28013 63.546000 Cu 0.995101 0.514712 1.07294e-15 3 63.546 2.92856 -3.27182 63.546000 Cu 0.976856 0.535408 0.5 19 63.546 0.830258 -3.22819 63.546000 Cu 0.727396 0.501933 0.5 2 63.546 9.22083 -2.99073 63.546000 Cu 0.874781 0.514707 0.5 4 63.546 7.62783 -3.01465 63.546000 Cu 0.69933 0.545132 1.07426e-15 14 63.546 0.476548 -3.22285 63.546000 Cu 0.727777 0.527455 0.5 15 63.546 9.1836 -2.98975 63.546000 Cu 0.851561 0.53151 1.6704e-15 17 63.546 2.78633 -3.18165 63.546000 Cu 0.942431 0.55536 1.19217e-15 18 63.546 0.0748839 -3.28013 63.546000 Cu 0.824489 0.550141 0.5 20 63.546 0.0974615 -3.28853 63.546000 Cu 0.0572051 0.560048 0.5 22 63.546 0.0557109 -3.28411 63.546000 Cu 0.174305 0.564313 9.53953e-16 23 63.546 0.0425168 -3.28741 63.546000 Cu 0.292741 0.569421 0.5 28 63.546 0.017426 -3.28566 63.546000 Cu 0.0290498 0.579677 1.07461e-15 37 63.546 0.0174289 -3.28114 63.546000 Cu 0.117663 0.603842 4.75485e-16 38 63.546 0.00240612 -3.28197 63.546000 Cu 0.146603 0.584191 0.5 40 63.546 0.00394619 -3.28188 63.546000 Cu 0.263501 0.588991 8.35798e-16 41 63.546 0.00497762 -3.28322 63.546000 Cu 0.23498 0.608588 0.5 44 63.546 0.000435889 -3.28252 63.546000 Cu 0.410948 0.574709 8.33649e-16 26 63.546 0.00701633 -3.27934 63.546000 Cu 0.557205 0.560048 9.54072e-16 29 63.546 0.0557109 -3.28411 63.546000 Cu 0.52905 0.579677 0.5 32 63.546 0.0174289 -3.28114 63.546000 Cu 0.381403 0.593983 0.5 43 63.546 0.0022568 -3.28296 63.546000 Cu 0.499792 0.598973 9.55504e-16 45 63.546 0.0014243 -3.28235 63.546000 Cu 0.617663 0.603842 0.5 47 63.546 0.00240612 -3.28197 63.546000 Cu 0.646603 0.584191 1.07461e-15 30 63.546 0.00394619 -3.28188 63.546000 Cu 0.999792 0.598973 0.5 39 63.546 0.0014243 -3.28235 63.546000 Cu 0.674305 0.564313 0.5 31 63.546 0.0425168 -3.28741 63.546000 Cu 0.792741 0.569421 1.07318e-15 33 63.546 0.017426 -3.28566 63.546000 Cu 0.881403 0.593983 7.13465e-16 34 63.546 0.0022568 -3.28296 63.546000 Cu 0.910948 0.574709 0.5 35 63.546 0.00701633 -3.27934 63.546000 Cu 0.763501 0.588991 0.5 36 63.546 0.00497762 -3.28322 63.546000 Cu 0.73498 0.608588 8.34724e-16 49 63.546 0.000435889 -3.28252 63.546000 Cu 0.0593853 0.642728 1 54 63.546 8.48596e-05 -3.28305 63.546000 Cu 0.0884755 0.623301 0.5 55 63.546 0.000557825 -3.28264 63.546000 Cu 0.206219 0.628132 1.1899e-16 57 63.546 0.000260773 -3.28258 63.546000 Cu 0.294787 0.652468 1 58 63.546 3.15109e-05 -3.28299 63.546000 Cu 0.177116 0.64762 0.5 60 63.546 0.000129817 -3.28284 63.546000 Cu 0.0301995 0.662198 0.5 71 63.546 5.48737e-05 -3.28322 63.546000 Cu 0.323792 0.632953 0.5 59 63.546 0.0001236 -3.28308 63.546000 Cu 0.352611 0.613436 5.72276e-16 42 63.546 0.000829421 -3.2837 63.546000 Cu 0.588476 0.623301 7.17285e-16 46 63.546 0.000557825 -3.28264 63.546000 Cu 0.470501 0.618367 0.5 48 63.546 0.000200642 -3.28356 63.546000 Cu 0.441489 0.637827 2.52661e-16 61 63.546 0.000179212 -3.28329 63.546000 Cu 0.5302 0.662198 1 62 63.546 5.48737e-05 -3.28322 63.546000 Cu 0.559385 0.642728 0.5 63 63.546 8.48596e-05 -3.28305 63.546000 Cu 0.412475 0.657314 0.5 64 63.546 9.88629e-05 -3.28322 63.546000 Cu 0.970501 0.618367 3.5721e-16 53 63.546 0.000200642 -3.28356 63.546000 Cu 0.823792 0.632953 2.58151e-16 50 63.546 0.0001236 -3.28308 63.546000 Cu 0.852611 0.613436 0.5 51 63.546 0.000829421 -3.2837 63.546000 Cu 0.706219 0.628132 0.5 52 63.546 0.000260773 -3.28258 63.546000 Cu 0.941489 0.637827 0.5 56 63.546 0.000179212 -3.28329 63.546000 Cu 0.677116 0.64762 1.32238e-16 65 63.546 0.000129817 -3.28284 63.546000 Cu 0.794787 0.652468 0.5 67 63.546 3.15109e-05 -3.28299 63.546000 Cu 0.912475 0.657314 1 69 63.546 9.88629e-05 -3.28322 63.546000 Cu 0.147873 0.667094 1 74 63.546 2.23481e-05 -3.28307 63.546000 Cu 0.000961149 0.681699 1 70 63.546 1.90657e-05 -3.28324 63.546000 Cu 0.118702 0.686576 0.5 73 63.546 1.79881e-05 -3.28316 63.546000 Cu 0.236407 0.691458 1 75 63.546 6.4605e-06 -3.28302 63.546000 Cu 0.265652 0.671965 0.5 76 63.546 4.2058e-05 -3.28303 63.546000 Cu 0.0895095 0.706086 1 89 63.546 1.47833e-05 -3.28312 63.546000 Cu 0.207161 0.710963 0.5 92 63.546 5.72683e-06 -3.28311 63.546000 Cu 0.324869 0.715834 1 93 63.546 2.1827e-05 -3.28311 63.546000 Cu 0.647873 0.667094 0.5 68 63.546 2.23481e-05 -3.28307 63.546000 Cu 0.383285 0.67683 1 77 63.546 5.86594e-06 -3.28314 63.546000 Cu 0.471831 0.701207 1 78 63.546 2.36783e-05 -3.28311 63.546000 Cu 0.500961 0.681699 0.5 79 63.546 1.90657e-05 -3.28324 63.546000 Cu 0.354057 0.696337 0.5 80 63.546 1.45073e-05 -3.28303 63.546000 Cu 0.618702 0.686576 1 81 63.546 1.79881e-05 -3.28316 63.546000 Cu 0.58951 0.706086 0.5 84 63.546 1.47833e-05 -3.28312 63.546000 Cu 0.442581 0.720709 0.5 95 63.546 4.39937e-05 -3.28308 63.546000 Cu 0.971831 0.701207 0.5 87 63.546 2.36783e-05 -3.28311 63.546000 Cu 0.765652 0.671965 1 66 63.546 4.2058e-05 -3.28303 63.546000 Cu 0.883285 0.67683 0.5 72 63.546 5.86594e-06 -3.28314 63.546000 Cu 0.707161 0.710963 1 82 63.546 5.72683e-06 -3.28311 63.546000 Cu 0.736407 0.691458 0.5 83 63.546 6.4605e-06 -3.28302 63.546000 Cu 0.854057 0.696337 1 85 63.546 1.45073e-05 -3.28303 63.546000 Cu 0.942581 0.720709 1 86 63.546 4.39937e-05 -3.28308 63.546000 Cu 0.824869 0.715834 0.5 88 63.546 2.1827e-05 -3.28311 63.546000 Cu 0.0601826 0.725596 0.5 90 63.546 7.45661e-06 -3.28309 63.546000 Cu 0.177896 0.730474 1 91 63.546 7.99218e-06 -3.28314 63.546000 Cu 0.295553 0.735347 0.5 96 63.546 7.9226e-06 -3.28311 63.546000 Cu 0.0308765 0.745106 1 105 63.546 4.59018e-06 -3.28315 63.546000 Cu 0.119214 0.769514 1 106 63.546 6.0418e-06 -3.28315 63.546000 Cu 0.00157797 0.764627 0.5 107 63.546 1.05586e-05 -3.2831 63.546000 Cu 0.14855 0.749989 0.5 108 63.546 4.35917e-06 -3.28313 63.546000 Cu 0.266196 0.754867 1 109 63.546 9.34174e-06 -3.28306 63.546000 Cu 0.236945 0.774395 0.5 112 63.546 2.79109e-05 -3.28315 63.546000 Cu 0.413173 0.740229 1 94 63.546 1.00928e-05 -3.28315 63.546000 Cu 0.560183 0.725596 1 97 63.546 7.45661e-06 -3.28309 63.546000 Cu 0.530877 0.745106 0.5 100 63.546 4.59018e-06 -3.28315 63.546000 Cu 0.383858 0.759747 0.5 111 63.546 6.18275e-06 -3.28308 63.546000 Cu 0.501578 0.764627 1 113 63.546 1.05586e-05 -3.2831 63.546000 Cu 0.619214 0.769514 0.5 115 63.546 6.0418e-06 -3.28315 63.546000 Cu 0.64855 0.749989 1 98 63.546 4.35917e-06 -3.28313 63.546000 Cu 0.677896 0.730474 0.5 99 63.546 7.99218e-06 -3.28314 63.546000 Cu 0.795553 0.735347 1 101 63.546 7.9226e-06 -3.28311 63.546000 Cu 0.883858 0.759747 1 102 63.546 6.18275e-06 -3.28308 63.546000 Cu 0.913173 0.740229 0.5 103 63.546 1.00928e-05 -3.28315 63.546000 Cu 0.766196 0.754867 0.5 104 63.546 9.34174e-06 -3.28306 63.546000 Cu 0.736945 0.774395 1 117 63.546 2.79109e-05 -3.28315 63.546000 Cu 0.0604621 0.808558 1 122 63.546 6.28184e-06 -3.28316 63.546000 Cu 0.0898578 0.789037 0.5 123 63.546 3.74562e-06 -3.28312 63.546000 Cu 0.207565 0.793923 1 125 63.546 2.30568e-05 -3.28313 63.546000 Cu 0.295718 0.818331 1 126 63.546 8.53387e-06 -3.28306 63.546000 Cu 0.178102 0.813443 0.5 128 63.546 3.0362e-06 -3.28309 63.546000 Cu 0.0310188 0.828086 0.5 139 63.546 4.47247e-06 -3.28316 63.546000 Cu 0.148704 0.832968 1.01088e-16 142 63.546 6.40921e-06 -3.28307 63.546000 Cu 0.32516 0.798808 0.5 127 63.546 1.28675e-05 -3.28312 63.546000 Cu 0.35457 0.779271 1 110 63.546 1.51623e-05 -3.2831 63.546000 Cu 0.589858 0.789037 1 114 63.546 3.74562e-06 -3.28312 63.546000 Cu 0.472222 0.78415 0.5 116 63.546 1.1546e-05 -3.28309 63.546000 Cu 0.442811 0.803678 1 129 63.546 4.31091e-06 -3.28318 63.546000 Cu 0.531019 0.828086 1 130 63.546 4.47247e-06 -3.28316 63.546000 Cu 0.560462 0.808558 0.5 131 63.546 6.28184e-06 -3.28316 63.546000 Cu 0.413355 0.823213 0.5 132 63.546 1.4887e-05 -3.28315 63.546000 Cu 0.648704 0.832968 0.5 136 63.546 6.40921e-06 -3.28307 63.546000 Cu 0.972222 0.78415 1 121 63.546 1.1546e-05 -3.28309 63.546000 Cu 0.82516 0.798808 1 118 63.546 1.28675e-05 -3.28312 63.546000 Cu 0.85457 0.779271 0.5 119 63.546 1.51623e-05 -3.2831 63.546000 Cu 0.707565 0.793923 0.5 120 63.546 2.30568e-05 -3.28313 63.546000 Cu 0.942811 0.803678 0.5 124 63.546 4.31091e-06 -3.28318 63.546000 Cu 0.678102 0.813443 1 133 63.546 3.0362e-06 -3.28309 63.546000 Cu 0.795718 0.818331 0.5 135 63.546 8.53387e-06 -3.28306 63.546000 Cu 0.913355 0.823213 1 137 63.546 1.4887e-05 -3.28315 63.546000 Cu 0.00163896 0.847611 0 138 63.546 6.90866e-06 -3.28316 63.546000 Cu 0.119273 0.852489 0.5 141 63.546 8.3324e-06 -3.28312 63.546000 Cu 0.236916 0.857358 2.51825e-16 143 63.546 2.72384e-05 -3.28302 63.546000 Cu 0.266344 0.837847 0.5 144 63.546 5.81802e-06 -3.28297 63.546000 Cu 0.0898723 0.872028 4.80736e-16 157 63.546 5.16048e-05 -3.28318 63.546000 Cu 0.207471 0.87689 0.5 160 63.546 1.8926e-05 -3.28299 63.546000 Cu 0.325035 0.881747 5.46139e-16 161 63.546 9.90596e-05 -3.28297 63.546000 Cu 0.383962 0.842732 1.3367e-16 145 63.546 9.95679e-06 -3.28305 63.546000 Cu 0.472244 0.867137 4.5436e-16 146 63.546 4.01545e-05 -3.28325 63.546000 Cu 0.501639 0.847611 0.5 147 63.546 6.90866e-06 -3.28316 63.546000 Cu 0.354563 0.862236 0.5 148 63.546 2.42734e-05 -3.28309 63.546000 Cu 0.619273 0.852489 3.74635e-16 149 63.546 8.3324e-06 -3.28312 63.546000 Cu 0.589872 0.872028 0.5 152 63.546 5.16048e-05 -3.28318 63.546000 Cu 0.442745 0.886635 0.5 163 63.546 3.57197e-05 -3.28321 63.546000 Cu 0.972244 0.867137 0.5 155 63.546 4.01545e-05 -3.28325 63.546000 Cu 0.766344 0.837847 1.76636e-17 134 63.546 5.81802e-06 -3.28297 63.546000 Cu 0.883962 0.842732 0.5 140 63.546 9.95679e-06 -3.28305 63.546000 Cu 0.707471 0.87689 8.28875e-16 150 63.546 1.8926e-05 -3.28299 63.546000 Cu 0.736916 0.857358 0.5 151 63.546 2.72384e-05 -3.28302 63.546000 Cu 0.854563 0.862236 2.94075e-16 153 63.546 2.42734e-05 -3.28309 63.546000 Cu 0.942745 0.886635 8.3902e-16 154 63.546 3.57197e-05 -3.28321 63.546000 Cu 0.825035 0.881747 0.5 156 63.546 9.90596e-05 -3.28297 63.546000 Cu 0.0604995 0.891555 0.5 158 63.546 0.000183346 -3.28342 63.546000 Cu 0.17806 0.896436 7.23849e-16 159 63.546 0.000135542 -3.28318 63.546000 Cu 0.295576 0.90126 0.5 164 63.546 0.000297184 -3.28266 63.546000 Cu 0.0309641 0.911063 9.37005e-16 173 63.546 0.000384483 -3.2836 63.546000 Cu 0.11973 0.935463 1.1467e-15 174 63.546 0.0024015 -3.28309 63.546000 Cu 0.00128189 0.930464 0.5 175 63.546 0.00188776 -3.28235 63.546000 Cu 0.148912 0.915994 0.5 176 63.546 0.0011509 -3.28389 63.546000 Cu 0.266449 0.920833 9.12897e-16 177 63.546 0.000424361 -3.28254 63.546000 Cu 0.237515 0.940473 0.5 180 63.546 0.00514664 -3.28319 63.546000 Cu 0.41325 0.906111 5.76692e-16 162 63.546 0.00046775 -3.28261 63.546000 Cu 0.560499 0.891555 9.16716e-16 165 63.546 0.000183346 -3.28342 63.546000 Cu 0.530964 0.911063 0.5 168 63.546 0.000384483 -3.2836 63.546000 Cu 0.383547 0.925603 0.5 179 63.546 0.00259344 -3.28183 63.546000 Cu 0.501282 0.930464 1.16186e-15 181 63.546 0.00188776 -3.28235 63.546000 Cu 0.61973 0.935463 0.5 183 63.546 0.0024015 -3.28309 63.546000 Cu 0.648912 0.915994 1.11352e-15 166 63.546 0.0011509 -3.28389 63.546000 Cu 0.67806 0.896436 0.5 167 63.546 0.000135542 -3.28318 63.546000 Cu 0.795576 0.90126 9.91667e-16 169 63.546 0.000297184 -3.28266 63.546000 Cu 0.883547 0.925603 1.15708e-15 170 63.546 0.00259344 -3.28183 63.546000 Cu 0.91325 0.906111 0.5 171 63.546 0.00046775 -3.28261 63.546000 Cu 0.766449 0.920833 0.5 172 63.546 0.000424361 -3.28254 63.546000 Cu 0.737515 0.940473 1.16639e-15 185 63.546 0.00514664 -3.28319 63.546000 Cu 0.148818 0.998017 1.67697e-15 208 63.546 2.7687 -3.18177 63.546000 Cu 0.0581433 0.974145 1.23001e-15 190 63.546 0.0749898 -3.27998 63.546000 Cu 0.0898332 0.954759 0.5 191 63.546 0.00745639 -3.27959 63.546000 Cu 0.207911 0.960062 1.2349e-15 193 63.546 0.017535 -3.28557 63.546000 Cu 0.301214 0.984358 8.36872e-16 194 63.546 0.479848 -3.22284 63.546000 Cu 0.175892 0.97937 0.5 196 63.546 0.105224 -3.28837 63.546000 Cu 0.023535 0.994138 0.5 204 63.546 0.835854 -3.2277 63.546000 Cu 0.326354 0.965189 0.5 195 63.546 0.0447035 -3.28728 63.546000 Cu 0.648818 0.998017 0.5 225 63.546 2.7687 -3.18177 63.546000 Cu 0.354302 0.945295 1.31271e-15 178 63.546 0.00460492 -3.2818 63.546000 Cu 0.589833 0.954759 1.47276e-15 182 63.546 0.00745639 -3.27959 63.546000 Cu 0.471767 0.949794 0.5 184 63.546 0.0179885 -3.28146 63.546000 Cu 0.443466 0.969457 1.07223e-15 197 63.546 0.0554994 -3.28404 63.546000 Cu 0.523535 0.994138 1.11388e-15 198 63.546 0.835854 -3.2277 63.546000 Cu 0.558143 0.974145 0.5 199 63.546 0.0749898 -3.27998 63.546000 Cu 0.416103 0.990343 0.5 200 63.546 0.495525 -3.17894 63.546000 Cu 0.971767 0.949794 1.143e-15 189 63.546 0.0179885 -3.28146 63.546000 Cu 0.826354 0.965189 1.35854e-15 186 63.546 0.0447035 -3.28728 63.546000 Cu 0.854302 0.945295 0.5 187 63.546 0.00460492 -3.2818 63.546000 Cu 0.707911 0.960062 0.5 188 63.546 0.017535 -3.28557 63.546000 Cu 0.943466 0.969457 0.5 192 63.546 0.0554994 -3.28404 63.546000 Cu 0.675892 0.97937 1.04215e-15 201 63.546 0.105224 -3.28837 63.546000 Cu 0.801214 0.984358 0.5 202 63.546 0.479848 -3.22284 63.546000 Cu 0.916103 0.990343 8.85447e-16 203 63.546 0.495525 -3.17894