Number of particles = 400 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0876 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.0352 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.606 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 0.0394684 0.0200259 0.5 203 63.546 0.0724784 -3.53615 63.546000 Cu 0.0180068 0.0555533 0.5 205 63.546 0.0243315 -3.54202 63.546000 Cu 0.0979682 0.040288 6.49439e-17 207 63.546 0.0545696 -3.54122 63.546000 Cu 0.236356 0.0472285 7.19194e-17 208 63.546 0.0675452 -3.52003 63.546000 Cu 0.176786 0.025749 0.5 209 63.546 0.0783564 -3.53398 63.546000 Cu 0.119267 0.00419535 4.7385e-17 197 63.546 0.246031 -3.52786 63.546000 Cu 0.25601 0.0133196 4.08906e-18 211 63.546 0.457774 -3.48391 63.546000 Cu 0.399247 0.0173588 1.25077e-16 212 63.546 0.0302351 -3.52764 63.546000 Cu 0.317167 0.0328657 0.5 213 63.546 0.0979178 -3.52104 63.546000 Cu 0.377594 0.0518815 4.81066e-18 225 63.546 0.0101787 -3.53475 63.546000 Cu 0.458778 0.0361621 0.5 227 63.546 0.0127 -3.53764 63.546000 Cu 0.48084 0.000778613 0.5 231 63.546 0.0590892 -3.52609 63.546000 Cu 0.518007 0.0555533 3.84853e-18 226 63.546 0.0243315 -3.54202 63.546000 Cu 0.539468 0.0200259 6.68682e-17 229 63.546 0.0724784 -3.53615 63.546000 Cu 0.676786 0.025749 1.92908e-16 230 63.546 0.0783564 -3.53398 63.546000 Cu 0.597968 0.040288 0.5 232 63.546 0.0545696 -3.54122 63.546000 Cu 0.736356 0.0472285 0.5 253 63.546 0.0675452 -3.52003 63.546000 Cu 0.619267 0.00419535 0.5 194 63.546 0.246031 -3.52786 63.546000 Cu 0.98084 0.000778613 9.62133e-18 202 63.546 0.0590892 -3.52609 63.546000 Cu 0.75601 0.0133196 0.5 233 63.546 0.457774 -3.48391 63.546000 Cu 0.817167 0.0328657 6.1817e-17 255 63.546 0.0979178 -3.52104 63.546000 Cu 0.958778 0.0361621 8.22623e-17 256 63.546 0.0127 -3.53764 63.546000 Cu 0.899247 0.0173588 0.5 257 63.546 0.0302351 -3.52764 63.546000 Cu 0.877594 0.0518815 0.5 258 63.546 0.0101787 -3.53475 63.546000 Cu 0.0771438 0.0755904 2.42698e-16 204 63.546 0.0151725 -3.54324 63.546000 Cu 0.156657 0.0610031 0.5 210 63.546 0.0110099 -3.54083 63.546000 Cu 0.0569442 0.110603 1.22191e-16 217 63.546 0.00395227 -3.54254 63.546000 Cu 0.136577 0.0958908 0.5 219 63.546 0.00240482 -3.54067 63.546000 Cu 0.216328 0.0815346 1.92427e-18 221 63.546 0.0131475 -3.53239 63.546000 Cu 0.356997 0.0864064 4.3296e-18 222 63.546 0.00359656 -3.53731 63.546000 Cu 0.296711 0.0669983 0.5 223 63.546 0.0250762 -3.52972 63.546000 Cu 0.276626 0.10137 0.5 224 63.546 0.0066358 -3.53548 63.546000 Cu 0.437575 0.0710885 0.5 228 63.546 0.00379489 -3.54028 63.546000 Cu 0.417141 0.105883 0.5 245 63.546 0.00113032 -3.54065 63.546000 Cu 0.497245 0.0906674 7.74517e-17 247 63.546 0.00716672 -3.54268 63.546000 Cu 0.636577 0.0958908 3.17504e-16 248 63.546 0.00240482 -3.54067 63.546000 Cu 0.577144 0.0755904 0.5 249 63.546 0.0151725 -3.54324 63.546000 Cu 0.556944 0.110603 0.5 250 63.546 0.00395227 -3.54254 63.546000 Cu 0.656657 0.0610031 2.1215e-16 251 63.546 0.0110099 -3.54083 63.546000 Cu 0.716328 0.0815346 0.5 254 63.546 0.0131475 -3.53239 63.546000 Cu 0.997245 0.0906674 0.5 206 63.546 0.00716672 -3.54268 63.546000 Cu 0.796711 0.0669983 1.24356e-16 252 63.546 0.0250762 -3.52972 63.546000 Cu 0.776626 0.10137 3.36746e-18 279 63.546 0.0066358 -3.53548 63.546000 Cu 0.917141 0.105883 2.45344e-16 280 63.546 0.00113032 -3.54065 63.546000 Cu 0.856997 0.0864064 0.5 281 63.546 0.00359656 -3.53731 63.546000 Cu 0.937575 0.0710885 2.4366e-16 283 63.546 0.00379489 -3.54028 63.546000 Cu 0.0369891 0.145477 1.12088e-16 215 63.546 0.000944631 -3.54148 63.546000 Cu 0.1966 0.116047 2.08783e-16 218 63.546 0.00259339 -3.53714 63.546000 Cu 0.116811 0.130685 0.5 220 63.546 0.000482456 -3.54088 63.546000 Cu 0.0968017 0.165435 0.5 237 63.546 0.000158416 -3.54019 63.546000 Cu 0.176795 0.150677 2.57611e-16 239 63.546 0.000817416 -3.53866 63.546000 Cu 0.317002 0.155611 1.5322e-16 240 63.546 0.000384694 -3.53908 63.546000 Cu 0.256802 0.135901 0.5 241 63.546 0.00177778 -3.53788 63.546000 Cu 0.336941 0.120994 2.61219e-16 243 63.546 0.0011512 -3.53887 63.546000 Cu 0.477157 0.125582 1.22912e-16 244 63.546 0.00208562 -3.54178 63.546000 Cu 0.397153 0.140627 0.5 246 63.546 0.000517759 -3.54034 63.546000 Cu 0.457032 0.160394 1.62841e-16 271 63.546 0.000598586 -3.54084 63.546000 Cu 0.596802 0.165435 1.22672e-16 272 63.546 0.000158416 -3.54019 63.546000 Cu 0.536989 0.145477 0.5 273 63.546 0.000944631 -3.54148 63.546000 Cu 0.616811 0.130685 0 275 63.546 0.000482456 -3.54088 63.546000 Cu 0.6966 0.116047 0.5 277 63.546 0.00259339 -3.53714 63.546000 Cu 0.676795 0.150677 0.5 278 63.546 0.000817416 -3.53866 63.546000 Cu 0.977157 0.125582 0.5 216 63.546 0.00208562 -3.54178 63.546000 Cu 0.756802 0.135901 3.608e-18 276 63.546 0.00177778 -3.53788 63.546000 Cu 0.836941 0.120994 0.5 282 63.546 0.0011512 -3.53887 63.546000 Cu 0.817002 0.155611 0.5 305 63.546 0.000384694 -3.53908 63.546000 Cu 0.897153 0.140627 1.23875e-16 307 63.546 0.000517759 -3.54034 63.546000 Cu 0.957032 0.160394 0.5 308 63.546 0.000598586 -3.54084 63.546000 Cu 0.0167635 0.180264 3.61762e-16 235 63.546 0.000158647 -3.5409 63.546000 Cu 0.156598 0.185328 3.608e-16 236 63.546 0.00022642 -3.53937 63.546000 Cu 0.0764345 0.200163 0.5 238 63.546 0.000118032 -3.54048 63.546000 Cu 0.236747 0.170494 0.5 242 63.546 0.000349807 -3.53839 63.546000 Cu 0.136272 0.220004 2.3909e-16 263 63.546 0.000185652 -3.53983 63.546000 Cu 0.216473 0.20513 0.5 265 63.546 4.23574e-05 -3.53941 63.546000 Cu 0.296662 0.190248 3.76915e-16 267 63.546 2.37433e-05 -3.53892 63.546000 Cu 0.436633 0.195141 1.19064e-16 268 63.546 0.000184732 -3.54051 63.546000 Cu 0.376858 0.175343 0.5 269 63.546 0.000119799 -3.53978 63.546000 Cu 0.356546 0.21003 0.5 270 63.546 0.000125652 -3.53982 63.546000 Cu 0.496426 0.215023 0.5 297 63.546 1.08659e-05 -3.54066 63.546000 Cu 0.516764 0.180264 0.5 274 63.546 0.000158647 -3.5409 63.546000 Cu 0.576434 0.200163 8.13002e-17 299 63.546 0.000118032 -3.54048 63.546000 Cu 0.716473 0.20513 4.81066e-19 300 63.546 4.23574e-05 -3.53941 63.546000 Cu 0.656598 0.185328 0.5 301 63.546 0.00022642 -3.53937 63.546000 Cu 0.636272 0.220004 0.5 302 63.546 0.000185652 -3.53983 63.546000 Cu 0.736747 0.170494 1.23634e-16 303 63.546 0.000349807 -3.53839 63.546000 Cu 0.996426 0.215023 2.39571e-16 234 63.546 1.08659e-05 -3.54066 63.546000 Cu 0.876858 0.175343 1.21229e-16 304 63.546 0.000119799 -3.53978 63.546000 Cu 0.796662 0.190248 0.5 306 63.546 2.37433e-05 -3.53892 63.546000 Cu 0.856546 0.21003 2.19126e-16 331 63.546 0.000125652 -3.53982 63.546000 Cu 0.936633 0.195141 0.5 332 63.546 0.000184732 -3.54051 63.546000 Cu 0.11625 0.254693 2.38128e-16 260 63.546 0.000205688 -3.54025 63.546000 Cu 0.0562161 0.234904 0.5 261 63.546 0.000323908 -3.54045 63.546000 Cu 0.0363566 0.269663 0.5 262 63.546 0.000797207 -3.54113 63.546000 Cu 0.19627 0.239775 0.5 266 63.546 0.000130152 -3.53899 63.546000 Cu 0.176523 0.274422 0.5 289 63.546 0.000335074 -3.53928 63.546000 Cu 0.276386 0.224898 1.15696e-16 264 63.546 0.000105099 -3.53916 63.546000 Cu 0.256435 0.259533 2.72284e-16 291 63.546 0.000494683 -3.53846 63.546000 Cu 0.396492 0.264605 1.97959e-16 292 63.546 0.000196061 -3.54039 63.546000 Cu 0.336359 0.244705 0.5 293 63.546 0.00037217 -3.53924 63.546000 Cu 0.4164 0.229882 1.96997e-16 295 63.546 9.70967e-05 -3.54047 63.546000 Cu 0.476258 0.249784 0.5 298 63.546 0.000373672 -3.5409 63.546000 Cu 0.556216 0.234904 1.88337e-16 296 63.546 0.000323908 -3.54045 63.546000 Cu 0.536357 0.269663 1.17621e-16 323 63.546 0.000797207 -3.54113 63.546000 Cu 0.676523 0.274422 2.42217e-16 324 63.546 0.000335074 -3.53928 63.546000 Cu 0.61625 0.254693 0.5 325 63.546 0.000205688 -3.54025 63.546000 Cu 0.69627 0.239775 2.41495e-16 327 63.546 0.000130152 -3.53899 63.546000 Cu 0.976258 0.249784 2.40293e-16 259 63.546 0.000373672 -3.5409 63.546000 Cu 0.836359 0.244705 1.20748e-16 328 63.546 0.00037217 -3.53924 63.546000 Cu 0.776386 0.224898 0.5 329 63.546 0.000105099 -3.53916 63.546000 Cu 0.756435 0.259533 0.5 330 63.546 0.000494683 -3.53846 63.546000 Cu 0.9164 0.229882 0.5 333 63.546 9.70967e-05 -3.54047 63.546000 Cu 0.896492 0.264605 0.5 357 63.546 0.000196061 -3.54039 63.546000 Cu 0.0769146 0.324171 3.62724e-16 284 63.546 0.00141793 -3.54075 63.546000 Cu 0.0168073 0.304469 0.5 285 63.546 0.00212503 -3.54198 63.546000 Cu 0.0966101 0.289415 2.86716e-16 287 63.546 0.000366571 -3.54047 63.546000 Cu 0.236986 0.294129 1.31331e-16 288 63.546 0.00194632 -3.53768 63.546000 Cu 0.157 0.309049 0.5 290 63.546 0.00113392 -3.53861 63.546000 Cu 0.217487 0.328638 1.16899e-16 315 63.546 0.00755885 -3.53523 63.546000 Cu 0.316787 0.27936 0.5 294 63.546 0.000822731 -3.53872 63.546000 Cu 0.297459 0.313968 0.5 317 63.546 0.00325333 -3.53648 63.546000 Cu 0.377071 0.299362 1.25799e-16 319 63.546 0.000590502 -3.54039 63.546000 Cu 0.456668 0.284572 0.5 321 63.546 0.000979135 -3.54161 63.546000 Cu 0.437092 0.319441 0.5 322 63.546 0.00413291 -3.54215 63.546000 Cu 0.516807 0.304469 2.40293e-16 320 63.546 0.00212503 -3.54198 63.546000 Cu 0.59661 0.289415 0.5 326 63.546 0.000366571 -3.54047 63.546000 Cu 0.576915 0.324171 0.5 349 63.546 0.00141793 -3.54075 63.546000 Cu 0.657 0.309049 5.58037e-17 351 63.546 0.00113392 -3.53861 63.546000 Cu 0.736986 0.294129 0.5 353 63.546 0.00194632 -3.53768 63.546000 Cu 0.717487 0.328638 0.5 354 63.546 0.00755885 -3.53523 63.546000 Cu 0.797459 0.313968 1.08721e-16 352 63.546 0.00325333 -3.53648 63.546000 Cu 0.816787 0.27936 4.81066e-19 355 63.546 0.000822731 -3.53872 63.546000 Cu 0.956668 0.284572 1.81362e-16 356 63.546 0.000979135 -3.54161 63.546000 Cu 0.877071 0.299362 0.5 358 63.546 0.000590502 -3.54039 63.546000 Cu 0.937092 0.319441 1.71019e-16 381 63.546 0.00413291 -3.54215 63.546000 Cu 0.0570011 0.358983 0 311 63.546 0.00436894 -3.54076 63.546000 Cu 0.197936 0.362994 1.18102e-16 312 63.546 0.0281307 -3.52921 63.546000 Cu 0.137288 0.343624 0.5 313 63.546 0.00368809 -3.53736 63.546000 Cu 0.117279 0.378165 0.5 314 63.546 0.00964184 -3.53469 63.546000 Cu 0.357655 0.334135 2.38128e-17 316 63.546 0.00244794 -3.54041 63.546000 Cu 0.278075 0.348464 0.5 318 63.546 0.0146588 -3.53172 63.546000 Cu 0.258743 0.382723 0.5 341 63.546 0.0797869 -3.51911 63.546000 Cu 0.338206 0.369025 9.09215e-17 343 63.546 0.0121906 -3.54049 63.546000 Cu 0.476906 0.374528 0 344 63.546 0.0264144 -3.54205 63.546000 Cu 0.417401 0.354461 0.5 345 63.546 0.0156641 -3.54323 63.546000 Cu 0.496978 0.339393 0 347 63.546 0.00794402 -3.5431 63.546000 Cu 0.637288 0.343624 1.77995e-17 348 63.546 0.00368809 -3.53736 63.546000 Cu 0.557001 0.358983 0.5 350 63.546 0.00436894 -3.54076 63.546000 Cu 0.617279 0.378165 1 373 63.546 0.00964184 -3.53469 63.546000 Cu 0.697936 0.362994 0.5 375 63.546 0.0281307 -3.52921 63.546000 Cu 0.996978 0.339393 0.5 286 63.546 0.00794402 -3.5431 63.546000 Cu 0.976906 0.374528 0.5 310 63.546 0.0264144 -3.54205 63.546000 Cu 0.758743 0.382723 0 374 63.546 0.0797869 -3.51911 63.546000 Cu 0.778075 0.348464 1.92667e-16 377 63.546 0.0146588 -3.53172 63.546000 Cu 0.917401 0.354461 1.19786e-16 378 63.546 0.0156641 -3.54323 63.546000 Cu 0.857655 0.334135 0.5 379 63.546 0.00244794 -3.54041 63.546000 Cu 0.838206 0.369025 0.5 380 63.546 0.0121906 -3.54049 63.546000 Cu 0.0365855 0.39393 0 309 63.546 0.0142624 -3.53755 63.546000 Cu 0.0159022 0.429332 8.46677e-17 335 63.546 0.0661403 -3.52761 63.546000 Cu 0.157949 0.430862 0 336 63.546 0.515437 -3.48974 63.546000 Cu 0.0966501 0.412696 0.5 337 63.546 0.031386 -3.528 63.546000 Cu 0.178238 0.397124 0 339 63.546 0.105237 -3.52108 63.546000 Cu 0.240119 0.416609 0.5 342 63.546 0.520336 -3.4778 63.546000 Cu 0.319042 0.404314 0 340 63.546 0.0894614 -3.533 63.546000 Cu 0.397376 0.389773 0.5 346 63.546 0.0564548 -3.541 63.546000 Cu 0.302369 0.441348 0 365 63.546 5.591 -3.47516 63.546000 Cu 0.377293 0.425881 0.5 367 63.546 0.25068 -3.52762 63.546000 Cu 0.456507 0.410082 1 369 63.546 0.0763438 -3.53602 63.546000 Cu 0.59665 0.412696 1 370 63.546 0.031386 -3.528 63.546000 Cu 0.536586 0.39393 0.5 371 63.546 0.0142624 -3.53755 63.546000 Cu 0.515902 0.429332 0.5 372 63.546 0.0661403 -3.52761 63.546000 Cu 0.678238 0.397124 0.5 376 63.546 0.105237 -3.52108 63.546000 Cu 0.657949 0.430862 0.5 389 63.546 0.515437 -3.48974 63.546000 Cu 0.740119 0.416609 0 391 63.546 0.520336 -3.4778 63.546000 Cu 0.877293 0.425881 0 392 63.546 0.25068 -3.52762 63.546000 Cu 0.819042 0.404314 0.5 393 63.546 0.0894614 -3.533 63.546000 Cu 0.802369 0.441348 0.5 394 63.546 5.591 -3.47516 63.546000 Cu 0.897376 0.389773 1 395 63.546 0.0564548 -3.541 63.546000 Cu 0.956507 0.410082 0.5 396 63.546 0.0763438 -3.53602 63.546000 Cu 0.0777673 0.447503 0.5 338 63.546 0.181779 -3.52643 63.546000 Cu 0.0784214 0.482509 0.5 360 63.546 0.181996 -3.52537 63.546000 Cu 0.145744 0.465005 1.48649e-16 361 63.546 3.36843 -3.49291 63.546000 Cu 0.219364 0.449106 0.5 363 63.546 7.69452 -3.27045 63.546000 Cu 0.220061 0.480801 0.5 364 63.546 7.71425 -3.27487 63.546000 Cu 0.00242161 0.465008 0 334 63.546 0.419508 -3.52748 63.546000 Cu 0.159192 0.499103 3.10288e-17 359 63.546 0.49676 -3.48865 63.546000 Cu 0.30308 0.48873 0 362 63.546 5.57787 -3.47724 63.546000 Cu 0.436869 0.446772 0 366 63.546 0.376034 -3.50007 63.546000 Cu 0.354924 0.464998 0.5 368 63.546 4.59609 -3.58219 63.546000 Cu 0.437484 0.483235 0 383 63.546 0.381537 -3.49994 63.546000 Cu 0.502422 0.465008 0.5 385 63.546 0.419508 -3.52748 63.546000 Cu 0.578421 0.482509 1 384 63.546 0.181996 -3.52537 63.546000 Cu 0.577767 0.447503 1 387 63.546 0.181779 -3.52643 63.546000 Cu 0.719364 0.449106 1 388 63.546 7.69452 -3.27045 63.546000 Cu 0.645744 0.465005 0.5 390 63.546 3.36843 -3.49291 63.546000 Cu 0.720061 0.480801 1 397 63.546 7.71425 -3.27487 63.546000 Cu 0.659192 0.499103 0.5 386 63.546 0.49676 -3.48865 63.546000 Cu 0.937484 0.483235 0.5 4 63.546 0.381537 -3.49994 63.546000 Cu 0.936869 0.446772 0.5 32 63.546 0.376034 -3.50007 63.546000 Cu 0.80308 0.48873 0.5 399 63.546 5.57787 -3.47724 63.546000 Cu 0.854924 0.464998 0 400 63.546 4.59609 -3.58219 63.546000 Cu 0.241818 0.513319 0.5 16 63.546 0.487447 -3.48107 63.546000 Cu 0.0391313 0.536087 0 33 63.546 0.0132358 -3.53726 63.546000 Cu 0.0985382 0.517318 0.5 34 63.546 0.0320715 -3.52737 63.546000 Cu 0.180684 0.532845 0 35 63.546 0.103343 -3.52079 63.546000 Cu 0.120458 0.551839 0.5 38 63.546 0.0105853 -3.53438 63.546000 Cu 0.0171409 0.500699 0 1 63.546 0.0653399 -3.52685 63.546000 Cu 0.37867 0.504115 0.5 382 63.546 0.249295 -3.5279 63.546000 Cu 0.321062 0.525662 0 14 63.546 0.0853982 -3.53368 63.546000 Cu 0.458368 0.519948 0 17 63.546 0.0735505 -3.5358 63.546000 Cu 0.480137 0.555493 1.41915e-17 18 63.546 0.0237162 -3.54199 63.546000 Cu 0.399977 0.540203 0.5 20 63.546 0.057018 -3.54117 63.546000 Cu 0.261677 0.547195 0.5 37 63.546 0.0716303 -3.5197 63.546000 Cu 0.517141 0.500699 0.5 15 63.546 0.0653399 -3.52685 63.546000 Cu 0.598538 0.517318 1 3 63.546 0.0320715 -3.52737 63.546000 Cu 0.741818 0.513319 1 5 63.546 0.487447 -3.48107 63.546000 Cu 0.680684 0.532845 0.5 8 63.546 0.103343 -3.52079 63.546000 Cu 0.539131 0.536087 0.5 19 63.546 0.0132358 -3.53726 63.546000 Cu 0.620458 0.551839 1 21 63.546 0.0105853 -3.53438 63.546000 Cu 0.87867 0.504115 0 398 63.546 0.249295 -3.5279 63.546000 Cu 0.958368 0.519948 0.5 2 63.546 0.0735505 -3.5358 63.546000 Cu 0.761677 0.547195 0 6 63.546 0.0716303 -3.5197 63.546000 Cu 0.821062 0.525662 0.5 7 63.546 0.0853982 -3.53368 63.546000 Cu 0.899977 0.540203 1 9 63.546 0.057018 -3.54117 63.546000 Cu 0.980137 0.555493 0.5 11 63.546 0.0237162 -3.54199 63.546000 Cu 0.00152522 0.590594 0.5 13 63.546 0.00740052 -3.54263 63.546000 Cu 0.201675 0.566963 2.37406e-16 36 63.546 0.026956 -3.52929 63.546000 Cu 0.0609187 0.571037 1.65006e-16 58 63.546 0.00348063 -3.54027 63.546000 Cu 0.0819247 0.605829 1.49371e-16 59 63.546 0.00105365 -3.54026 63.546000 Cu 0.141718 0.586364 0.5 60 63.546 0.0041176 -3.53699 63.546000 Cu 0.222368 0.601314 2.4342e-16 61 63.546 0.00714493 -3.53534 63.546000 Cu 0.341609 0.56092 7.19194e-17 39 63.546 0.0121381 -3.54063 63.546000 Cu 0.362301 0.5958 1.78235e-16 40 63.546 0.0027707 -3.54085 63.546000 Cu 0.421343 0.575499 0.5 41 63.546 0.0166951 -3.5431 63.546000 Cu 0.28229 0.581471 0.5 42 63.546 0.0133944 -3.53211 63.546000 Cu 0.442186 0.610515 0.5 46 63.546 0.00443483 -3.5424 63.546000 Cu 0.641718 0.586364 0 22 63.546 0.0041176 -3.53699 63.546000 Cu 0.701675 0.566963 0.5 23 63.546 0.026956 -3.52929 63.546000 Cu 0.560919 0.571037 0.5 24 63.546 0.00348063 -3.54027 63.546000 Cu 0.722368 0.601314 0.5 28 63.546 0.00714493 -3.53534 63.546000 Cu 0.501525 0.590594 4.25744e-17 43 63.546 0.00740052 -3.54263 63.546000 Cu 0.581925 0.605829 0.5 45 63.546 0.00105365 -3.54026 63.546000 Cu 0.921343 0.575499 1.06797e-16 10 63.546 0.0166951 -3.5431 63.546000 Cu 0.841609 0.56092 0.5 12 63.546 0.0121381 -3.54063 63.546000 Cu 0.78229 0.581471 1.67171e-16 25 63.546 0.0133944 -3.53211 63.546000 Cu 0.862301 0.5958 0.5 27 63.546 0.0027707 -3.54085 63.546000 Cu 0.942186 0.610515 1.91224e-16 29 63.546 0.00443483 -3.5424 63.546000 Cu 0.242647 0.635824 2.99223e-16 62 63.546 0.00170865 -3.5376 63.546000 Cu 0.162346 0.620934 0.5 64 63.546 0.00140412 -3.53833 63.546000 Cu 0.0222179 0.625499 0.5 82 63.546 0.00228647 -3.54175 63.546000 Cu 0.102406 0.640571 2.37406e-16 83 63.546 0.000370092 -3.5401 63.546000 Cu 0.182643 0.655542 0.5 85 63.546 0.000286764 -3.53904 63.546000 Cu 0.0425128 0.66032 0.5 86 63.546 0.000633776 -3.54116 63.546000 Cu 0.302665 0.615971 0.5 63 63.546 0.00287461 -3.53708 63.546000 Cu 0.382619 0.630592 1.33977e-16 65 63.546 0.000592553 -3.54064 63.546000 Cu 0.402748 0.665361 3.37949e-16 66 63.546 0.000140172 -3.54065 63.546000 Cu 0.462549 0.645388 0.5 67 63.546 0.00112526 -3.54164 63.546000 Cu 0.322816 0.650589 0.5 68 63.546 0.000749158 -3.53909 63.546000 Cu 0.522218 0.625499 7.07167e-17 44 63.546 0.00228647 -3.54175 63.546000 Cu 0.662346 0.620934 1.82805e-17 47 63.546 0.00140412 -3.53833 63.546000 Cu 0.682643 0.655542 0 48 63.546 0.000286764 -3.53904 63.546000 Cu 0.742647 0.635824 0.5 49 63.546 0.00170865 -3.5376 63.546000 Cu 0.602406 0.640571 0.5 50 63.546 0.000370092 -3.5401 63.546000 Cu 0.542513 0.66032 1.4432e-16 69 63.546 0.000633776 -3.54116 63.546000 Cu 0.802665 0.615971 1.29888e-16 26 63.546 0.00287461 -3.53708 63.546000 Cu 0.962549 0.645388 2.35963e-16 30 63.546 0.00112526 -3.54164 63.546000 Cu 0.882619 0.630592 0.5 31 63.546 0.000592553 -3.54064 63.546000 Cu 0.822816 0.650589 1.19786e-16 51 63.546 0.000749158 -3.53909 63.546000 Cu 0.902748 0.665361 0.5 53 63.546 0.000140172 -3.54065 63.546000 Cu 0.00282007 0.714977 2.15518e-16 56 63.546 1.87762e-05 -3.54077 63.546000 Cu 0.122513 0.67528 1.10405e-16 84 63.546 0.000223866 -3.5402 63.546000 Cu 0.202672 0.690183 0.5 90 63.546 3.78341e-05 -3.53912 63.546000 Cu 0.0625858 0.695098 0.5 108 63.546 0.000210781 -3.54037 63.546000 Cu 0.14272 0.709963 6.03738e-17 109 63.546 0.000164725 -3.53972 63.546000 Cu 0.482643 0.680199 0.5 72 63.546 0.000177028 -3.54084 63.546000 Cu 0.262742 0.670435 2.04934e-16 87 63.546 0.000438947 -3.53882 63.546000 Cu 0.28285 0.705063 1.17621e-16 88 63.546 6.07262e-05 -3.53912 63.546000 Cu 0.342806 0.685265 0.5 89 63.546 0.000281007 -3.53942 63.546000 Cu 0.422817 0.700113 0 91 63.546 8.00138e-05 -3.54049 63.546000 Cu 0.362945 0.719972 0.5 94 63.546 0.000228895 -3.54008 63.546000 Cu 0.562586 0.695098 0 70 63.546 0.000210781 -3.54037 63.546000 Cu 0.622513 0.67528 0.5 71 63.546 0.000223866 -3.5402 63.546000 Cu 0.702672 0.690183 0 73 63.546 3.78341e-05 -3.53912 63.546000 Cu 0.64272 0.709963 0.5 76 63.546 0.000164725 -3.53972 63.546000 Cu 0.50282 0.714977 0.5 93 63.546 1.87762e-05 -3.54077 63.546000 Cu 0.842806 0.685265 0 52 63.546 0.000281007 -3.53942 63.546000 Cu 0.762742 0.670435 0.5 54 63.546 0.000438947 -3.53882 63.546000 Cu 0.982643 0.680199 1.1714e-16 55 63.546 0.000177028 -3.54084 63.546000 Cu 0.922817 0.700113 0.5 57 63.546 8.00138e-05 -3.54049 63.546000 Cu 0.78285 0.705063 0.5 75 63.546 6.07262e-05 -3.53912 63.546000 Cu 0.862945 0.719972 1.18102e-16 77 63.546 0.000228895 -3.54008 63.546000 Cu 0.162994 0.744637 3.22314e-16 110 63.546 0.000373341 -3.53908 63.546000 Cu 0.222882 0.72483 0.5 111 63.546 0.000141185 -3.5392 63.546000 Cu 0.0828765 0.729824 0.5 112 63.546 8.03488e-05 -3.54029 63.546000 Cu 0.243172 0.759471 0.5 116 63.546 0.000622524 -3.53842 63.546000 Cu 0.0231642 0.749739 3.32176e-16 132 63.546 0.000214662 -3.54082 63.546000 Cu 0.103219 0.76455 0.5 134 63.546 0.000183118 -3.54048 63.546000 Cu 0.443043 0.734866 1.18102e-16 92 63.546 0.00024813 -3.5406 63.546000 Cu 0.303064 0.739737 3.59116e-16 113 63.546 4.24334e-05 -3.53917 63.546000 Cu 0.323375 0.774381 3.58154e-16 114 63.546 0.00026896 -3.53902 63.546000 Cu 0.383333 0.754678 0.5 115 63.546 0.000330562 -3.5398 63.546000 Cu 0.463495 0.769624 2.40774e-16 117 63.546 0.000906697 -3.54091 63.546000 Cu 0.722882 0.72483 0 74 63.546 0.000141185 -3.5392 63.546000 Cu 0.582876 0.729824 0 95 63.546 8.03488e-05 -3.54029 63.546000 Cu 0.603219 0.76455 1.78235e-16 96 63.546 0.000183118 -3.54048 63.546000 Cu 0.662994 0.744637 0.5 97 63.546 0.000373341 -3.53908 63.546000 Cu 0.523164 0.749739 0.5 98 63.546 0.000214662 -3.54082 63.546000 Cu 0.743172 0.759471 1.18823e-16 99 63.546 0.000622524 -3.53842 63.546000 Cu 0.883333 0.754678 1.18102e-16 78 63.546 0.000330562 -3.5398 63.546000 Cu 0.943043 0.734866 0.5 79 63.546 0.00024813 -3.5406 63.546000 Cu 0.803064 0.739737 0.5 80 63.546 4.24334e-05 -3.53917 63.546000 Cu 0.963495 0.769624 0.5 81 63.546 0.000906697 -3.54091 63.546000 Cu 0.823375 0.774381 0.5 101 63.546 0.00026896 -3.53902 63.546000 Cu 0.0434167 0.784546 4.20933e-17 133 63.546 0.00130443 -3.54167 63.546000 Cu 0.183194 0.779295 3.66813e-16 135 63.546 0.00111774 -3.53875 63.546000 Cu 0.203052 0.81391 2.91767e-16 136 63.546 0.00373815 -3.53674 63.546000 Cu 0.123235 0.799313 0.5 138 63.546 0.000541869 -3.5404 63.546000 Cu 0.0634698 0.819419 3.9688e-17 158 63.546 0.00470772 -3.54227 63.546000 Cu 0.483624 0.804446 3.6561e-17 118 63.546 0.00257046 -3.5419 63.546000 Cu 0.403561 0.789384 0.5 120 63.546 0.000472536 -3.5402 63.546000 Cu 0.263242 0.794074 0.5 137 63.546 0.00214731 -3.53782 63.546000 Cu 0.343453 0.809005 9.40485e-17 139 63.546 0.00110811 -3.53857 63.546000 Cu 0.423663 0.824132 0.5 141 63.546 0.00123168 -3.54068 63.546000 Cu 0.28316 0.828605 0.5 142 63.546 0.00718556 -3.53547 63.546000 Cu 0.683194 0.779295 0.5 102 63.546 0.00111774 -3.53875 63.546000 Cu 0.543417 0.784546 0.5 119 63.546 0.00130443 -3.54167 63.546000 Cu 0.623235 0.799313 1.02948e-16 121 63.546 0.000541869 -3.5404 63.546000 Cu 0.703052 0.81391 0.5 123 63.546 0.00373815 -3.53674 63.546000 Cu 0.56347 0.819419 0.5 124 63.546 0.00470772 -3.54227 63.546000 Cu 0.763242 0.794074 2.41255e-16 100 63.546 0.00214731 -3.53782 63.546000 Cu 0.903561 0.789384 2.40774e-16 103 63.546 0.000472536 -3.5402 63.546000 Cu 0.923663 0.824132 1.20267e-16 104 63.546 0.00123168 -3.54068 63.546000 Cu 0.983624 0.804446 0.5 105 63.546 0.00257046 -3.5419 63.546000 Cu 0.843453 0.809005 0.5 106 63.546 0.00110811 -3.53857 63.546000 Cu 0.78316 0.828605 1.19064e-16 125 63.546 0.00718556 -3.53547 63.546000 Cu 0.00375585 0.839386 0.5 107 63.546 0.00889913 -3.54292 63.546000 Cu 0.0834472 0.854437 0 159 63.546 0.0160124 -3.54283 63.546000 Cu 0.143056 0.834095 0.5 160 63.546 0.00226923 -3.54031 63.546000 Cu 0.222706 0.84841 2.1648e-18 161 63.546 0.0164627 -3.5318 63.546000 Cu 0.242091 0.88269 4.08906e-18 162 63.546 0.0837971 -3.51854 63.546000 Cu 0.162707 0.868997 0.5 164 63.546 0.0121067 -3.54047 63.546000 Cu 0.0239727 0.874516 0.5 180 63.546 0.0269184 -3.5421 63.546000 Cu 0.363512 0.843596 2.44382e-16 140 63.546 0.00373834 -3.5373 63.546000 Cu 0.443852 0.858961 0.5 146 63.546 0.00423103 -3.54033 63.546000 Cu 0.302951 0.86297 0.5 163 63.546 0.0276688 -3.52899 63.546000 Cu 0.383592 0.878146 3.84853e-18 165 63.546 0.0100107 -3.53477 63.546000 Cu 0.643056 0.834095 3.63686e-16 122 63.546 0.00226923 -3.54031 63.546000 Cu 0.722706 0.84841 0.5 128 63.546 0.0164627 -3.5318 63.546000 Cu 0.503756 0.839386 9.62133e-19 143 63.546 0.00889913 -3.54292 63.546000 Cu 0.523973 0.874516 1.4432e-18 144 63.546 0.0269184 -3.5421 63.546000 Cu 0.583447 0.854437 0.5 145 63.546 0.0160124 -3.54283 63.546000 Cu 0.662707 0.868997 1.33736e-16 147 63.546 0.0121067 -3.54047 63.546000 Cu 0.742091 0.88269 0.5 149 63.546 0.0837971 -3.51854 63.546000 Cu 0.802951 0.86297 4.07704e-16 126 63.546 0.0276688 -3.52899 63.546000 Cu 0.863512 0.843596 0.5 127 63.546 0.00373834 -3.5373 63.546000 Cu 0.943852 0.858961 2.43901e-16 129 63.546 0.00423103 -3.54033 63.546000 Cu 0.883592 0.878146 0.5 131 63.546 0.0100107 -3.53477 63.546000 Cu 0.103494 0.889753 0 181 63.546 0.0555731 -3.54064 63.546000 Cu 0.123184 0.925909 1.58752e-16 182 63.546 0.253354 -3.52778 63.546000 Cu 0.181597 0.90434 0.5 183 63.546 0.0990582 -3.53189 63.546000 Cu 0.0441427 0.910106 0.5 184 63.546 0.0779494 -3.53547 63.546000 Cu 0.197578 0.941548 0.5 188 63.546 5.60122 -3.47552 63.546000 Cu 0.403995 0.91271 0 166 63.546 0.0318499 -3.52844 63.546000 Cu 0.464237 0.893941 0.5 167 63.546 0.0153992 -3.53834 63.546000 Cu 0.3225 0.897097 0.5 168 63.546 0.11007 -3.52092 63.546000 Cu 0.484546 0.929375 0.5 172 63.546 0.07504 -3.52806 63.546000 Cu 0.260461 0.916578 5.67658e-17 185 63.546 0.557173 -3.47481 63.546000 Cu 0.3425 0.930853 0.5 187 63.546 0.550083 -3.49 63.546000 Cu 0.681597 0.90434 5.74874e-17 148 63.546 0.0990582 -3.53189 63.546000 Cu 0.603494 0.889753 0.5 150 63.546 0.0555731 -3.54064 63.546000 Cu 0.544143 0.910106 8.03381e-17 169 63.546 0.0779494 -3.53547 63.546000 Cu 0.623184 0.925909 0.5 171 63.546 0.253354 -3.52778 63.546000 Cu 0.697578 0.941548 1.23394e-16 173 63.546 5.60122 -3.47552 63.546000 Cu 0.964237 0.893941 5.58037e-17 130 63.546 0.0153992 -3.53834 63.546000 Cu 0.8225 0.897097 9.33269e-17 151 63.546 0.11007 -3.52092 63.546000 Cu 0.8425 0.930853 1.23394e-16 152 63.546 0.550083 -3.49 63.546000 Cu 0.903995 0.91271 0.5 153 63.546 0.0318499 -3.52844 63.546000 Cu 0.760461 0.916578 0.5 154 63.546 0.557173 -3.47481 63.546000 Cu 0.984546 0.929375 0 155 63.546 0.07504 -3.52806 63.546000 Cu 0.06292 0.946852 0.5 195 63.546 0.379731 -3.49925 63.546000 Cu 0.144114 0.965062 1.4432e-18 196 63.546 4.5765 -3.58125 63.546000 Cu 0.19525 0.988897 0.5 198 63.546 5.58606 -3.47668 63.546000 Cu 0.0609612 0.983322 0.5 199 63.546 0.374439 -3.50039 63.546000 Cu 0.33871 0.999125 0.5 214 63.546 0.469275 -3.48896 63.546000 Cu 0.28085 0.949034 2.4342e-16 186 63.546 7.73953 -3.26394 63.546000 Cu 0.422196 0.947551 1.17861e-16 189 63.546 0.197722 -3.52666 63.546000 Cu 0.419939 0.98258 4.44986e-17 190 63.546 0.166898 -3.52476 63.546000 Cu 0.353413 0.965042 0.5 192 63.546 3.31559 -3.49283 63.546000 Cu 0.278036 0.980726 2.64586e-18 200 63.546 7.71296 -3.28208 63.546000 Cu 0.496661 0.965072 0.5 191 63.546 0.411459 -3.52697 63.546000 Cu 0.56292 0.946852 4.3296e-18 170 63.546 0.379731 -3.49925 63.546000 Cu 0.69525 0.988897 4.08906e-18 174 63.546 5.58606 -3.47668 63.546000 Cu 0.644114 0.965062 0.5 176 63.546 4.5765 -3.58125 63.546000 Cu 0.560961 0.983322 1.4432e-18 193 63.546 0.374439 -3.50039 63.546000 Cu 0.83871 0.999125 0 201 63.546 0.469275 -3.48896 63.546000 Cu 0.996661 0.965072 0 156 63.546 0.411459 -3.52697 63.546000 Cu 0.922196 0.947551 0.5 157 63.546 0.197722 -3.52666 63.546000 Cu 0.78085 0.949034 0.5 175 63.546 7.73953 -3.26394 63.546000 Cu 0.853413 0.965042 1.25558e-16 177 63.546 3.31559 -3.49283 63.546000 Cu 0.919939 0.98258 0.5 178 63.546 0.166898 -3.52476 63.546000 Cu 0.778036 0.980726 0.5 179 63.546 7.71296 -3.28208