Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.4692 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.841 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60309 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 0.0808929 0.0259871 1.34807e-17 226 63.546 0.754745 -3.4208 63.546000 Cu 0.167697 0.0212771 0.5 228 63.546 0.477415 -3.46677 63.546000 Cu 0.189533 0.047606 4.42938e-17 227 63.546 0.101204 -3.52305 63.546000 Cu 0.263268 0.0197886 0 230 63.546 0.475234 -3.49602 63.546000 Cu 0.38438 0.0393376 0 231 63.546 0.0887427 -3.52413 63.546000 Cu 0.367216 0.0165818 0.5 232 63.546 3.8711 -3.43321 63.546000 Cu 0.285017 0.0432522 0.5 233 63.546 0.1044 -3.52522 63.546000 Cu 0.466519 0.0112335 1 234 63.546 9.07579 -3.38499 63.546000 Cu 0.580893 0.0259871 0 235 63.546 0.754745 -3.4208 63.546000 Cu 0.484957 0.0332059 0.5 237 63.546 0.559269 -3.46536 63.546000 Cu 0.763268 0.0197886 7.36625e-17 212 63.546 0.475234 -3.49602 63.546000 Cu 0.667697 0.0212771 0.5 213 63.546 0.477415 -3.46677 63.546000 Cu 0.785017 0.0432522 0.5 220 63.546 0.1044 -3.52522 63.546000 Cu 0.689533 0.047606 0 218 63.546 0.101204 -3.52305 63.546000 Cu 0.966519 0.0112335 0 214 63.546 9.07579 -3.38499 63.546000 Cu 0.867216 0.0165818 0.5 215 63.546 3.8711 -3.43321 63.546000 Cu 0.88438 0.0393376 1 222 63.546 0.0887427 -3.52413 63.546000 Cu 0.984957 0.0332059 0.5 224 63.546 0.559269 -3.46536 63.546000 Cu 0.00204642 0.0570129 0 223 63.546 0.0539197 -3.52906 63.546000 Cu 0.0971468 0.0517078 0.5 229 63.546 0.0679393 -3.52811 63.546000 Cu 0.0197468 0.0812023 0.5 245 63.546 0.00704426 -3.53862 63.546000 Cu 0.114972 0.0765883 2.79243e-17 247 63.546 0.00919463 -3.53834 63.546000 Cu 0.210192 0.0719603 0.5 249 63.546 0.0129776 -3.53875 63.546000 Cu 0.306134 0.0672512 1 251 63.546 0.013831 -3.53766 63.546000 Cu 0.326613 0.0910805 0.5 254 63.546 0.00186322 -3.53977 63.546000 Cu 0.423374 0.0861341 3.89978e-17 252 63.546 0.00513405 -3.53902 63.546000 Cu 0.404259 0.0623171 0.5 253 63.546 0.0184409 -3.53426 63.546000 Cu 0.502046 0.0570129 0 255 63.546 0.0539197 -3.52906 63.546000 Cu 0.597147 0.0517078 0.5 257 63.546 0.0679393 -3.52811 63.546000 Cu 0.519747 0.0812023 0.5 258 63.546 0.00704426 -3.53862 63.546000 Cu 0.710192 0.0719603 0.5 221 63.546 0.0129776 -3.53875 63.546000 Cu 0.614972 0.0765883 0 256 63.546 0.00919463 -3.53834 63.546000 Cu 0.806134 0.0672512 1.57917e-16 219 63.546 0.013831 -3.53766 63.546000 Cu 0.904259 0.0623171 0.5 225 63.546 0.0184409 -3.53426 63.546000 Cu 0.826613 0.0910805 0.5 241 63.546 0.00186322 -3.53977 63.546000 Cu 0.923374 0.0861341 0 243 63.546 0.00513405 -3.53902 63.546000 Cu 0.0382494 0.105516 0 244 63.546 0.000599902 -3.53983 63.546000 Cu 0.13414 0.10082 0.5 250 63.546 0.0018275 -3.53978 63.546000 Cu 0.0573985 0.129681 0.5 267 63.546 0.000306523 -3.53991 63.546000 Cu 0.153516 0.124916 0 269 63.546 0.000483424 -3.5399 63.546000 Cu 0.230133 0.0960642 0 248 63.546 0.00223474 -3.53976 63.546000 Cu 0.24984 0.120053 0.5 271 63.546 0.000215642 -3.53991 63.546000 Cu 0.346136 0.115124 0 273 63.546 0.00077592 -3.53986 63.546000 Cu 0.365367 0.139244 0.5 276 63.546 0.000218873 -3.53989 63.546000 Cu 0.461373 0.134448 7.8477e-17 274 63.546 0.00010456 -3.53991 63.546000 Cu 0.442343 0.110247 0.5 275 63.546 0.00100738 -3.53975 63.546000 Cu 0.538249 0.105516 0 277 63.546 0.000599902 -3.53983 63.546000 Cu 0.557399 0.129681 0.5 279 63.546 0.000306523 -3.53991 63.546000 Cu 0.653516 0.124916 4.7664e-17 238 63.546 0.000483424 -3.5399 63.546000 Cu 0.730133 0.0960642 3.22574e-17 239 63.546 0.00223474 -3.53976 63.546000 Cu 0.74984 0.120053 0.5 242 63.546 0.000215642 -3.53991 63.546000 Cu 0.63414 0.10082 0.5 278 63.546 0.0018275 -3.53978 63.546000 Cu 0.846136 0.115124 1 240 63.546 0.00077592 -3.53986 63.546000 Cu 0.942343 0.110247 0.5 246 63.546 0.00100738 -3.53975 63.546000 Cu 0.865367 0.139244 0.5 263 63.546 0.000218873 -3.53989 63.546000 Cu 0.961373 0.134448 0 265 63.546 0.00010456 -3.53991 63.546000 Cu 0.0767473 0.153785 0 266 63.546 0.000106023 -3.53993 63.546000 Cu 0.172956 0.148958 0.5 272 63.546 3.2202e-05 -3.53993 63.546000 Cu 0.0961223 0.177849 0.5 288 63.546 1.24828e-05 -3.53993 63.546000 Cu 0.192309 0.173018 1 290 63.546 2.86105e-05 -3.53993 63.546000 Cu 0.269208 0.144102 0 270 63.546 0.000135035 -3.53991 63.546000 Cu 0.288461 0.16819 0.5 292 63.546 3.6814e-05 -3.53992 63.546000 Cu 0.384565 0.163378 1 294 63.546 2.74503e-05 -3.53993 63.546000 Cu 0.499955 0.182667 1 295 63.546 1.76736e-05 -3.53993 63.546000 Cu 0.480639 0.158583 0.5 296 63.546 7.76314e-05 -3.53993 63.546000 Cu 0.403816 0.187474 0.5 297 63.546 1.00044e-05 -3.53993 63.546000 Cu 0.576747 0.153785 4.57381e-17 298 63.546 0.000106023 -3.53993 63.546000 Cu 0.596122 0.177849 0.5 299 63.546 1.24828e-05 -3.53993 63.546000 Cu 0.692309 0.173018 5.296e-18 259 63.546 2.86105e-05 -3.53993 63.546000 Cu 0.672956 0.148958 0.5 260 63.546 3.2202e-05 -3.53993 63.546000 Cu 0.769208 0.144102 8.85876e-17 261 63.546 0.000135035 -3.53991 63.546000 Cu 0.788461 0.16819 0.5 264 63.546 3.6814e-05 -3.53992 63.546000 Cu 0.999955 0.182667 1 286 63.546 1.76736e-05 -3.53993 63.546000 Cu 0.884565 0.163378 3.80349e-17 262 63.546 2.74503e-05 -3.53993 63.546000 Cu 0.980639 0.158583 0.5 268 63.546 7.76314e-05 -3.53993 63.546000 Cu 0.903816 0.187474 0.5 284 63.546 1.00044e-05 -3.53993 63.546000 Cu 0.115399 0.201916 1 287 63.546 6.64644e-06 -3.53993 63.546000 Cu 0.0192335 0.206735 0.5 289 63.546 4.16168e-06 -3.53993 63.546000 Cu 0.0384542 0.230811 0 308 63.546 4.50035e-07 -3.53993 63.546000 Cu 0.134618 0.225993 0.5 310 63.546 1.06717e-06 -3.53993 63.546000 Cu 0.307694 0.192282 0 291 63.546 3.34428e-06 -3.53993 63.546000 Cu 0.211561 0.197096 0.5 293 63.546 8.62662e-06 -3.53993 63.546000 Cu 0.230766 0.221179 0 312 63.546 7.55038e-07 -3.53993 63.546000 Cu 0.326921 0.216364 0.5 314 63.546 1.52524e-06 -3.53993 63.546000 Cu 0.423067 0.211552 1 316 63.546 2.75889e-06 -3.53993 63.546000 Cu 0.538454 0.230811 8.76247e-17 317 63.546 4.50035e-07 -3.53993 63.546000 Cu 0.519234 0.206735 0.5 318 63.546 4.16168e-06 -3.53993 63.546000 Cu 0.442296 0.235626 0.5 319 63.546 4.37162e-07 -3.53993 63.546000 Cu 0.730766 0.221179 1 280 63.546 7.55038e-07 -3.53993 63.546000 Cu 0.711561 0.197096 0.5 281 63.546 8.62662e-06 -3.53993 63.546000 Cu 0.615399 0.201916 1 320 63.546 6.64644e-06 -3.53993 63.546000 Cu 0.634618 0.225993 0.5 321 63.546 1.06717e-06 -3.53993 63.546000 Cu 0.807694 0.192282 0 282 63.546 3.34428e-06 -3.53993 63.546000 Cu 0.923067 0.211552 1 283 63.546 2.75889e-06 -3.53993 63.546000 Cu 0.826921 0.216364 0.5 285 63.546 1.52524e-06 -3.53993 63.546000 Cu 0.942296 0.235626 0.5 306 63.546 4.37162e-07 -3.53993 63.546000 Cu 0.15382 0.250071 5.8256e-17 309 63.546 4.95068e-07 -3.53993 63.546000 Cu 0.057663 0.254885 0.5 311 63.546 6.98961e-07 -3.53992 63.546000 Cu 0.0768956 0.278958 2.79243e-17 330 63.546 3.84188e-06 -3.53993 63.546000 Cu 0.173037 0.274148 0.5 332 63.546 2.02241e-06 -3.53993 63.546000 Cu 0.346131 0.240443 0 313 63.546 6.72245e-07 -3.53993 63.546000 Cu 0.249979 0.245256 0.5 315 63.546 8.864e-08 -3.53993 63.546000 Cu 0.269189 0.269333 0 334 63.546 9.47298e-07 -3.53993 63.546000 Cu 0.365345 0.264517 0.5 336 63.546 7.13442e-07 -3.53993 63.546000 Cu 0.461505 0.259701 3.46647e-17 338 63.546 4.01672e-07 -3.53993 63.546000 Cu 0.576896 0.278958 1 339 63.546 3.84188e-06 -3.53993 63.546000 Cu 0.557663 0.254885 0.5 340 63.546 6.98961e-07 -3.53992 63.546000 Cu 0.48073 0.283775 0.5 341 63.546 6.01264e-06 -3.53993 63.546000 Cu 0.65382 0.250071 5.58487e-17 300 63.546 4.95068e-07 -3.53993 63.546000 Cu 0.769189 0.269333 4.04421e-17 301 63.546 9.47298e-07 -3.53993 63.546000 Cu 0.749979 0.245256 0.5 302 63.546 8.864e-08 -3.53993 63.546000 Cu 0.673037 0.274148 0.5 303 63.546 2.02241e-06 -3.53993 63.546000 Cu 0.846131 0.240443 4.52567e-17 304 63.546 6.72245e-07 -3.53993 63.546000 Cu 0.961505 0.259701 4.42938e-17 305 63.546 4.01672e-07 -3.53993 63.546000 Cu 0.865345 0.264517 0.5 307 63.546 7.13442e-07 -3.53993 63.546000 Cu 0.98073 0.283775 0.5 328 63.546 6.01264e-06 -3.53993 63.546000 Cu 3.01334e-05 0.307844 0 327 63.546 1.58821e-05 -3.53993 63.546000 Cu 0.192281 0.298228 1.16512e-16 331 63.546 2.84966e-06 -3.53993 63.546000 Cu 0.0961523 0.303039 0.5 333 63.546 6.45098e-06 -3.53993 63.546000 Cu 0.0193516 0.331927 0.5 349 63.546 6.80951e-05 -3.53993 63.546000 Cu 0.115432 0.32713 0 351 63.546 2.75416e-05 -3.53993 63.546000 Cu 0.384573 0.288593 7.70327e-18 335 63.546 5.49032e-06 -3.53993 63.546000 Cu 0.28841 0.293414 0.5 337 63.546 7.61447e-06 -3.53993 63.546000 Cu 0.211522 0.322318 0.5 353 63.546 3.42852e-05 -3.53992 63.546000 Cu 0.307674 0.317489 9.24392e-17 355 63.546 2.59785e-05 -3.53992 63.546000 Cu 0.403852 0.312661 0.5 357 63.546 1.40002e-05 -3.53993 63.546000 Cu 0.50003 0.307844 0 359 63.546 1.58821e-05 -3.53993 63.546000 Cu 0.596152 0.303039 0.5 361 63.546 6.45098e-06 -3.53993 63.546000 Cu 0.519352 0.331927 0.5 362 63.546 6.80951e-05 -3.53993 63.546000 Cu 0.692281 0.298228 1 322 63.546 2.84966e-06 -3.53993 63.546000 Cu 0.78841 0.293414 0.5 324 63.546 7.61447e-06 -3.53993 63.546000 Cu 0.711522 0.322318 0.5 325 63.546 3.42852e-05 -3.53992 63.546000 Cu 0.615432 0.32713 5.7293e-17 360 63.546 2.75416e-05 -3.53993 63.546000 Cu 0.807674 0.317489 1.44436e-18 323 63.546 2.59785e-05 -3.53992 63.546000 Cu 0.884573 0.288593 1.49251e-17 326 63.546 5.49032e-06 -3.53993 63.546000 Cu 0.903852 0.312661 0.5 329 63.546 1.40002e-05 -3.53993 63.546000 Cu 0.0386254 0.356056 8.28101e-17 348 63.546 0.000100979 -3.53991 63.546000 Cu 0.13463 0.351257 0.5 354 63.546 0.000194401 -3.5399 63.546000 Cu 0.0576777 0.38025 0.5 371 63.546 0.000980671 -3.53975 63.546000 Cu 0.153863 0.375375 6.35519e-17 373 63.546 0.000776899 -3.53987 63.546000 Cu 0.230787 0.346401 8.04028e-17 352 63.546 0.000127326 -3.53991 63.546000 Cu 0.327041 0.341548 0.5 358 63.546 3.28536e-05 -3.53993 63.546000 Cu 0.250164 0.37045 0.5 375 63.546 0.000215226 -3.53991 63.546000 Cu 0.346486 0.365589 1.11216e-16 377 63.546 0.000440564 -3.5399 63.546000 Cu 0.42324 0.336724 1.0592e-17 356 63.546 9.07699e-05 -3.53992 63.546000 Cu 0.442622 0.360821 0.5 379 63.546 0.000321208 -3.53991 63.546000 Cu 0.538625 0.356056 0 381 63.546 0.000100979 -3.53991 63.546000 Cu 0.557678 0.38025 0.5 383 63.546 0.000980671 -3.53975 63.546000 Cu 0.653863 0.375375 0 342 63.546 0.000776899 -3.53987 63.546000 Cu 0.730787 0.346401 0 343 63.546 0.000127326 -3.53991 63.546000 Cu 0.750164 0.37045 0.5 346 63.546 0.000215226 -3.53991 63.546000 Cu 0.63463 0.351257 0.5 382 63.546 0.000194401 -3.5399 63.546000 Cu 0.846486 0.365589 1 344 63.546 0.000440564 -3.5399 63.546000 Cu 0.827041 0.341548 0.5 345 63.546 3.28536e-05 -3.53993 63.546000 Cu 0.92324 0.336724 3.03316e-17 347 63.546 9.07699e-05 -3.53992 63.546000 Cu 0.942622 0.360821 0.5 350 63.546 0.000321208 -3.53991 63.546000 Cu 0.0766535 0.404364 9.34021e-17 370 63.546 0.005071 -3.53902 63.546000 Cu 0.173396 0.399415 0.5 376 63.546 0.00175895 -3.53978 63.546000 Cu 0.0957501 0.428186 0.5 392 63.546 0.0186696 -3.53422 63.546000 Cu 0.193885 0.423254 0 394 63.546 0.0138264 -3.53767 63.546000 Cu 0.269882 0.394432 1 374 63.546 0.00231946 -3.53976 63.546000 Cu 0.365855 0.389681 0.5 380 63.546 0.00177828 -3.53978 63.546000 Cu 0.289819 0.418545 0.5 396 63.546 0.0126628 -3.53875 63.546000 Cu 0.385046 0.413906 0 398 63.546 0.00949679 -3.53831 63.546000 Cu 0.461779 0.38498 0 378 63.546 0.000644526 -3.53983 63.546000 Cu 0.480264 0.409294 0.5 400 63.546 0.00699774 -3.5386 63.546000 Cu 0.576653 0.404364 0 402 63.546 0.005071 -3.53902 63.546000 Cu 0.59575 0.428186 0.5 403 63.546 0.0186696 -3.53422 63.546000 Cu 0.693885 0.423254 1.01105e-17 363 63.546 0.0138264 -3.53767 63.546000 Cu 0.673396 0.399415 0.5 364 63.546 0.00175895 -3.53978 63.546000 Cu 0.769882 0.394432 1 365 63.546 0.00231946 -3.53976 63.546000 Cu 0.789819 0.418545 0.5 368 63.546 0.0126628 -3.53875 63.546000 Cu 0.885046 0.413906 0 366 63.546 0.00949679 -3.53831 63.546000 Cu 0.865855 0.389681 0.5 367 63.546 0.00177828 -3.53978 63.546000 Cu 0.961779 0.38498 9.48465e-17 369 63.546 0.000644526 -3.53983 63.546000 Cu 0.980264 0.409294 0.5 372 63.546 0.00699774 -3.5386 63.546000 Cu 0.115601 0.451153 7.22181e-18 391 63.546 0.0890307 -3.52399 63.546000 Cu 0.015017 0.457288 0.5 393 63.546 0.558713 -3.46537 63.546000 Cu 0.132738 0.473905 0.5 410 63.546 3.87652 -3.43327 63.546000 Cu 0.332285 0.469204 0.5 208 63.546 0.474113 -3.46689 63.546000 Cu 0.310473 0.442879 3.65905e-17 395 63.546 0.102827 -3.52306 63.546000 Cu 0.214971 0.44724 0.5 397 63.546 0.104308 -3.52529 63.546000 Cu 0.236768 0.470693 1 411 63.546 0.480042 -3.4962 63.546000 Cu 0.515017 0.457288 0.5 9 63.546 0.558713 -3.46537 63.546000 Cu 0.419079 0.46451 1 201 63.546 0.756987 -3.42121 63.546000 Cu 0.497979 0.433485 1 399 63.546 0.053989 -3.52901 63.546000 Cu 0.402874 0.438798 0.5 401 63.546 0.0681194 -3.52807 63.546000 Cu 0.632738 0.473905 0.5 1 63.546 3.87652 -3.43327 63.546000 Cu 0.615601 0.451153 1 3 63.546 0.0890307 -3.52399 63.546000 Cu 0.736768 0.470693 5.77745e-18 384 63.546 0.480042 -3.4962 63.546000 Cu 0.714971 0.44724 0.5 385 63.546 0.104308 -3.52529 63.546000 Cu 0.997979 0.433485 1.30474e-16 390 63.546 0.053989 -3.52901 63.546000 Cu 0.810473 0.442879 0 386 63.546 0.102827 -3.52306 63.546000 Cu 0.919079 0.46451 1 387 63.546 0.756987 -3.42121 63.546000 Cu 0.902874 0.438798 0.5 388 63.546 0.0681194 -3.52807 63.546000 Cu 0.832285 0.469204 0.5 389 63.546 0.474113 -3.46689 63.546000 Cu 0.0336183 0.51095 0 2 63.546 9.05449 -3.38387 63.546000 Cu 0.13285 0.516332 0.5 5 63.546 3.87611 -3.43326 63.546000 Cu 0.0334698 0.479268 0 408 63.546 9.06655 -3.38442 63.546000 Cu 0.149021 0.495131 1 409 63.546 6.64888 -3.4912 63.546000 Cu 0.2368 0.519497 0 4 63.546 0.481946 -3.49501 63.546000 Cu 0.246929 0.495075 0.5 207 63.546 1.0853 -3.51174 63.546000 Cu 0.347133 0.495061 1 412 63.546 2.02294 -3.46806 63.546000 Cu 0.33232 0.520944 0.5 6 63.546 0.475214 -3.46691 63.546000 Cu 0.446332 0.495107 0.5 7 63.546 7.69765 -3.25152 63.546000 Cu 0.533618 0.51095 3.89978e-17 10 63.546 9.05449 -3.38387 63.546000 Cu 0.53347 0.479268 0 199 63.546 9.06655 -3.38442 63.546000 Cu 0.63285 0.516332 0.5 12 63.546 3.87611 -3.43326 63.546000 Cu 0.7368 0.519497 1.39622e-17 14 63.546 0.481946 -3.49501 63.546000 Cu 0.649021 0.495131 4.52567e-17 404 63.546 6.64888 -3.4912 63.546000 Cu 0.746929 0.495075 0.5 405 63.546 1.0853 -3.51174 63.546000 Cu 0.847133 0.495061 9.00319e-17 406 63.546 2.02294 -3.46806 63.546000 Cu 0.946332 0.495107 0.5 407 63.546 7.69765 -3.25152 63.546000 Cu 0.83232 0.520944 0.5 16 63.546 0.475214 -3.46691 63.546000 Cu 0.0150975 0.532947 0.5 20 63.546 0.554533 -3.46581 63.546000 Cu 0.115666 0.539085 1 22 63.546 0.0921169 -3.52382 63.546000 Cu 0.193774 0.566982 1 23 63.546 0.0148412 -3.53737 63.546000 Cu 0.0956003 0.562045 0.5 25 63.546 0.018537 -3.53414 63.546000 Cu 0.215074 0.542976 0.5 24 63.546 0.108387 -3.52465 63.546000 Cu 0.310504 0.547298 0 26 63.546 0.102465 -3.52245 63.546000 Cu 0.419057 0.525654 0 8 63.546 0.763411 -3.42159 63.546000 Cu 0.515097 0.532947 0.5 13 63.546 0.554533 -3.46581 63.546000 Cu 0.402737 0.551337 0.5 29 63.546 0.0731055 -3.52777 63.546000 Cu 0.49774 0.556717 2.40727e-18 30 63.546 0.0569558 -3.52893 63.546000 Cu 0.5956 0.562045 0.5 32 63.546 0.018537 -3.53414 63.546000 Cu 0.615666 0.539085 1.64176e-16 11 63.546 0.0921169 -3.52382 63.546000 Cu 0.715074 0.542976 0.5 17 63.546 0.108387 -3.52465 63.546000 Cu 0.693774 0.566982 0 34 63.546 0.0148412 -3.53737 63.546000 Cu 0.99774 0.556717 1 19 63.546 0.0569558 -3.52893 63.546000 Cu 0.810504 0.547298 1 15 63.546 0.102465 -3.52245 63.546000 Cu 0.919057 0.525654 2.26283e-17 18 63.546 0.763411 -3.42159 63.546000 Cu 0.902737 0.551337 0.5 21 63.546 0.0731055 -3.52777 63.546000 Cu 0.0763697 0.585838 3.75534e-17 42 63.546 0.00573698 -3.53896 63.546000 Cu 0.153608 0.614848 1 43 63.546 0.000813151 -3.53984 63.546000 Cu 0.173179 0.590819 0.5 44 63.546 0.00181231 -3.53976 63.546000 Cu 0.0573863 0.609955 0.5 45 63.546 0.00122453 -3.53972 63.546000 Cu 0.289691 0.571679 0.5 27 63.546 0.0144505 -3.53852 63.546000 Cu 0.38481 0.576278 2.31098e-17 28 63.546 0.00984332 -3.53806 63.546000 Cu 0.269662 0.59579 6.11447e-17 46 63.546 0.0025238 -3.53973 63.546000 Cu 0.365628 0.600534 0.5 49 63.546 0.00191681 -3.53975 63.546000 Cu 0.57637 0.585838 8.18472e-18 31 63.546 0.00573698 -3.53896 63.546000 Cu 0.47996 0.5809 0.5 33 63.546 0.00800708 -3.53848 63.546000 Cu 0.461498 0.60522 0 50 63.546 0.000631576 -3.53982 63.546000 Cu 0.557386 0.609955 0.5 52 63.546 0.00122453 -3.53972 63.546000 Cu 0.769662 0.59579 0 35 63.546 0.0025238 -3.53973 63.546000 Cu 0.789691 0.571679 0.5 36 63.546 0.0144505 -3.53852 63.546000 Cu 0.673179 0.590819 0.5 37 63.546 0.00181231 -3.53976 63.546000 Cu 0.653608 0.614848 0 54 63.546 0.000813151 -3.53984 63.546000 Cu 0.88481 0.576278 7.70327e-18 38 63.546 0.00984332 -3.53806 63.546000 Cu 0.961498 0.60522 5.97003e-17 39 63.546 0.000631576 -3.53982 63.546000 Cu 0.97996 0.5809 0.5 40 63.546 0.00800708 -3.53848 63.546000 Cu 0.865628 0.600534 0.5 41 63.546 0.00191681 -3.53975 63.546000 Cu 0.0383494 0.634162 0 62 63.546 8.44405e-05 -3.53989 63.546000 Cu 0.115232 0.663132 7.07738e-17 63 63.546 2.97792e-05 -3.53991 63.546000 Cu 0.134373 0.638973 0.5 64 63.546 0.000286542 -3.53987 63.546000 Cu 0.0191612 0.658332 0.5 65 63.546 4.0298e-05 -3.53992 63.546000 Cu 0.249927 0.619789 0.5 47 63.546 0.000254923 -3.53991 63.546000 Cu 0.346251 0.624648 0 48 63.546 0.000574261 -3.53991 63.546000 Cu 0.230561 0.643843 1.15549e-16 66 63.546 0.000169773 -3.5399 63.546000 Cu 0.326846 0.648712 0.5 68 63.546 6.10822e-05 -3.53993 63.546000 Cu 0.538349 0.634162 3.56276e-17 51 63.546 8.44405e-05 -3.53989 63.546000 Cu 0.442342 0.629402 0.5 53 63.546 0.00023388 -3.5399 63.546000 Cu 0.423063 0.653539 1 70 63.546 0.000127275 -3.53993 63.546000 Cu 0.519161 0.658332 0.5 72 63.546 4.0298e-05 -3.53992 63.546000 Cu 0.730561 0.643843 0 55 63.546 0.000169773 -3.5399 63.546000 Cu 0.749927 0.619789 0.5 56 63.546 0.000254923 -3.53991 63.546000 Cu 0.634373 0.638973 0.5 57 63.546 0.000286542 -3.53987 63.546000 Cu 0.615232 0.663132 0 74 63.546 2.97792e-05 -3.53991 63.546000 Cu 0.846251 0.624648 7.70327e-18 58 63.546 0.000574261 -3.53991 63.546000 Cu 0.923063 0.653539 0 59 63.546 0.000127275 -3.53993 63.546000 Cu 0.942342 0.629402 0.5 60 63.546 0.00023388 -3.5399 63.546000 Cu 0.826846 0.648712 0.5 61 63.546 6.10822e-05 -3.53993 63.546000 Cu 0.076897 0.711427 1.01587e-16 83 63.546 4.10909e-06 -3.53992 63.546000 Cu 0.0960832 0.687284 0.5 84 63.546 6.16629e-06 -3.53992 63.546000 Cu 0.192204 0.692102 9.9661e-17 86 63.546 7.3041e-06 -3.53991 63.546000 Cu 0.30755 0.672805 0 67 63.546 3.6799e-05 -3.53992 63.546000 Cu 0.211368 0.66796 0.5 69 63.546 5.65332e-05 -3.5399 63.546000 Cu 0.288359 0.696932 0.5 88 63.546 1.33259e-05 -3.53991 63.546000 Cu 0.384542 0.701767 2.40727e-18 90 63.546 7.13045e-06 -3.53992 63.546000 Cu 0.499948 0.68247 0 71 63.546 2.25347e-05 -3.53993 63.546000 Cu 0.403772 0.677646 0.5 73 63.546 1.61853e-05 -3.53993 63.546000 Cu 0.596083 0.687284 0.5 77 63.546 6.16629e-06 -3.53992 63.546000 Cu 0.480725 0.7066 0.5 92 63.546 3.76026e-06 -3.53992 63.546000 Cu 0.576897 0.711427 1.44436e-18 94 63.546 4.10909e-06 -3.53992 63.546000 Cu 0.692204 0.692102 1 75 63.546 7.3041e-06 -3.53991 63.546000 Cu 0.711368 0.66796 0.5 76 63.546 5.65332e-05 -3.5399 63.546000 Cu 0.788359 0.696932 0.5 81 63.546 1.33259e-05 -3.53991 63.546000 Cu 0.999948 0.68247 0 82 63.546 2.25347e-05 -3.53993 63.546000 Cu 0.80755 0.672805 1.39622e-17 78 63.546 3.6799e-05 -3.53992 63.546000 Cu 0.884542 0.701767 2.45542e-17 79 63.546 7.13045e-06 -3.53992 63.546000 Cu 0.903772 0.677646 0.5 80 63.546 1.61853e-05 -3.53993 63.546000 Cu 0.980725 0.7066 0.5 85 63.546 3.76026e-06 -3.53992 63.546000 Cu 0.173045 0.71625 0.5 89 63.546 1.13284e-06 -3.53992 63.546000 Cu 0.0385209 0.759708 0 103 63.546 3.93488e-07 -3.53992 63.546000 Cu 0.0577026 0.735567 0.5 104 63.546 4.68944e-07 -3.53992 63.546000 Cu 0.153873 0.740397 2.74429e-17 106 63.546 1.36012e-06 -3.53991 63.546000 Cu 0.269201 0.721076 3.1776e-17 87 63.546 1.09392e-06 -3.53991 63.546000 Cu 0.365358 0.725905 0.5 93 63.546 2.37412e-06 -3.53991 63.546000 Cu 0.250029 0.745223 0.5 108 63.546 8.07022e-08 -3.53991 63.546000 Cu 0.346191 0.750051 7.22181e-18 111 63.546 7.59032e-07 -3.53991 63.546000 Cu 0.461534 0.730737 0 91 63.546 5.13883e-07 -3.53992 63.546000 Cu 0.557703 0.735567 0.5 97 63.546 4.68944e-07 -3.53992 63.546000 Cu 0.442354 0.754879 0.5 113 63.546 9.02131e-07 -3.53991 63.546000 Cu 0.538521 0.759708 1 114 63.546 3.93488e-07 -3.53992 63.546000 Cu 0.653873 0.740397 1.324e-16 95 63.546 1.36012e-06 -3.53991 63.546000 Cu 0.673045 0.71625 0.5 96 63.546 1.13284e-06 -3.53992 63.546000 Cu 0.769201 0.721076 1.11697e-16 98 63.546 1.09392e-06 -3.53991 63.546000 Cu 0.750029 0.745223 0.5 101 63.546 8.07022e-08 -3.53991 63.546000 Cu 0.846191 0.750051 0 99 63.546 7.59032e-07 -3.53991 63.546000 Cu 0.865358 0.725905 0.5 100 63.546 2.37412e-06 -3.53991 63.546000 Cu 0.961534 0.730737 0 102 63.546 5.13883e-07 -3.53992 63.546000 Cu 0.942354 0.754879 0.5 105 63.546 9.02131e-07 -3.53991 63.546000 Cu 0.134692 0.764539 0.5 109 63.546 1.1367e-06 -3.53991 63.546000 Cu 7.99937e-05 0.807978 6.01818e-17 123 63.546 2.06193e-05 -3.53993 63.546000 Cu 0.0193248 0.783847 0.5 124 63.546 4.2688e-06 -3.53992 63.546000 Cu 0.115496 0.788678 1.01587e-16 126 63.546 4.94335e-06 -3.53992 63.546000 Cu 0.230856 0.76937 0 107 63.546 1.34243e-06 -3.53991 63.546000 Cu 0.327011 0.774197 0.5 110 63.546 9.35705e-07 -3.53991 63.546000 Cu 0.211677 0.793513 0.5 128 63.546 9.9744e-06 -3.53991 63.546000 Cu 0.307828 0.798343 1.82953e-17 130 63.546 5.71444e-06 -3.53991 63.546000 Cu 0.423155 0.779019 1 112 63.546 3.60509e-06 -3.53992 63.546000 Cu 0.519325 0.783847 0.5 117 63.546 4.2688e-06 -3.53992 63.546000 Cu 0.403958 0.803165 0.5 133 63.546 5.00519e-06 -3.53992 63.546000 Cu 0.50008 0.807978 1 134 63.546 2.06193e-05 -3.53993 63.546000 Cu 0.615496 0.788678 1 115 63.546 4.94335e-06 -3.53992 63.546000 Cu 0.634692 0.764539 0.5 116 63.546 1.1367e-06 -3.53991 63.546000 Cu 0.730856 0.76937 0 118 63.546 1.34243e-06 -3.53991 63.546000 Cu 0.711677 0.793513 0.5 121 63.546 9.9744e-06 -3.53991 63.546000 Cu 0.807828 0.798343 0 119 63.546 5.71444e-06 -3.53991 63.546000 Cu 0.827011 0.774197 0.5 120 63.546 9.35705e-07 -3.53991 63.546000 Cu 0.923155 0.779019 9.62908e-19 122 63.546 3.60509e-06 -3.53992 63.546000 Cu 0.903958 0.803165 0.5 125 63.546 5.00519e-06 -3.53992 63.546000 Cu 0.192469 0.817641 1 127 63.546 3.09335e-05 -3.53992 63.546000 Cu 0.0962613 0.812802 0.5 129 63.546 1.49154e-05 -3.53994 63.546000 Cu 0.0769616 0.83691 0 146 63.546 0.000109428 -3.53993 63.546000 Cu 0.17317 0.841735 0.5 148 63.546 6.0002e-05 -3.53993 63.546000 Cu 0.288651 0.822485 0.5 131 63.546 5.05599e-05 -3.53991 63.546000 Cu 0.384776 0.827314 0 132 63.546 2.54232e-05 -3.53991 63.546000 Cu 0.269451 0.846602 3.51462e-17 150 63.546 0.000152129 -3.53991 63.546000 Cu 0.365631 0.851469 0.5 153 63.546 0.00023722 -3.53987 63.546000 Cu 0.576962 0.83691 4.42938e-17 135 63.546 0.000109428 -3.53993 63.546000 Cu 0.596261 0.812802 0.5 136 63.546 1.49154e-05 -3.53994 63.546000 Cu 0.480853 0.832116 0.5 137 63.546 3.68555e-05 -3.53993 63.546000 Cu 0.461656 0.856285 1.13142e-16 154 63.546 8.7196e-05 -3.53989 63.546000 Cu 0.692469 0.817641 3.27389e-17 138 63.546 3.09335e-05 -3.53992 63.546000 Cu 0.769451 0.846602 0 139 63.546 0.000152129 -3.53991 63.546000 Cu 0.788651 0.822485 0.5 140 63.546 5.05599e-05 -3.53991 63.546000 Cu 0.67317 0.841735 0.5 141 63.546 6.0002e-05 -3.53993 63.546000 Cu 0.884776 0.827314 5.296e-17 142 63.546 2.54232e-05 -3.53991 63.546000 Cu 0.961656 0.856285 3.85163e-18 143 63.546 8.7196e-05 -3.53989 63.546000 Cu 0.980853 0.832116 0.5 144 63.546 3.68555e-05 -3.53993 63.546000 Cu 0.865631 0.851469 0.5 145 63.546 0.00023722 -3.53987 63.546000 Cu 0.153758 0.865805 1.10734e-17 147 63.546 0.000514976 -3.53991 63.546000 Cu 0.0576492 0.861046 0.5 149 63.546 0.000232101 -3.53991 63.546000 Cu 0.0384718 0.885229 0 166 63.546 0.000639334 -3.53982 63.546000 Cu 0.134375 0.889925 0.5 168 63.546 0.00178587 -3.53976 63.546000 Cu 0.250078 0.870663 0.5 151 63.546 0.000253517 -3.53992 63.546000 Cu 0.346396 0.875598 1 152 63.546 0.000785031 -3.53984 63.546000 Cu 0.230318 0.894666 0 170 63.546 0.00251349 -3.53975 63.546000 Cu 0.326821 0.899633 0.5 172 63.546 0.00167278 -3.53977 63.546000 Cu 0.538472 0.885229 0 155 63.546 0.000639334 -3.53982 63.546000 Cu 0.557649 0.861046 0.5 156 63.546 0.000232101 -3.53991 63.546000 Cu 0.442593 0.880491 0.5 157 63.546 0.00115822 -3.53972 63.546000 Cu 0.423587 0.904618 1 174 63.546 0.0055275 -3.53897 63.546000 Cu 0.653758 0.865805 1.10734e-17 158 63.546 0.000514976 -3.53991 63.546000 Cu 0.730318 0.894666 1 159 63.546 0.00251349 -3.53975 63.546000 Cu 0.750078 0.870663 0.5 160 63.546 0.000253517 -3.53992 63.546000 Cu 0.634375 0.889925 0.5 161 63.546 0.00178587 -3.53976 63.546000 Cu 0.846396 0.875598 0 162 63.546 0.000785031 -3.53984 63.546000 Cu 0.923587 0.904618 1 163 63.546 0.0055275 -3.53897 63.546000 Cu 0.942593 0.880491 0.5 164 63.546 0.00115822 -3.53972 63.546000 Cu 0.826821 0.899633 0.5 165 63.546 0.00167278 -3.53977 63.546000 Cu 0.115183 0.914179 4.2368e-17 167 63.546 0.00989703 -3.53808 63.546000 Cu 0.0200067 0.90955 0.5 169 63.546 0.00762613 -3.53847 63.546000 Cu 0.00221501 0.933745 1.45399e-16 186 63.546 0.0563686 -3.52893 63.546000 Cu 0.0972292 0.939129 0.5 188 63.546 0.0726074 -3.52775 63.546000 Cu 0.189508 0.943172 1 190 63.546 0.102451 -3.52246 63.546000 Cu 0.306225 0.923495 4.33309e-18 171 63.546 0.0145906 -3.53743 63.546000 Cu 0.210302 0.918791 0.5 173 63.546 0.0140008 -3.53854 63.546000 Cu 0.284928 0.947499 0.5 192 63.546 0.108605 -3.5247 63.546000 Cu 0.384352 0.951388 4.81454e-19 194 63.546 0.0919554 -3.52381 63.546000 Cu 0.502215 0.933745 1.92582e-17 175 63.546 0.0563686 -3.52893 63.546000 Cu 0.520007 0.90955 0.5 176 63.546 0.00762613 -3.53847 63.546000 Cu 0.404376 0.928426 0.5 177 63.546 0.0186034 -3.53417 63.546000 Cu 0.597229 0.939129 0.5 181 63.546 0.0726074 -3.52775 63.546000 Cu 0.615183 0.914179 0 178 63.546 0.00989703 -3.53808 63.546000 Cu 0.689508 0.943172 1.34807e-17 179 63.546 0.102451 -3.52246 63.546000 Cu 0.710302 0.918791 0.5 180 63.546 0.0140008 -3.53854 63.546000 Cu 0.784928 0.947499 0.5 185 63.546 0.108605 -3.5247 63.546000 Cu 0.806225 0.923495 1.44436e-17 182 63.546 0.0145906 -3.53743 63.546000 Cu 0.884352 0.951388 1.27104e-16 183 63.546 0.0919554 -3.52381 63.546000 Cu 0.904376 0.928426 0.5 184 63.546 0.0186034 -3.53417 63.546000 Cu 0.152854 0.995416 0 216 63.546 2.02428 -3.46774 63.546000 Cu 0.053631 0.995374 0.5 217 63.546 7.71204 -3.25082 63.546000 Cu 0.0809201 0.964811 0 187 63.546 0.763114 -3.4211 63.546000 Cu 0.167669 0.969534 0.5 193 63.546 0.476055 -3.46677 63.546000 Cu 0.263148 0.970982 4.38123e-17 191 63.546 0.485854 -3.49505 63.546000 Cu 0.367172 0.974144 0.5 197 63.546 3.88201 -3.43337 63.546000 Cu 0.253075 0.995405 0.5 209 63.546 1.08314 -3.51177 63.546000 Cu 0.350942 0.995361 2.45542e-17 210 63.546 6.6566 -3.49149 63.546000 Cu 0.553631 0.995374 0.5 236 63.546 7.71204 -3.25082 63.546000 Cu 0.466444 0.979523 0 195 63.546 9.06081 -3.3847 63.546000 Cu 0.484873 0.957521 0.5 196 63.546 0.555375 -3.46585 63.546000 Cu 0.58092 0.964811 1 198 63.546 0.763114 -3.4211 63.546000 Cu 0.652854 0.995416 1 211 63.546 2.02428 -3.46774 63.546000 Cu 0.667669 0.969534 0.5 200 63.546 0.476055 -3.46677 63.546000 Cu 0.763148 0.970982 3.99607e-17 202 63.546 0.485854 -3.49505 63.546000 Cu 0.753075 0.995405 0.5 205 63.546 1.08314 -3.51177 63.546000 Cu 0.984873 0.957521 0.5 189 63.546 0.555375 -3.46585 63.546000 Cu 0.850942 0.995361 4.81454e-17 203 63.546 6.6566 -3.49149 63.546000 Cu 0.867172 0.974144 0.5 204 63.546 3.88201 -3.43337 63.546000 Cu 0.966444 0.979523 1 206 63.546 9.06081 -3.3847