Number of particles = 404 A = 1 Angstrom (basic length-scale) H0(1,1) = 14.846 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 89.3916 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61073 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 0.0605642 0.0123456 5.75322e-17 221 63.546 8.64643 -3.88116 63.546000 Cu 0.209209 0.0332771 1.51878e-16 222 63.546 0.791694 -3.37292 63.546000 Cu 0.183677 0.0123371 0.5 223 63.546 4.56492 -3.55051 63.546000 Cu 0.101872 0.0373427 0.5 224 63.546 0.514914 -3.30695 63.546000 Cu 0.308611 0.0123508 1.18608e-16 225 63.546 8.33388 -2.77987 63.546000 Cu 0.458133 0.0252047 1 226 63.546 9.19258 -3.02841 63.546000 Cu 0.338605 0.0291271 0.5 228 63.546 2.84329 -3.36206 63.546000 Cu 0.246239 0.0531543 0.5 241 63.546 0.0500526 -3.46963 63.546000 Cu 0.362851 0.0485137 1.77701e-16 243 63.546 0.112716 -3.46493 63.546000 Cu 0.488024 0.0433099 0.5 245 63.546 0.544436 -3.36496 63.546000 Cu 0.130905 0.0583594 7.87315e-17 239 63.546 0.0721379 -3.41952 63.546000 Cu 0.683677 0.0123371 1.2065e-16 208 63.546 4.56492 -3.55051 63.546000 Cu 0.560564 0.0123456 0.5 209 63.546 8.64643 -3.88116 63.546000 Cu 0.808611 0.0123508 0.5 211 63.546 8.33388 -2.77987 63.546000 Cu 0.601872 0.0373427 1 213 63.546 0.514914 -3.30695 63.546000 Cu 0.746239 0.0531543 1.60766e-16 214 63.546 0.0500526 -3.46963 63.546000 Cu 0.709209 0.0332771 0.5 215 63.546 0.791694 -3.37292 63.546000 Cu 0.838605 0.0291271 2.77932e-16 217 63.546 2.84329 -3.36206 63.546000 Cu 0.988024 0.0433099 1.79443e-16 218 63.546 0.544436 -3.36496 63.546000 Cu 0.958133 0.0252047 0.5 219 63.546 9.19258 -3.02841 63.546000 Cu 0.862851 0.0485137 0.5 220 63.546 0.112716 -3.46493 63.546000 Cu 0.630905 0.0583594 0.5 216 63.546 0.0721379 -3.41952 63.546000 Cu 0.0424456 0.0827536 1.2107e-16 236 63.546 0.00203505 -3.48943 63.546000 Cu 0.277649 0.0730575 2.41659e-16 240 63.546 0.00672388 -3.47309 63.546000 Cu 0.160081 0.0779914 0.5 242 63.546 0.00533999 -3.47668 63.546000 Cu 0.395576 0.0677858 0.5 246 63.546 0.016865 -3.50515 63.546000 Cu 0.072294 0.102507 0.5 255 63.546 0.000976426 -3.4902 63.546000 Cu 0.189927 0.0976112 1.20349e-16 257 63.546 0.000853398 -3.49123 63.546000 Cu 0.337682 0.112239 1 258 63.546 0.000924529 -3.49731 63.546000 Cu 0.308024 0.0925803 0.5 259 63.546 0.00147186 -3.49418 63.546000 Cu 0.425539 0.0875407 1.38426e-16 261 63.546 0.00352866 -3.49786 63.546000 Cu 0.455003 0.107362 0.5 262 63.546 0.000200667 -3.49228 63.546000 Cu 0.0136155 0.0628133 0.5 237 63.546 0.0268791 -3.49824 63.546000 Cu 0.219933 0.117203 0.5 260 63.546 0.000221352 -3.49647 63.546000 Cu 0.513615 0.0628133 2.4208e-16 244 63.546 0.0268791 -3.49824 63.546000 Cu 0.572294 0.102507 5.42292e-17 229 63.546 0.000976426 -3.4902 63.546000 Cu 0.542446 0.0827536 0.5 230 63.546 0.00203505 -3.48943 63.546000 Cu 0.660081 0.0779914 5.75322e-17 231 63.546 0.00533999 -3.47668 63.546000 Cu 0.808024 0.0925803 1.85448e-16 232 63.546 0.00147186 -3.49418 63.546000 Cu 0.777649 0.0730575 0.5 233 63.546 0.00672388 -3.47309 63.546000 Cu 0.689927 0.0976112 0.5 234 63.546 0.000853398 -3.49123 63.546000 Cu 0.895576 0.0677858 6.01746e-17 235 63.546 0.016865 -3.50515 63.546000 Cu 0.925539 0.0875407 0.5 238 63.546 0.00352866 -3.49786 63.546000 Cu 0.837682 0.112239 0.5 251 63.546 0.000924529 -3.49731 63.546000 Cu 0.955003 0.107362 1.22631e-16 253 63.546 0.000200667 -3.49228 63.546000 Cu 0.719933 0.117203 6.53994e-17 249 63.546 0.000221352 -3.49647 63.546000 Cu 0.10214 0.122181 1.547e-16 254 63.546 0.000281938 -3.49273 63.546000 Cu 0.161516 0.161487 2.78953e-16 272 63.546 5.84038e-05 -3.49568 63.546000 Cu 0.131965 0.141824 0.5 273 63.546 6.83753e-05 -3.49546 63.546000 Cu 0.0438138 0.166428 0.5 274 63.546 9.29923e-06 -3.49494 63.546000 Cu 0.249605 0.136867 2.4268e-16 275 63.546 0.000262826 -3.49613 63.546000 Cu 0.39659 0.151675 2.12413e-16 276 63.546 7.20119e-05 -3.49317 63.546000 Cu 0.367104 0.131965 0.5 277 63.546 4.04192e-05 -3.4946 63.546000 Cu 0.279118 0.156568 0.5 278 63.546 3.95328e-05 -3.49421 63.546000 Cu 0.484612 0.127096 1.84367e-17 279 63.546 0.000297793 -3.49236 63.546000 Cu 0.42617 0.171354 0.5 295 63.546 3.61677e-05 -3.49364 63.546000 Cu 0.0142153 0.146769 2.11332e-16 271 63.546 0.000101915 -3.49401 63.546000 Cu 0.308584 0.176262 2.62138e-16 293 63.546 1.23822e-05 -3.49374 63.546000 Cu 0.514215 0.146769 0.5 280 63.546 0.000101915 -3.49401 63.546000 Cu 0.631965 0.141824 1.08398e-16 247 63.546 6.83753e-05 -3.49546 63.546000 Cu 0.60214 0.122181 0.5 248 63.546 0.000281938 -3.49273 63.546000 Cu 0.867104 0.131965 7.80709e-19 250 63.546 4.04192e-05 -3.4946 63.546000 Cu 0.749605 0.136867 0.5 252 63.546 0.000262826 -3.49613 63.546000 Cu 0.984612 0.127096 0.5 256 63.546 0.000297793 -3.49236 63.546000 Cu 0.543814 0.166428 2.21001e-16 263 63.546 9.29923e-06 -3.49494 63.546000 Cu 0.661516 0.161487 0.5 265 63.546 5.84038e-05 -3.49568 63.546000 Cu 0.779118 0.156568 1.38125e-18 267 63.546 3.95328e-05 -3.49421 63.546000 Cu 0.92617 0.171354 1.22031e-16 268 63.546 3.61677e-05 -3.49364 63.546000 Cu 0.89659 0.151675 0.5 269 63.546 7.20119e-05 -3.49317 63.546000 Cu 0.808584 0.176262 0.5 270 63.546 1.23822e-05 -3.49374 63.546000 Cu 0.073428 0.18609 3.94018e-16 289 63.546 2.10936e-05 -3.49533 63.546000 Cu 0.220599 0.200854 1.74098e-16 290 63.546 2.74284e-06 -3.49418 63.546000 Cu 0.19101 0.181169 0.5 291 63.546 1.81272e-05 -3.4948 63.546000 Cu 0.103 0.205772 0.5 292 63.546 4.19339e-06 -3.49498 63.546000 Cu 0.455769 0.191023 4.20382e-19 294 63.546 7.13807e-06 -3.49479 63.546000 Cu 0.338144 0.195942 0.5 296 63.546 1.39758e-05 -3.49398 63.546000 Cu 0.132608 0.225447 6.17361e-17 307 63.546 5.12346e-06 -3.49394 63.546000 Cu 0.250169 0.220533 0.5 309 63.546 6.21813e-06 -3.49369 63.546000 Cu 0.367792 0.215617 1.22511e-16 311 63.546 3.1355e-06 -3.4945 63.546000 Cu 0.485384 0.210693 0.5 313 63.546 3.95007e-06 -3.49511 63.546000 Cu 0.0150343 0.230373 0.5 305 63.546 6.87531e-06 -3.49489 63.546000 Cu 0.397401 0.235294 0.5 314 63.546 3.33894e-06 -3.49486 63.546000 Cu 0.515034 0.230373 1.26115e-18 312 63.546 6.87531e-06 -3.49489 63.546000 Cu 0.69101 0.181169 5.84931e-17 264 63.546 1.81272e-05 -3.4948 63.546000 Cu 0.573428 0.18609 0.5 266 63.546 2.10936e-05 -3.49533 63.546000 Cu 0.603 0.205772 1.68153e-18 281 63.546 4.19339e-06 -3.49498 63.546000 Cu 0.750169 0.220533 3.65732e-17 282 63.546 6.21813e-06 -3.49369 63.546000 Cu 0.720599 0.200854 0.5 283 63.546 2.74284e-06 -3.49418 63.546000 Cu 0.632608 0.225447 0.5 284 63.546 5.12346e-06 -3.49394 63.546000 Cu 0.838144 0.195942 1 285 63.546 1.39758e-05 -3.49398 63.546000 Cu 0.985384 0.210693 2.48025e-17 286 63.546 3.95007e-06 -3.49511 63.546000 Cu 0.955769 0.191023 0.5 287 63.546 7.13807e-06 -3.49479 63.546000 Cu 0.867792 0.215617 0.5 288 63.546 3.1355e-06 -3.4945 63.546000 Cu 0.897401 0.235294 1 303 63.546 3.33894e-06 -3.49486 63.546000 Cu 0.0446066 0.250048 6.84622e-17 304 63.546 9.99119e-06 -3.49487 63.546000 Cu 0.279811 0.240209 9.38052e-17 308 63.546 8.88833e-06 -3.49428 63.546000 Cu 0.162262 0.245128 0.5 310 63.546 2.97098e-05 -3.4943 63.546000 Cu 0.103783 0.289429 1 322 63.546 1.61352e-05 -3.4947 63.546000 Cu 0.0741822 0.269737 0.5 323 63.546 6.55981e-06 -3.495 63.546000 Cu 0.191753 0.264814 1.13263e-16 325 63.546 1.8313e-05 -3.49508 63.546000 Cu 0.338895 0.279592 2.47425e-17 326 63.546 2.56176e-05 -3.49524 63.546000 Cu 0.309411 0.259903 0.5 327 63.546 1.50792e-05 -3.49514 63.546000 Cu 0.221339 0.284517 0.5 328 63.546 7.17549e-06 -3.49476 63.546000 Cu 0.426989 0.254978 1 329 63.546 3.54e-06 -3.49498 63.546000 Cu 0.456568 0.274665 0.5 330 63.546 2.72537e-06 -3.49532 63.546000 Cu 0.574182 0.269737 9.89098e-17 297 63.546 6.55981e-06 -3.495 63.546000 Cu 0.544607 0.250048 0.5 298 63.546 9.99119e-06 -3.49487 63.546000 Cu 0.662262 0.245128 1.24013e-16 299 63.546 2.97098e-05 -3.4943 63.546000 Cu 0.809411 0.259903 5.75322e-17 300 63.546 1.50792e-05 -3.49514 63.546000 Cu 0.779811 0.240209 0.5 301 63.546 8.88833e-06 -3.49428 63.546000 Cu 0.691753 0.264814 0.5 302 63.546 1.8313e-05 -3.49508 63.546000 Cu 0.926989 0.254978 0.5 306 63.546 3.54e-06 -3.49498 63.546000 Cu 0.603783 0.289429 0.5 316 63.546 1.61352e-05 -3.4947 63.546000 Cu 0.721339 0.284517 1.56742e-16 317 63.546 7.17549e-06 -3.49476 63.546000 Cu 0.838895 0.279592 0.5 319 63.546 2.56176e-05 -3.49524 63.546000 Cu 0.956568 0.274665 1.2083e-16 321 63.546 2.72537e-06 -3.49532 63.546000 Cu 0.162738 0.328814 2.47905e-16 340 63.546 1.84927e-06 -3.4944 63.546000 Cu 0.133277 0.30912 0.5 341 63.546 4.9893e-06 -3.49416 63.546000 Cu 0.0451276 0.33373 0.5 342 63.546 8.6111e-06 -3.49461 63.546000 Cu 0.250915 0.30421 1.85088e-16 343 63.546 2.99332e-05 -3.49431 63.546000 Cu 0.398067 0.318968 2.11392e-17 344 63.546 2.41152e-05 -3.49523 63.546000 Cu 0.368522 0.299281 0.5 345 63.546 8.08633e-06 -3.49512 63.546000 Cu 0.280351 0.323892 0.5 346 63.546 9.15447e-06 -3.495 63.546000 Cu 0.486144 0.294347 2.25805e-17 347 63.546 1.46952e-05 -3.49522 63.546000 Cu 0.192202 0.348504 0.5 359 63.546 1.63591e-05 -3.49478 63.546000 Cu 0.309846 0.343584 5.75322e-17 361 63.546 1.62848e-05 -3.49493 63.546000 Cu 0.427441 0.338651 0.5 363 63.546 8.35496e-06 -3.49472 63.546000 Cu 0.0156829 0.314038 1.24313e-17 339 63.546 1.57383e-05 -3.49473 63.546000 Cu 0.515683 0.314038 0.5 348 63.546 1.57383e-05 -3.49473 63.546000 Cu 0.633277 0.30912 1.28216e-16 315 63.546 4.9893e-06 -3.49416 63.546000 Cu 0.868522 0.299281 1.9878e-17 318 63.546 8.08633e-06 -3.49512 63.546000 Cu 0.750915 0.30421 0.5 320 63.546 2.99332e-05 -3.49431 63.546000 Cu 0.986144 0.294347 0.5 324 63.546 1.46952e-05 -3.49522 63.546000 Cu 0.545128 0.33373 1.08879e-16 331 63.546 8.6111e-06 -3.49461 63.546000 Cu 0.692202 0.348504 7.15249e-17 332 63.546 1.63591e-05 -3.49478 63.546000 Cu 0.662738 0.328814 0.5 333 63.546 1.84927e-06 -3.4944 63.546000 Cu 0.780351 0.323892 5.58507e-17 335 63.546 9.15447e-06 -3.495 63.546000 Cu 0.927441 0.338651 2.94027e-16 336 63.546 8.35496e-06 -3.49472 63.546000 Cu 0.898067 0.318968 0.5 337 63.546 2.41152e-05 -3.49523 63.546000 Cu 0.809846 0.343584 0.5 338 63.546 1.62848e-05 -3.49493 63.546000 Cu 0.0745226 0.353413 2.4196e-16 357 63.546 7.19203e-06 -3.49427 63.546000 Cu 0.221532 0.368191 5.75322e-17 358 63.546 2.65334e-05 -3.49451 63.546000 Cu 0.103941 0.373101 0.5 360 63.546 1.06478e-05 -3.49318 63.546000 Cu 0.456883 0.358334 6.00545e-20 362 63.546 4.95542e-06 -3.49409 63.546000 Cu 0.339255 0.363265 0.5 364 63.546 1.42903e-05 -3.49475 63.546000 Cu 0.133381 0.392798 1.26115e-18 375 63.546 4.28161e-05 -3.49404 63.546000 Cu 0.280527 0.40756 3.00273e-18 376 63.546 0.000187167 -3.4963 63.546000 Cu 0.250923 0.38788 0.5 377 63.546 0.000109241 -3.49564 63.546000 Cu 0.368586 0.38294 1.20109e-18 379 63.546 7.11918e-05 -3.495 63.546000 Cu 0.486314 0.378012 0.5 381 63.546 2.95098e-05 -3.49355 63.546000 Cu 0.398222 0.402601 0.5 382 63.546 0.000171766 -3.49331 63.546000 Cu 0.0158377 0.39769 0.5 373 63.546 0.000133575 -3.49274 63.546000 Cu 0.515838 0.39769 6.13757e-17 380 63.546 0.000133575 -3.49274 63.546000 Cu 0.574523 0.353413 0.5 334 63.546 7.19203e-06 -3.49427 63.546000 Cu 0.603941 0.373101 5.75322e-17 349 63.546 1.06478e-05 -3.49318 63.546000 Cu 0.750923 0.38788 1 350 63.546 0.000109241 -3.49564 63.546000 Cu 0.721532 0.368191 0.5 351 63.546 2.65334e-05 -3.49451 63.546000 Cu 0.633381 0.392798 0.5 352 63.546 4.28161e-05 -3.49404 63.546000 Cu 0.839255 0.363265 1.92835e-16 353 63.546 1.42903e-05 -3.49475 63.546000 Cu 0.986314 0.378012 2.42921e-16 354 63.546 2.95098e-05 -3.49355 63.546000 Cu 0.956883 0.358334 0.5 355 63.546 4.95542e-06 -3.49409 63.546000 Cu 0.868586 0.38294 0.5 356 63.546 7.11918e-05 -3.495 63.546000 Cu 0.780527 0.40756 0.5 369 63.546 0.000187167 -3.4963 63.546000 Cu 0.898222 0.402601 6.86423e-17 371 63.546 0.000171766 -3.49331 63.546000 Cu 0.486794 0.461955 7.66896e-17 2 63.546 0.0257741 -3.49761 63.546000 Cu 0.369478 0.466424 0.5 8 63.546 0.0715588 -3.41988 63.546000 Cu 0.0454979 0.417406 1.14104e-18 372 63.546 0.000236293 -3.49273 63.546000 Cu 0.162878 0.412519 0.5 378 63.546 0.00049657 -3.49715 63.546000 Cu 0.104857 0.456985 3.65071e-16 390 63.546 0.0164982 -3.50464 63.546000 Cu 0.0749784 0.437219 0.5 391 63.546 0.00275511 -3.4979 63.546000 Cu 0.192455 0.432189 1.62147e-18 393 63.546 0.0013736 -3.4937 63.546000 Cu 0.340312 0.446795 7.20654e-19 394 63.546 0.00486722 -3.47626 63.546000 Cu 0.31051 0.427178 0.5 395 63.546 0.000580256 -3.49084 63.546000 Cu 0.222771 0.451727 0.5 396 63.546 0.00622817 -3.47253 63.546000 Cu 0.428137 0.422279 1 397 63.546 0.000674456 -3.49076 63.546000 Cu 0.458044 0.442024 0.5 398 63.546 0.00231669 -3.48965 63.546000 Cu 0.574978 0.437219 1.85568e-17 365 63.546 0.00275511 -3.4979 63.546000 Cu 0.545498 0.417406 0.5 366 63.546 0.000236293 -3.49273 63.546000 Cu 0.662878 0.412519 1.08098e-18 367 63.546 0.00049657 -3.49715 63.546000 Cu 0.81051 0.427178 1.9818e-18 368 63.546 0.000580256 -3.49084 63.546000 Cu 0.692455 0.432189 0.5 370 63.546 0.0013736 -3.4937 63.546000 Cu 0.928137 0.422279 0.5 374 63.546 0.000674456 -3.49076 63.546000 Cu 0.604857 0.456985 0.5 384 63.546 0.0164982 -3.50464 63.546000 Cu 0.722771 0.451727 1 385 63.546 0.00622817 -3.47253 63.546000 Cu 0.869478 0.466424 1 386 63.546 0.0715588 -3.41988 63.546000 Cu 0.840312 0.446795 0.5 387 63.546 0.00486722 -3.47626 63.546000 Cu 0.958044 0.442024 1.14104e-18 389 63.546 0.00231669 -3.48965 63.546000 Cu 0.986794 0.461955 0.5 392 63.546 0.0257741 -3.49761 63.546000 Cu 0.316594 0.512452 2.48926e-16 3 63.546 4.56338 -3.55094 63.546000 Cu 0.191633 0.51246 0.5 4 63.546 8.33909 -2.78 63.546000 Cu 0.439734 0.512448 0.5 5 63.546 8.64603 -3.88032 63.546000 Cu 0.290978 0.491511 0.5 6 63.546 0.783438 -3.374 63.546000 Cu 0.0423393 0.525302 0.5 15 63.546 9.17654 -3.0282 63.546000 Cu 0.161909 0.52924 1.70975e-16 17 63.546 2.83928 -3.36025 63.546000 Cu 0.39841 0.48744 1 198 63.546 0.516752 -3.3088 63.546000 Cu 0.254047 0.471637 4.01765e-17 203 63.546 0.0490574 -3.46943 63.546000 Cu 0.0421269 0.499597 0.5 205 63.546 9.19329 -3.02873 63.546000 Cu 0.137466 0.476275 0.5 206 63.546 0.111331 -3.46555 63.546000 Cu 0.161649 0.495684 2.0947e-16 404 63.546 2.84242 -3.36276 63.546000 Cu 0.0123125 0.481458 1.84247e-16 403 63.546 0.545679 -3.36619 63.546000 Cu 0.512313 0.481458 0.5 1 63.546 0.545679 -3.36619 63.546000 Cu 0.542339 0.525302 3.45914e-17 7 63.546 9.17654 -3.0282 63.546000 Cu 0.691633 0.51246 1 9 63.546 8.33909 -2.78 63.546000 Cu 0.816594 0.512452 0.5 11 63.546 4.56338 -3.55094 63.546000 Cu 0.661909 0.52924 0.5 12 63.546 2.83928 -3.36025 63.546000 Cu 0.939734 0.512448 1.22751e-16 13 63.546 8.64603 -3.88032 63.546000 Cu 0.637466 0.476275 1.92174e-18 383 63.546 0.111331 -3.46555 63.546000 Cu 0.754047 0.471637 0.5 388 63.546 0.0490574 -3.46943 63.546000 Cu 0.542127 0.499597 1.50737e-17 399 63.546 9.19329 -3.02873 63.546000 Cu 0.661649 0.495684 0.5 400 63.546 2.84242 -3.36276 63.546000 Cu 0.790978 0.491511 1.38125e-18 401 63.546 0.783438 -3.374 63.546000 Cu 0.89841 0.48744 0.5 402 63.546 0.516752 -3.3088 63.546000 Cu 0.0127145 0.543421 1.23172e-16 14 63.546 0.546079 -3.36456 63.546000 Cu 0.254647 0.553258 1.23292e-16 18 63.546 0.0500108 -3.46915 63.546000 Cu 0.291356 0.533385 0.5 19 63.546 0.791572 -3.37465 63.546000 Cu 0.137996 0.548617 0.5 20 63.546 0.111937 -3.46545 63.546000 Cu 0.39869 0.537452 2.25385e-16 21 63.546 0.51977 -3.30773 63.546000 Cu 0.370125 0.55846 0.5 22 63.546 0.0730676 -3.41912 63.546000 Cu 0.105629 0.567879 7.32665e-18 33 63.546 0.017089 -3.50446 63.546000 Cu 0.223717 0.573147 0.5 35 63.546 0.00666246 -3.47279 63.546000 Cu 0.0761431 0.587628 0.5 36 63.546 0.00325579 -3.49735 63.546000 Cu 0.341412 0.578076 2.34213e-18 37 63.546 0.00529684 -3.4761 63.546000 Cu 0.45917 0.582837 0.5 40 63.546 0.00234911 -3.48914 63.546000 Cu 0.487513 0.562908 1.18968e-16 23 63.546 0.0267845 -3.49726 63.546000 Cu 0.987513 0.562908 0.5 31 63.546 0.0267845 -3.49726 63.546000 Cu 0.791356 0.533385 9.45859e-17 10 63.546 0.791572 -3.37465 63.546000 Cu 0.89869 0.537452 0.5 16 63.546 0.51977 -3.30773 63.546000 Cu 0.512715 0.543421 0.5 24 63.546 0.546079 -3.36456 63.546000 Cu 0.637996 0.548617 1.44611e-16 25 63.546 0.111937 -3.46545 63.546000 Cu 0.723717 0.573147 1.05035e-16 26 63.546 0.00666246 -3.47279 63.546000 Cu 0.754647 0.553258 0.5 27 63.546 0.0500108 -3.46915 63.546000 Cu 0.605629 0.567879 0.5 28 63.546 0.017089 -3.50446 63.546000 Cu 0.870125 0.55846 1.93376e-16 29 63.546 0.0730676 -3.41912 63.546000 Cu 0.95917 0.582837 1.92174e-18 30 63.546 0.00234911 -3.48914 63.546000 Cu 0.841412 0.578076 0.5 32 63.546 0.00529684 -3.4761 63.546000 Cu 0.576143 0.587628 9.60872e-18 41 63.546 0.00325579 -3.49735 63.546000 Cu 0.193737 0.592655 2.12593e-17 34 63.546 0.00149108 -3.49354 63.546000 Cu 0.429673 0.602579 1 38 63.546 0.00109721 -3.49012 63.546000 Cu 0.311965 0.597673 0.5 39 63.546 0.000765801 -3.4908 63.546000 Cu 0.0470565 0.607433 2.04185e-18 49 63.546 0.000259281 -3.49201 63.546000 Cu 0.135033 0.63202 5.40491e-19 50 63.546 8.77073e-05 -3.49462 63.546000 Cu 0.164477 0.612301 0.5 51 63.546 0.00077008 -3.49671 63.546000 Cu 0.0175637 0.627147 0.5 52 63.546 0.000274553 -3.49232 63.546000 Cu 0.282172 0.617264 1.50136e-18 53 63.546 0.000207272 -3.4961 63.546000 Cu 0.370148 0.641874 2.40218e-19 54 63.546 2.69922e-05 -3.49606 63.546000 Cu 0.399944 0.622236 0.5 55 63.546 0.000211659 -3.49296 63.546000 Cu 0.252513 0.636925 0.5 56 63.546 0.000173763 -3.49691 63.546000 Cu 0.487787 0.646815 0.5 60 63.546 8.02054e-05 -3.4937 63.546000 Cu 0.987787 0.646815 5.6151e-17 65 63.546 8.02054e-05 -3.4937 63.546000 Cu 0.664477 0.612301 8.32956e-17 42 63.546 0.00077008 -3.49671 63.546000 Cu 0.693737 0.592655 0.5 43 63.546 0.00149108 -3.49354 63.546000 Cu 0.547056 0.607433 0.5 44 63.546 0.000259281 -3.49201 63.546000 Cu 0.811965 0.597673 1.56142e-18 45 63.546 0.000765801 -3.4908 63.546000 Cu 0.899944 0.622236 2.22202e-18 46 63.546 0.000211659 -3.49296 63.546000 Cu 0.929673 0.602579 0.5 47 63.546 0.00109721 -3.49012 63.546000 Cu 0.782172 0.617264 0.5 48 63.546 0.000207272 -3.4961 63.546000 Cu 0.517564 0.627147 2.88262e-18 57 63.546 0.000274553 -3.49232 63.546000 Cu 0.635033 0.63202 0.5 59 63.546 8.77073e-05 -3.49462 63.546000 Cu 0.752513 0.636925 1 61 63.546 0.000173763 -3.49691 63.546000 Cu 0.870148 0.641874 0.5 63 63.546 2.69922e-05 -3.49606 63.546000 Cu 0.0755062 0.671396 1.28276e-16 66 63.546 2.73802e-05 -3.49402 63.546000 Cu 0.105286 0.651719 0.5 67 63.546 2.76601e-05 -3.49403 63.546000 Cu 0.222802 0.656621 5.75322e-17 69 63.546 1.76671e-05 -3.49576 63.546000 Cu 0.310629 0.68122 4.86442e-18 70 63.546 1.63833e-05 -3.49476 63.546000 Cu 0.340344 0.661542 0.5 71 63.546 3.41353e-05 -3.49605 63.546000 Cu 0.193125 0.676305 0.5 72 63.546 1.06391e-05 -3.49438 63.546000 Cu 0.428232 0.686139 0.5 73 63.546 3.24555e-06 -3.49512 63.546000 Cu 0.457939 0.666476 5.75322e-17 74 63.546 1.9475e-05 -3.4947 63.546000 Cu 0.0458506 0.691059 0.5 83 63.546 1.30002e-05 -3.49459 63.546000 Cu 0.163386 0.69598 1.88571e-17 85 63.546 7.49872e-06 -3.49437 63.546000 Cu 0.280992 0.70089 0.5 87 63.546 9.85285e-06 -3.49436 63.546000 Cu 0.398592 0.705808 1 89 63.546 2.63253e-05 -3.49483 63.546000 Cu 0.605286 0.651719 9.60872e-19 58 63.546 2.76601e-05 -3.49403 63.546000 Cu 0.840344 0.661542 1 62 63.546 3.41353e-05 -3.49605 63.546000 Cu 0.722802 0.656621 0.5 64 63.546 1.76671e-05 -3.49576 63.546000 Cu 0.957939 0.666476 0.5 68 63.546 1.9475e-05 -3.4947 63.546000 Cu 0.545851 0.691059 5.75322e-17 75 63.546 1.30002e-05 -3.49459 63.546000 Cu 0.575506 0.671396 0.5 76 63.546 2.73802e-05 -3.49402 63.546000 Cu 0.693125 0.676305 5.75322e-17 77 63.546 1.06391e-05 -3.49438 63.546000 Cu 0.780992 0.70089 1 78 63.546 9.85285e-06 -3.49436 63.546000 Cu 0.810629 0.68122 0.5 79 63.546 1.63833e-05 -3.49476 63.546000 Cu 0.663386 0.69598 0.5 80 63.546 7.49872e-06 -3.49437 63.546000 Cu 0.928232 0.686139 1 81 63.546 3.24555e-06 -3.49512 63.546000 Cu 0.898592 0.705808 0.5 84 63.546 2.63253e-05 -3.49483 63.546000 Cu 0.0161008 0.710737 1 82 63.546 2.11802e-05 -3.49507 63.546000 Cu 0.251264 0.72055 5.75322e-17 86 63.546 2.21141e-05 -3.4945 63.546000 Cu 0.133665 0.715647 0.5 88 63.546 6.97143e-06 -3.49508 63.546000 Cu 0.368779 0.725471 0.5 90 63.546 3.27419e-05 -3.4942 63.546000 Cu 0.104022 0.735316 5.75322e-17 101 63.546 1.75743e-05 -3.49455 63.546000 Cu 0.191935 0.759896 1 102 63.546 1.97152e-05 -3.4947 63.546000 Cu 0.221569 0.740229 0.5 103 63.546 7.69326e-06 -3.49457 63.546000 Cu 0.0743053 0.754974 0.5 104 63.546 4.27041e-06 -3.49418 63.546000 Cu 0.339128 0.745134 1 105 63.546 1.34571e-05 -3.49442 63.546000 Cu 0.456764 0.750048 0.5 108 63.546 2.48631e-05 -3.49399 63.546000 Cu 0.486393 0.730398 1 91 63.546 1.21278e-05 -3.49426 63.546000 Cu 0.986393 0.730398 0.5 99 63.546 1.21278e-05 -3.49426 63.546000 Cu 0.516101 0.710737 0.5 92 63.546 2.11802e-05 -3.49507 63.546000 Cu 0.633665 0.715647 5.75322e-17 93 63.546 6.97143e-06 -3.49508 63.546000 Cu 0.721569 0.740229 1 94 63.546 7.69326e-06 -3.49457 63.546000 Cu 0.751264 0.72055 0.5 95 63.546 2.21141e-05 -3.4945 63.546000 Cu 0.604022 0.735316 0.5 96 63.546 1.75743e-05 -3.49455 63.546000 Cu 0.868779 0.725471 8.40763e-18 97 63.546 3.27419e-05 -3.4942 63.546000 Cu 0.956764 0.750048 5.75322e-17 98 63.546 2.48631e-05 -3.49399 63.546000 Cu 0.839128 0.745134 0.5 100 63.546 1.34571e-05 -3.49442 63.546000 Cu 0.574305 0.754974 5.75322e-17 109 63.546 4.27041e-06 -3.49418 63.546000 Cu 0.691935 0.759896 0.5 111 63.546 1.97152e-05 -3.4947 63.546000 Cu 0.309526 0.764803 0.5 107 63.546 2.6164e-05 -3.49464 63.546000 Cu 0.427047 0.769714 1 106 63.546 9.22594e-06 -3.49437 63.546000 Cu 0.0445914 0.774633 1 117 63.546 7.56101e-06 -3.49474 63.546000 Cu 0.132471 0.799219 5.75322e-17 118 63.546 1.34441e-05 -3.49457 63.546000 Cu 0.16222 0.779556 0.5 119 63.546 1.2409e-05 -3.49464 63.546000 Cu 0.0148555 0.794296 0.5 120 63.546 2.6188e-05 -3.49509 63.546000 Cu 0.279745 0.784476 1 121 63.546 6.167e-06 -3.49433 63.546000 Cu 0.367602 0.809063 1 122 63.546 3.74203e-06 -3.49464 63.546000 Cu 0.397306 0.789389 0.5 123 63.546 4.15509e-06 -3.49469 63.546000 Cu 0.249995 0.804146 0.5 124 63.546 1.0255e-05 -3.49414 63.546000 Cu 0.102736 0.818899 0.5 135 63.546 1.08747e-05 -3.49493 63.546000 Cu 0.485197 0.813975 0.5 128 63.546 9.69348e-06 -3.49513 63.546000 Cu 0.809526 0.764803 1 113 63.546 2.6164e-05 -3.49464 63.546000 Cu 0.985197 0.813975 5.75322e-17 133 63.546 9.69348e-06 -3.49513 63.546000 Cu 0.66222 0.779556 5.75322e-17 110 63.546 1.2409e-05 -3.49464 63.546000 Cu 0.544591 0.774633 0.5 112 63.546 7.56101e-06 -3.49474 63.546000 Cu 0.897306 0.789389 1 114 63.546 4.15509e-06 -3.49469 63.546000 Cu 0.927047 0.769714 0.5 115 63.546 9.22594e-06 -3.49437 63.546000 Cu 0.779745 0.784476 0.5 116 63.546 6.167e-06 -3.49433 63.546000 Cu 0.514855 0.794296 1 125 63.546 2.6188e-05 -3.49509 63.546000 Cu 0.602736 0.818899 1 126 63.546 1.08747e-05 -3.49493 63.546000 Cu 0.632471 0.799219 0.5 127 63.546 1.34441e-05 -3.49457 63.546000 Cu 0.749995 0.804146 1 129 63.546 1.0255e-05 -3.49414 63.546000 Cu 0.867602 0.809063 0.5 131 63.546 3.74203e-06 -3.49464 63.546000 Cu 0.220272 0.823817 1 137 63.546 2.74882e-05 -3.49457 63.546000 Cu 0.0731479 0.838582 1 134 63.546 5.5561e-05 -3.49484 63.546000 Cu 0.308147 0.848421 1 138 63.546 2.32943e-05 -3.49517 63.546000 Cu 0.337909 0.828732 0.5 139 63.546 1.50812e-05 -3.49478 63.546000 Cu 0.190664 0.843507 0.5 140 63.546 1.71925e-05 -3.49437 63.546000 Cu 0.425728 0.853326 0.5 141 63.546 5.08496e-05 -3.49518 63.546000 Cu 0.455489 0.833652 1 142 63.546 1.01856e-05 -3.49507 63.546000 Cu 0.0136013 0.877918 1 150 63.546 0.000112731 -3.49363 63.546000 Cu 0.0433789 0.858246 0.5 151 63.546 2.55402e-05 -3.49459 63.546000 Cu 0.160969 0.863192 1 153 63.546 4.29699e-05 -3.49471 63.546000 Cu 0.278527 0.868121 0.5 155 63.546 4.21873e-05 -3.49519 63.546000 Cu 0.396091 0.873022 1 157 63.546 1.25407e-05 -3.49418 63.546000 Cu 0.720272 0.823817 0.5 132 63.546 2.74882e-05 -3.49457 63.546000 Cu 0.837909 0.828732 1 130 63.546 1.50812e-05 -3.49478 63.546000 Cu 0.955489 0.833652 0.5 136 63.546 1.01856e-05 -3.49507 63.546000 Cu 0.543379 0.858246 8.09535e-17 143 63.546 2.55402e-05 -3.49459 63.546000 Cu 0.573148 0.838582 0.5 144 63.546 5.5561e-05 -3.49484 63.546000 Cu 0.690664 0.843507 1 145 63.546 1.71925e-05 -3.49437 63.546000 Cu 0.778527 0.868121 1 146 63.546 4.21873e-05 -3.49519 63.546000 Cu 0.808147 0.848421 0.5 147 63.546 2.32943e-05 -3.49517 63.546000 Cu 0.660969 0.863192 0.5 148 63.546 4.29699e-05 -3.49471 63.546000 Cu 0.925728 0.853326 1 149 63.546 5.08496e-05 -3.49518 63.546000 Cu 0.896091 0.873022 0.5 152 63.546 1.25407e-05 -3.49418 63.546000 Cu 0.513601 0.877918 0.5 160 63.546 0.000112731 -3.49363 63.546000 Cu 0.131246 0.882857 0.5 156 63.546 1.6773e-05 -3.49535 63.546000 Cu 0.248925 0.887817 5.75322e-17 154 63.546 0.000181014 -3.4965 63.546000 Cu 0.366443 0.892725 0.5 158 63.546 4.58024e-05 -3.49441 63.546000 Cu 0.101438 0.902515 1.40588e-16 169 63.546 0.000232658 -3.49329 63.546000 Cu 0.189245 0.927089 1 170 63.546 0.000745936 -3.49112 63.546000 Cu 0.219168 0.907482 0.5 171 63.546 0.000108257 -3.49691 63.546000 Cu 0.0715959 0.922197 0.5 172 63.546 0.000711118 -3.49036 63.546000 Cu 0.336885 0.912451 5.75322e-17 173 63.546 0.000664897 -3.49703 63.546000 Cu 0.424819 0.937141 1 174 63.546 0.0028287 -3.49784 63.546000 Cu 0.307303 0.932117 0.5 175 63.546 0.00127922 -3.49375 63.546000 Cu 0.454224 0.917332 0.5 176 63.546 0.000203313 -3.4921 63.546000 Cu 0.48392 0.897613 1 159 63.546 9.25629e-05 -3.49226 63.546000 Cu 0.631246 0.882857 1.18908e-16 161 63.546 1.6773e-05 -3.49535 63.546000 Cu 0.98392 0.897613 0.5 167 63.546 9.25629e-05 -3.49226 63.546000 Cu 0.719168 0.907482 5.75322e-17 162 63.546 0.000108257 -3.49691 63.546000 Cu 0.748925 0.887817 0.5 163 63.546 0.000181014 -3.4965 63.546000 Cu 0.601438 0.902515 0.5 164 63.546 0.000232658 -3.49329 63.546000 Cu 0.866443 0.892725 1 165 63.546 4.58024e-05 -3.49441 63.546000 Cu 0.954224 0.917332 1 166 63.546 0.000203313 -3.4921 63.546000 Cu 0.836885 0.912451 0.5 168 63.546 0.000664897 -3.49703 63.546000 Cu 0.571596 0.922197 9.95104e-17 177 63.546 0.000711118 -3.49036 63.546000 Cu 0.689245 0.927089 0.5 179 63.546 0.000745936 -3.49112 63.546000 Cu 0.807303 0.932117 1 181 63.546 0.00127922 -3.49375 63.546000 Cu 0.924819 0.937141 0.5 183 63.546 0.0028287 -3.49784 63.546000 Cu 0.338377 0.995572 0.5 227 63.546 2.82627 -3.36059 63.546000 Cu 0.457947 0.999487 1 207 63.546 9.18891 -3.02831 63.546000 Cu 0.0418347 0.941936 1 185 63.546 0.00200098 -3.48936 63.546000 Cu 0.130418 0.966332 5.75322e-17 186 63.546 0.0710626 -3.41964 63.546000 Cu 0.159502 0.946711 0.5 187 63.546 0.00487457 -3.47598 63.546000 Cu 0.0131078 0.961867 0.5 188 63.546 0.0259576 -3.49793 63.546000 Cu 0.277081 0.951646 1 189 63.546 0.00607569 -3.47271 63.546000 Cu 0.362511 0.976179 5.75322e-17 190 63.546 0.11141 -3.46511 63.546000 Cu 0.395057 0.956899 0.5 191 63.546 0.0163907 -3.50508 63.546000 Cu 0.245895 0.971543 0.5 192 63.546 0.0490981 -3.46952 63.546000 Cu 0.101582 0.987338 0.5 202 63.546 0.513623 -3.3082 63.546000 Cu 0.209039 0.991411 1.11101e-17 204 63.546 0.786368 -3.37526 63.546000 Cu 0.487688 0.981379 0.5 196 63.546 0.542706 -3.3644 63.546000 Cu 0.957947 0.999487 0.5 212 63.546 9.18891 -3.02831 63.546000 Cu 0.838377 0.995572 2.07248e-16 210 63.546 2.82627 -3.36059 63.546000 Cu 0.541835 0.941936 0.5 180 63.546 0.00200098 -3.48936 63.546000 Cu 0.987688 0.981379 5.75322e-17 201 63.546 0.542706 -3.3644 63.546000 Cu 0.659502 0.946711 1 178 63.546 0.00487457 -3.47598 63.546000 Cu 0.895057 0.956899 1 182 63.546 0.0163907 -3.50508 63.546000 Cu 0.777081 0.951646 0.5 184 63.546 0.00607569 -3.47271 63.546000 Cu 0.513108 0.961867 1 193 63.546 0.0259576 -3.49793 63.546000 Cu 0.601582 0.987338 5.75322e-17 194 63.546 0.513623 -3.3082 63.546000 Cu 0.630418 0.966332 0.5 195 63.546 0.0710626 -3.41964 63.546000 Cu 0.745895 0.971543 5.75322e-17 197 63.546 0.0490981 -3.46952 63.546000 Cu 0.862511 0.976179 0.5 199 63.546 0.11141 -3.46511 63.546000 Cu 0.709039 0.991411 0.5 200 63.546 0.786368 -3.37526