Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.4358 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.7047 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.602 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 0.081212 0.0255688 1.4448e-18 226 63.546 0.788636 -3.42936 63.546000 Cu 0.1688 0.0214935 0.5 228 63.546 0.395389 -3.4754 63.546000 Cu 0.263217 0.0200325 4.18992e-17 230 63.546 0.512297 -3.4999 63.546000 Cu 0.383864 0.0393527 2.408e-19 231 63.546 0.108562 -3.52096 63.546000 Cu 0.366154 0.0168645 0.5 232 63.546 4.01084 -3.42856 63.546000 Cu 0.284625 0.0433401 0.5 233 63.546 0.119658 -3.52566 63.546000 Cu 0.463731 0.0114287 2.93776e-17 234 63.546 9.01846 -3.33784 63.546000 Cu 0.581212 0.0255688 1 235 63.546 0.788636 -3.42936 63.546000 Cu 0.486157 0.032805 0.5 237 63.546 0.618306 -3.45156 63.546000 Cu 0.763217 0.0200325 0 212 63.546 0.512297 -3.4999 63.546000 Cu 0.6688 0.0214935 0.5 213 63.546 0.395389 -3.4754 63.546000 Cu 0.784625 0.0433401 0.5 220 63.546 0.119658 -3.52566 63.546000 Cu 0.963731 0.0114287 6.06817e-17 214 63.546 9.01846 -3.33784 63.546000 Cu 0.866154 0.0168645 0.5 215 63.546 4.01084 -3.42856 63.546000 Cu 0.883864 0.0393527 1 222 63.546 0.108562 -3.52096 63.546000 Cu 0.986157 0.032805 0.5 224 63.546 0.618306 -3.45156 63.546000 Cu 0.00231795 0.0567283 1 223 63.546 0.0758743 -3.52896 63.546000 Cu 0.189009 0.0477919 4.214e-17 227 63.546 0.134554 -3.52192 63.546000 Cu 0.0973652 0.0516291 0.5 229 63.546 0.0690238 -3.5255 63.546000 Cu 0.0198105 0.0810627 0.5 245 63.546 0.00821257 -3.53845 63.546000 Cu 0.11476 0.0766396 6.98321e-18 247 63.546 0.0154346 -3.53779 63.546000 Cu 0.210115 0.0720934 0.5 249 63.546 0.0229182 -3.53876 63.546000 Cu 0.306014 0.0672809 5.61065e-17 251 63.546 0.0175788 -3.53708 63.546000 Cu 0.327006 0.0909789 0.5 254 63.546 0.00435663 -3.53955 63.546000 Cu 0.423641 0.085937 6.98321e-17 252 63.546 0.0100358 -3.53889 63.546000 Cu 0.404757 0.0620687 0.5 253 63.546 0.0326463 -3.53211 63.546000 Cu 0.502318 0.0567283 0 255 63.546 0.0758743 -3.52896 63.546000 Cu 0.597365 0.0516291 0.5 257 63.546 0.0690238 -3.5255 63.546000 Cu 0.51981 0.0810627 0.5 258 63.546 0.00821257 -3.53845 63.546000 Cu 0.689009 0.0477919 4.214e-17 218 63.546 0.134554 -3.52192 63.546000 Cu 0.710115 0.0720934 0.5 221 63.546 0.0229182 -3.53876 63.546000 Cu 0.61476 0.0766396 4.214e-17 256 63.546 0.0154346 -3.53779 63.546000 Cu 0.806014 0.0672809 3.1304e-18 219 63.546 0.0175788 -3.53708 63.546000 Cu 0.904757 0.0620687 0.5 225 63.546 0.0326463 -3.53211 63.546000 Cu 0.827006 0.0909789 0.5 241 63.546 0.00435663 -3.53955 63.546000 Cu 0.923641 0.085937 7.75377e-17 243 63.546 0.0100358 -3.53889 63.546000 Cu 0.0381217 0.105477 4.214e-17 244 63.546 0.00152029 -3.5397 63.546000 Cu 0.133982 0.100856 0.5 250 63.546 0.00428461 -3.53973 63.546000 Cu 0.0573204 0.129663 0.5 267 63.546 0.000920983 -3.53991 63.546000 Cu 0.153483 0.124903 5.15313e-17 269 63.546 0.00101588 -3.5399 63.546000 Cu 0.230172 0.0961016 0 248 63.546 0.00410284 -3.53967 63.546000 Cu 0.249997 0.119986 0.5 271 63.546 0.000599116 -3.53984 63.546000 Cu 0.346385 0.115008 0 273 63.546 0.00210753 -3.53977 63.546000 Cu 0.36548 0.139147 0.5 276 63.546 0.000538182 -3.53987 63.546000 Cu 0.46138 0.134386 1.22808e-17 274 63.546 0.000216518 -3.5399 63.546000 Cu 0.4425 0.110135 0.5 275 63.546 0.00165357 -3.53966 63.546000 Cu 0.538122 0.105477 3.7324e-17 277 63.546 0.00152029 -3.5397 63.546000 Cu 0.55732 0.129663 0.5 279 63.546 0.000920983 -3.53991 63.546000 Cu 0.653483 0.124903 6.02001e-18 238 63.546 0.00101588 -3.5399 63.546000 Cu 0.730172 0.0961016 2.91368e-17 239 63.546 0.00410284 -3.53967 63.546000 Cu 0.749997 0.119986 0.5 242 63.546 0.000599116 -3.53984 63.546000 Cu 0.633982 0.100856 0.5 278 63.546 0.00428461 -3.53973 63.546000 Cu 0.846385 0.115008 7.72969e-17 240 63.546 0.00210753 -3.53977 63.546000 Cu 0.9425 0.110135 0.5 246 63.546 0.00165357 -3.53966 63.546000 Cu 0.86548 0.139147 0.5 263 63.546 0.000538182 -3.53987 63.546000 Cu 0.96138 0.134386 4.64744e-17 265 63.546 0.000216518 -3.5399 63.546000 Cu 0.0766784 0.153751 4.214e-17 266 63.546 0.00028456 -3.53996 63.546000 Cu 0.172996 0.148898 0.5 272 63.546 8.69794e-05 -3.53995 63.546000 Cu 0.0960984 0.177802 0.5 288 63.546 1.98992e-05 -3.53997 63.546000 Cu 0.192323 0.17295 1.42072e-17 290 63.546 0.000115741 -3.53996 63.546000 Cu 0.269321 0.144014 4.214e-17 270 63.546 0.00045224 -3.53991 63.546000 Cu 0.288491 0.168114 0.5 292 63.546 0.000132014 -3.53994 63.546000 Cu 0.384544 0.163318 0 294 63.546 4.69715e-05 -3.53995 63.546000 Cu 0.499885 0.182638 0 295 63.546 6.76036e-05 -3.53997 63.546000 Cu 0.480567 0.158543 0.5 296 63.546 0.000233073 -3.53995 63.546000 Cu 0.403738 0.187443 0.5 297 63.546 6.02303e-05 -3.53997 63.546000 Cu 0.576678 0.153751 1.6856e-18 298 63.546 0.00028456 -3.53996 63.546000 Cu 0.596098 0.177802 0.5 299 63.546 1.98992e-05 -3.53997 63.546000 Cu 0.692323 0.17295 1 259 63.546 0.000115741 -3.53996 63.546000 Cu 0.672996 0.148898 0.5 260 63.546 8.69794e-05 -3.53995 63.546000 Cu 0.769321 0.144014 4.214e-17 261 63.546 0.00045224 -3.53991 63.546000 Cu 0.788491 0.168114 0.5 264 63.546 0.000132014 -3.53994 63.546000 Cu 0.999885 0.182638 4.214e-17 286 63.546 6.76036e-05 -3.53997 63.546000 Cu 0.884544 0.163318 1 262 63.546 4.69715e-05 -3.53995 63.546000 Cu 0.980567 0.158543 0.5 268 63.546 0.000233073 -3.53995 63.546000 Cu 0.903738 0.187443 0.5 284 63.546 6.02303e-05 -3.53997 63.546000 Cu 0.115407 0.201876 1 287 63.546 3.72518e-05 -3.53996 63.546000 Cu 0.0192105 0.20671 0.5 289 63.546 8.32674e-06 -3.53997 63.546000 Cu 0.0384643 0.230796 4.3344e-18 308 63.546 4.94569e-06 -3.53997 63.546000 Cu 0.134611 0.225974 0.5 310 63.546 3.93158e-06 -3.53996 63.546000 Cu 0.307652 0.19224 6.67017e-17 291 63.546 8.01426e-06 -3.53996 63.546000 Cu 0.211555 0.197049 0.5 293 63.546 3.03611e-05 -3.53996 63.546000 Cu 0.230749 0.221159 0 312 63.546 4.34209e-06 -3.53997 63.546000 Cu 0.326874 0.216351 0.5 314 63.546 1.78175e-05 -3.53997 63.546000 Cu 0.42303 0.211536 4.214e-17 316 63.546 1.19387e-05 -3.53997 63.546000 Cu 0.538464 0.230796 0 317 63.546 4.94569e-06 -3.53997 63.546000 Cu 0.51921 0.20671 0.5 318 63.546 8.32674e-06 -3.53997 63.546000 Cu 0.442295 0.235621 0.5 319 63.546 3.48609e-06 -3.53997 63.546000 Cu 0.730749 0.221159 6.98321e-18 280 63.546 4.34209e-06 -3.53997 63.546000 Cu 0.711555 0.197049 0.5 281 63.546 3.03611e-05 -3.53996 63.546000 Cu 0.615407 0.201876 0 320 63.546 3.72518e-05 -3.53996 63.546000 Cu 0.634611 0.225974 0.5 321 63.546 3.93158e-06 -3.53996 63.546000 Cu 0.807652 0.19224 0 282 63.546 8.01426e-06 -3.53996 63.546000 Cu 0.92303 0.211536 4.214e-17 283 63.546 1.19387e-05 -3.53997 63.546000 Cu 0.826874 0.216351 0.5 285 63.546 1.78175e-05 -3.53997 63.546000 Cu 0.942295 0.235621 0.5 306 63.546 3.48609e-06 -3.53997 63.546000 Cu 0.153828 0.250068 7.15177e-17 309 63.546 2.63236e-06 -3.53997 63.546000 Cu 0.0576698 0.254886 0.5 311 63.546 3.72499e-06 -3.53997 63.546000 Cu 0.0769303 0.278971 4.214e-17 330 63.546 9.7592e-06 -3.53997 63.546000 Cu 0.173084 0.274156 0.5 332 63.546 1.11265e-05 -3.53997 63.546000 Cu 0.346132 0.24044 4.4548e-17 313 63.546 1.90238e-06 -3.53997 63.546000 Cu 0.249973 0.245255 0.5 315 63.546 1.21176e-06 -3.53997 63.546000 Cu 0.269219 0.269346 0 334 63.546 5.49763e-06 -3.53997 63.546000 Cu 0.365356 0.264532 0.5 336 63.546 2.81313e-06 -3.53997 63.546000 Cu 0.461507 0.25971 2.35984e-17 338 63.546 2.9122e-06 -3.53997 63.546000 Cu 0.57693 0.278971 1.42072e-17 339 63.546 9.7592e-06 -3.53997 63.546000 Cu 0.55767 0.254886 0.5 340 63.546 3.72499e-06 -3.53997 63.546000 Cu 0.48076 0.283795 0.5 341 63.546 8.34396e-06 -3.53997 63.546000 Cu 0.653828 0.250068 2.408e-17 300 63.546 2.63236e-06 -3.53997 63.546000 Cu 0.769219 0.269346 5.61065e-17 301 63.546 5.49763e-06 -3.53997 63.546000 Cu 0.749973 0.245255 0.5 302 63.546 1.21176e-06 -3.53997 63.546000 Cu 0.673084 0.274156 0.5 303 63.546 1.11265e-05 -3.53997 63.546000 Cu 0.846132 0.24044 0 304 63.546 1.90238e-06 -3.53997 63.546000 Cu 0.961507 0.25971 1 305 63.546 2.9122e-06 -3.53997 63.546000 Cu 0.865356 0.264532 0.5 307 63.546 2.81313e-06 -3.53997 63.546000 Cu 0.98076 0.283795 0.5 328 63.546 8.34396e-06 -3.53997 63.546000 Cu 8.87105e-05 0.307871 4.214e-17 327 63.546 4.83769e-05 -3.53997 63.546000 Cu 0.192327 0.298263 4.23808e-17 331 63.546 9.05391e-06 -3.53996 63.546000 Cu 0.096243 0.303062 0.5 333 63.546 5.81789e-05 -3.53997 63.546000 Cu 0.0194258 0.331963 0.5 349 63.546 0.000222984 -3.53996 63.546000 Cu 0.115455 0.327185 4.214e-17 351 63.546 4.6552e-05 -3.53995 63.546000 Cu 0.38457 0.288628 2.93776e-17 335 63.546 3.11242e-05 -3.53996 63.546000 Cu 0.288426 0.293453 0.5 337 63.546 2.21334e-05 -3.53996 63.546000 Cu 0.211509 0.322388 0.5 353 63.546 0.000112675 -3.53994 63.546000 Cu 0.307662 0.317553 5.61065e-17 355 63.546 0.000113002 -3.53996 63.546000 Cu 0.403883 0.312704 0.5 357 63.546 2.15634e-05 -3.53997 63.546000 Cu 0.500089 0.307871 1 359 63.546 4.83769e-05 -3.53997 63.546000 Cu 0.596243 0.303062 0.5 361 63.546 5.81789e-05 -3.53997 63.546000 Cu 0.519426 0.331963 0.5 362 63.546 0.000222984 -3.53996 63.546000 Cu 0.692327 0.298263 3.9732e-17 322 63.546 9.05391e-06 -3.53996 63.546000 Cu 0.788426 0.293453 0.5 324 63.546 2.21334e-05 -3.53996 63.546000 Cu 0.711509 0.322388 0.5 325 63.546 0.000112675 -3.53994 63.546000 Cu 0.615455 0.327185 1 360 63.546 4.6552e-05 -3.53995 63.546000 Cu 0.807662 0.317553 4.214e-17 323 63.546 0.000113002 -3.53996 63.546000 Cu 0.88457 0.288628 1.10768e-17 326 63.546 3.11242e-05 -3.53996 63.546000 Cu 0.903883 0.312704 0.5 329 63.546 2.15634e-05 -3.53997 63.546000 Cu 0.0386262 0.356112 8.33169e-17 348 63.546 0.000232607 -3.5399 63.546000 Cu 0.134521 0.351351 0.5 354 63.546 0.00051139 -3.53987 63.546000 Cu 0.0575132 0.380364 0.5 371 63.546 0.00163892 -3.53967 63.546000 Cu 0.153626 0.375491 1 373 63.546 0.00207787 -3.53978 63.546000 Cu 0.230685 0.346488 1.00173e-16 352 63.546 0.000435598 -3.53991 63.546000 Cu 0.327008 0.341608 0.5 358 63.546 8.56545e-05 -3.53995 63.546000 Cu 0.250004 0.370515 0.5 375 63.546 0.00061198 -3.53984 63.546000 Cu 0.346522 0.365602 7.46481e-17 377 63.546 0.000956073 -3.5399 63.546000 Cu 0.423311 0.336756 0 356 63.546 0.000249254 -3.53996 63.546000 Cu 0.442685 0.36084 0.5 379 63.546 0.000910141 -3.53991 63.546000 Cu 0.538626 0.356112 0 381 63.546 0.000232607 -3.5399 63.546000 Cu 0.557513 0.380364 0.5 383 63.546 0.00163892 -3.53967 63.546000 Cu 0.653626 0.375491 4.214e-17 342 63.546 0.00207787 -3.53978 63.546000 Cu 0.730685 0.346488 5.99593e-17 343 63.546 0.000435598 -3.53991 63.546000 Cu 0.750004 0.370515 0.5 346 63.546 0.00061198 -3.53984 63.546000 Cu 0.634521 0.351351 0.5 382 63.546 0.00051139 -3.53987 63.546000 Cu 0.846522 0.365602 2.79328e-17 344 63.546 0.000956073 -3.5399 63.546000 Cu 0.827008 0.341608 0.5 345 63.546 8.56545e-05 -3.53995 63.546000 Cu 0.923311 0.336756 4.214e-17 347 63.546 0.000249254 -3.53996 63.546000 Cu 0.942685 0.36084 0.5 350 63.546 0.000910141 -3.53991 63.546000 Cu 0.0763616 0.404556 1.03063e-16 370 63.546 0.00983853 -3.53889 63.546000 Cu 0.173008 0.39952 0.5 376 63.546 0.00434739 -3.53955 63.546000 Cu 0.0952287 0.428427 0.5 392 63.546 0.0327985 -3.53211 63.546000 Cu 0.193977 0.423216 2.35984e-17 394 63.546 0.0174933 -3.53706 63.546000 Cu 0.269824 0.394396 2.38392e-17 374 63.546 0.00406991 -3.53966 63.546000 Cu 0.366014 0.389642 0.5 380 63.546 0.00431399 -3.53972 63.546000 Cu 0.289883 0.418402 0.5 396 63.546 0.0229613 -3.53878 63.546000 Cu 0.385236 0.413855 2.1672e-18 398 63.546 0.015578 -3.53777 63.546000 Cu 0.461871 0.38502 1.5652e-17 378 63.546 0.00152375 -3.53971 63.546000 Cu 0.480182 0.409434 0.5 400 63.546 0.00832224 -3.53844 63.546000 Cu 0.576362 0.404556 0 402 63.546 0.00983853 -3.53889 63.546000 Cu 0.595229 0.428427 0.5 403 63.546 0.0327985 -3.53211 63.546000 Cu 0.693977 0.423216 0 363 63.546 0.0174933 -3.53706 63.546000 Cu 0.673008 0.39952 0.5 364 63.546 0.00434739 -3.53955 63.546000 Cu 0.769824 0.394396 5.00865e-17 365 63.546 0.00406991 -3.53966 63.546000 Cu 0.789883 0.418402 0.5 368 63.546 0.0229613 -3.53878 63.546000 Cu 0.885236 0.413855 0 366 63.546 0.015578 -3.53777 63.546000 Cu 0.866014 0.389642 0.5 367 63.546 0.00431399 -3.53972 63.546000 Cu 0.961871 0.38502 4.214e-17 369 63.546 0.00152375 -3.53971 63.546000 Cu 0.980182 0.409434 0.5 372 63.546 0.00832224 -3.53844 63.546000 Cu 0.116123 0.451138 4.214e-17 391 63.546 0.10886 -3.52091 63.546000 Cu 0.0138226 0.45768 0.5 393 63.546 0.617104 -3.45183 63.546000 Cu 0.133846 0.473625 0.5 410 63.546 4.00876 -3.42822 63.546000 Cu 0.33119 0.468995 0.5 208 63.546 0.395247 -3.47547 63.546000 Cu 0.310982 0.442696 4.214e-17 395 63.546 0.135548 -3.52201 63.546000 Cu 0.215354 0.447158 0.5 397 63.546 0.119433 -3.52561 63.546000 Cu 0.236759 0.470463 2.26352e-17 411 63.546 0.510565 -3.49964 63.546000 Cu 0.513823 0.45768 0.5 9 63.546 0.617104 -3.45183 63.546000 Cu 0.418734 0.464917 4.214e-17 201 63.546 0.790118 -3.42993 63.546000 Cu 0.497671 0.433765 4.214e-17 399 63.546 0.0758042 -3.52895 63.546000 Cu 0.40262 0.438867 0.5 401 63.546 0.0693533 -3.52552 63.546000 Cu 0.633846 0.473625 0.5 1 63.546 4.00876 -3.42822 63.546000 Cu 0.616123 0.451138 1 3 63.546 0.10886 -3.52091 63.546000 Cu 0.736759 0.470463 1.87824e-17 384 63.546 0.510565 -3.49964 63.546000 Cu 0.715354 0.447158 0.5 385 63.546 0.119433 -3.52561 63.546000 Cu 0.997671 0.433765 0 390 63.546 0.0758042 -3.52895 63.546000 Cu 0.810982 0.442696 0 386 63.546 0.135548 -3.52201 63.546000 Cu 0.918734 0.464917 3.80464e-17 387 63.546 0.790118 -3.42993 63.546000 Cu 0.90262 0.438867 0.5 388 63.546 0.0693533 -3.52552 63.546000 Cu 0.83119 0.468995 0.5 389 63.546 0.395247 -3.47547 63.546000 Cu 0.036281 0.511145 1 2 63.546 9.02832 -3.33709 63.546000 Cu 0.133792 0.516593 0.5 5 63.546 4.02083 -3.42842 63.546000 Cu 0.0362802 0.479063 0 408 63.546 9.01044 -3.33783 63.546000 Cu 0.151133 0.495101 4.50296e-17 409 63.546 6.7645 -3.42515 63.546000 Cu 0.236747 0.519766 1.25216e-17 4 63.546 0.514289 -3.49949 63.546000 Cu 0.24611 0.495115 0.5 207 63.546 0.981642 -3.52261 63.546000 Cu 0.343913 0.495095 4.214e-17 412 63.546 1.48983 -3.49083 63.546000 Cu 0.33108 0.521221 0.5 6 63.546 0.389906 -3.47503 63.546000 Cu 0.444426 0.495071 0.5 7 63.546 7.48741 -3.289 63.546000 Cu 0.536281 0.511145 4.214e-17 10 63.546 9.02832 -3.33709 63.546000 Cu 0.53628 0.479063 0 199 63.546 9.01044 -3.33783 63.546000 Cu 0.633792 0.516593 0.5 12 63.546 4.02083 -3.42842 63.546000 Cu 0.736747 0.519766 0 14 63.546 0.514289 -3.49949 63.546000 Cu 0.651133 0.495101 4.214e-17 404 63.546 6.7645 -3.42515 63.546000 Cu 0.74611 0.495115 0.5 405 63.546 0.981642 -3.52261 63.546000 Cu 0.843913 0.495095 5.27353e-17 406 63.546 1.48983 -3.49083 63.546000 Cu 0.944426 0.495071 0.5 407 63.546 7.48741 -3.289 63.546000 Cu 0.83108 0.521221 0.5 16 63.546 0.389906 -3.47503 63.546000 Cu 0.0137416 0.532496 0.5 20 63.546 0.625959 -3.45093 63.546000 Cu 0.11606 0.539072 6.98321e-18 22 63.546 0.109343 -3.52074 63.546000 Cu 0.193987 0.566992 0 23 63.546 0.0185896 -3.53704 63.546000 Cu 0.0951399 0.561779 0.5 25 63.546 0.0334633 -3.53191 63.546000 Cu 0.215384 0.543062 0.5 24 63.546 0.121751 -3.5257 63.546000 Cu 0.311015 0.547511 0 26 63.546 0.137274 -3.52181 63.546000 Cu 0.418742 0.525244 1 8 63.546 0.798337 -3.42866 63.546000 Cu 0.513742 0.532496 0.5 13 63.546 0.625959 -3.45093 63.546000 Cu 0.40258 0.551344 0.5 29 63.546 0.0686888 -3.52514 63.546000 Cu 0.497579 0.556442 0 30 63.546 0.0779652 -3.52883 63.546000 Cu 0.59514 0.561779 0.5 32 63.546 0.0334633 -3.53191 63.546000 Cu 0.61606 0.539072 4.214e-17 11 63.546 0.109343 -3.52074 63.546000 Cu 0.715384 0.543062 0.5 17 63.546 0.121751 -3.5257 63.546000 Cu 0.693987 0.566992 1 34 63.546 0.0185896 -3.53704 63.546000 Cu 0.997579 0.556442 7.07953e-17 19 63.546 0.0779652 -3.52883 63.546000 Cu 0.811015 0.547511 0 15 63.546 0.137274 -3.52181 63.546000 Cu 0.918742 0.525244 0 18 63.546 0.798337 -3.42866 63.546000 Cu 0.90258 0.551344 0.5 21 63.546 0.0686888 -3.52514 63.546000 Cu 0.076245 0.585646 4.214e-17 42 63.546 0.0110011 -3.53884 63.546000 Cu 0.153488 0.614745 0 43 63.546 0.00247108 -3.53971 63.546000 Cu 0.172894 0.59069 0.5 44 63.546 0.00502288 -3.53951 63.546000 Cu 0.0574042 0.609867 0.5 45 63.546 0.00192491 -3.53958 63.546000 Cu 0.28985 0.571821 0.5 27 63.546 0.0235735 -3.53874 63.546000 Cu 0.385149 0.576384 0 28 63.546 0.0162383 -3.5377 63.546000 Cu 0.269729 0.59585 4.3344e-18 46 63.546 0.0046014 -3.53969 63.546000 Cu 0.365915 0.600609 0.5 49 63.546 0.00447728 -3.53974 63.546000 Cu 0.576245 0.585646 4.64744e-17 31 63.546 0.0110011 -3.53884 63.546000 Cu 0.480063 0.580782 0.5 33 63.546 0.00859911 -3.53839 63.546000 Cu 0.461807 0.605227 3.22672e-17 50 63.546 0.00165929 -3.53965 63.546000 Cu 0.557404 0.609867 0.5 52 63.546 0.00192491 -3.53958 63.546000 Cu 0.769729 0.59585 0 35 63.546 0.0046014 -3.53969 63.546000 Cu 0.78985 0.571821 0.5 36 63.546 0.0235735 -3.53874 63.546000 Cu 0.672894 0.59069 0.5 37 63.546 0.00502288 -3.53951 63.546000 Cu 0.653488 0.614745 3.8528e-18 54 63.546 0.00247108 -3.53971 63.546000 Cu 0.885149 0.576384 4.214e-17 38 63.546 0.0162383 -3.5377 63.546000 Cu 0.961807 0.605227 3.9732e-17 39 63.546 0.00165929 -3.53965 63.546000 Cu 0.980063 0.580782 0.5 40 63.546 0.00859911 -3.53839 63.546000 Cu 0.865915 0.600609 0.5 41 63.546 0.00447728 -3.53974 63.546000 Cu 0.0384964 0.634158 7.22401e-19 62 63.546 0.000225679 -3.53984 63.546000 Cu 0.1153 0.663121 0 63 63.546 4.1965e-05 -3.53989 63.546000 Cu 0.134385 0.638915 0.5 64 63.546 0.00068511 -3.53981 63.546000 Cu 0.0192932 0.658354 0.5 65 63.546 0.000235784 -3.53992 63.546000 Cu 0.249906 0.619747 0.5 47 63.546 0.000589507 -3.5398 63.546000 Cu 0.346455 0.624676 0 48 63.546 0.00116535 -3.53991 63.546000 Cu 0.230543 0.643789 2.1672e-18 66 63.546 0.000572913 -3.53986 63.546000 Cu 0.326871 0.648696 0.5 68 63.546 0.000111741 -3.53993 63.546000 Cu 0.538496 0.634158 7.94641e-17 51 63.546 0.000225679 -3.53984 63.546000 Cu 0.442604 0.629444 0.5 53 63.546 0.00111203 -3.53989 63.546000 Cu 0.423176 0.653564 1.90232e-17 70 63.546 0.000352278 -3.53995 63.546000 Cu 0.519293 0.658354 0.5 72 63.546 0.000235784 -3.53992 63.546000 Cu 0.730543 0.643789 0 55 63.546 0.000572913 -3.53986 63.546000 Cu 0.749906 0.619747 0.5 56 63.546 0.000589507 -3.5398 63.546000 Cu 0.634385 0.638915 0.5 57 63.546 0.00068511 -3.53981 63.546000 Cu 0.6153 0.663121 8.66881e-18 74 63.546 4.1965e-05 -3.53989 63.546000 Cu 0.846455 0.624676 4.214e-17 58 63.546 0.00116535 -3.53991 63.546000 Cu 0.923176 0.653564 6.11633e-17 59 63.546 0.000352278 -3.53995 63.546000 Cu 0.942604 0.629444 0.5 60 63.546 0.00111203 -3.53989 63.546000 Cu 0.826871 0.648696 0.5 61 63.546 0.000111741 -3.53993 63.546000 Cu 2.12651e-06 0.682495 5.39393e-17 82 63.546 0.000100983 -3.53994 63.546000 Cu 0.076921 0.711449 1.0836e-17 83 63.546 2.85894e-05 -3.53993 63.546000 Cu 0.0961349 0.687299 0.5 84 63.546 5.12198e-05 -3.53992 63.546000 Cu 0.192209 0.692098 8.66881e-18 86 63.546 1.52512e-05 -3.5399 63.546000 Cu 0.307507 0.67278 0 67 63.546 0.000169597 -3.53991 63.546000 Cu 0.211332 0.667924 0.5 69 63.546 0.000228205 -3.53988 63.546000 Cu 0.288317 0.696921 0.5 88 63.546 6.33053e-05 -3.53989 63.546000 Cu 0.384502 0.701767 1.03544e-17 90 63.546 3.73193e-05 -3.53991 63.546000 Cu 0.500002 0.682495 7.22401e-19 71 63.546 0.000100983 -3.53994 63.546000 Cu 0.403768 0.677654 0.5 73 63.546 4.13428e-05 -3.53994 63.546000 Cu 0.596135 0.687299 0.5 77 63.546 5.12198e-05 -3.53992 63.546000 Cu 0.480732 0.706617 0.5 92 63.546 1.13356e-05 -3.53993 63.546000 Cu 0.576921 0.711449 0 94 63.546 2.85894e-05 -3.53993 63.546000 Cu 0.692209 0.692098 3.80464e-17 75 63.546 1.52512e-05 -3.5399 63.546000 Cu 0.711332 0.667924 0.5 76 63.546 0.000228205 -3.53988 63.546000 Cu 0.788317 0.696921 0.5 81 63.546 6.33053e-05 -3.53989 63.546000 Cu 0.807507 0.67278 4.214e-17 78 63.546 0.000169597 -3.53991 63.546000 Cu 0.884502 0.701767 4.214e-17 79 63.546 3.73193e-05 -3.53991 63.546000 Cu 0.903768 0.677654 0.5 80 63.546 4.13428e-05 -3.53994 63.546000 Cu 0.980732 0.706617 0.5 85 63.546 1.13356e-05 -3.53993 63.546000 Cu 0.173068 0.716265 0.5 89 63.546 1.55992e-05 -3.53992 63.546000 Cu 0.0385316 0.759711 4.0936e-17 103 63.546 1.82176e-06 -3.53992 63.546000 Cu 0.0577156 0.735582 0.5 104 63.546 5.67718e-06 -3.53993 63.546000 Cu 0.153888 0.740409 2.81736e-17 106 63.546 6.44515e-06 -3.53993 63.546000 Cu 0.269189 0.721079 0 87 63.546 6.32733e-06 -3.53991 63.546000 Cu 0.36534 0.725907 0.5 93 63.546 1.20265e-05 -3.53991 63.546000 Cu 0.250037 0.74523 0.5 108 63.546 1.37558e-06 -3.53993 63.546000 Cu 0.346173 0.750048 0 111 63.546 5.19556e-06 -3.53993 63.546000 Cu 0.461516 0.730744 4.214e-17 91 63.546 3.83207e-06 -3.53992 63.546000 Cu 0.557716 0.735582 0.5 97 63.546 5.67718e-06 -3.53993 63.546000 Cu 0.442342 0.754875 0.5 113 63.546 5.7097e-06 -3.53993 63.546000 Cu 0.538532 0.759711 4.214e-17 114 63.546 1.82176e-06 -3.53992 63.546000 Cu 0.653888 0.740409 1 95 63.546 6.44515e-06 -3.53993 63.546000 Cu 0.673068 0.716265 0.5 96 63.546 1.55992e-05 -3.53992 63.546000 Cu 0.769189 0.721079 5.70697e-17 98 63.546 6.32733e-06 -3.53991 63.546000 Cu 0.750037 0.74523 0.5 101 63.546 1.37558e-06 -3.53993 63.546000 Cu 0.846173 0.750048 1.03544e-17 99 63.546 5.19556e-06 -3.53993 63.546000 Cu 0.86534 0.725907 0.5 100 63.546 1.20265e-05 -3.53991 63.546000 Cu 0.961516 0.730744 4.214e-17 102 63.546 3.83207e-06 -3.53992 63.546000 Cu 0.942342 0.754875 0.5 105 63.546 5.7097e-06 -3.53993 63.546000 Cu 0.134712 0.764548 0.5 109 63.546 8.84547e-06 -3.53992 63.546000 Cu 3.75057e-05 0.807963 1.34848e-17 123 63.546 7.23421e-05 -3.53994 63.546000 Cu 0.019315 0.783838 0.5 124 63.546 1.08611e-05 -3.53993 63.546000 Cu 0.115532 0.788684 5.97185e-17 126 63.546 2.7087e-05 -3.53992 63.546000 Cu 0.230862 0.769375 3.8528e-18 107 63.546 4.91866e-06 -3.53992 63.546000 Cu 0.326992 0.774191 0.5 110 63.546 7.95159e-06 -3.53993 63.546000 Cu 0.21171 0.793528 0.5 128 63.546 4.36583e-05 -3.5399 63.546000 Cu 0.307825 0.798352 3.78056e-17 130 63.546 1.29606e-05 -3.53991 63.546000 Cu 0.423136 0.779008 1.23049e-16 112 63.546 2.11158e-05 -3.53993 63.546000 Cu 0.519315 0.783838 0.5 117 63.546 1.08611e-05 -3.53993 63.546000 Cu 0.403901 0.803154 0.5 133 63.546 4.28451e-05 -3.53993 63.546000 Cu 0.500038 0.807963 4.23808e-17 134 63.546 7.23421e-05 -3.53994 63.546000 Cu 0.615532 0.788684 0 115 63.546 2.7087e-05 -3.53992 63.546000 Cu 0.634712 0.764548 0.5 116 63.546 8.84547e-06 -3.53992 63.546000 Cu 0.730862 0.769375 0 118 63.546 4.91866e-06 -3.53992 63.546000 Cu 0.71171 0.793528 0.5 121 63.546 4.36583e-05 -3.5399 63.546000 Cu 0.807825 0.798352 0 119 63.546 1.29606e-05 -3.53991 63.546000 Cu 0.826992 0.774191 0.5 120 63.546 7.95159e-06 -3.53993 63.546000 Cu 0.923136 0.779008 1.75784e-17 122 63.546 2.11158e-05 -3.53993 63.546000 Cu 0.903901 0.803154 0.5 125 63.546 4.28451e-05 -3.53993 63.546000 Cu 0.192515 0.81767 1.5652e-17 127 63.546 0.000153203 -3.53991 63.546000 Cu 0.0962605 0.8128 0.5 129 63.546 3.80101e-05 -3.53994 63.546000 Cu 0.0768537 0.836895 5.39393e-17 146 63.546 0.000283812 -3.53995 63.546000 Cu 0.173133 0.84176 0.5 148 63.546 0.000103487 -3.53993 63.546000 Cu 0.28867 0.822522 0.5 131 63.546 0.000174125 -3.53989 63.546000 Cu 0.384709 0.827329 1.61336e-17 132 63.546 3.77244e-05 -3.5399 63.546000 Cu 0.26945 0.846658 1.95048e-17 150 63.546 0.000510163 -3.53987 63.546000 Cu 0.365613 0.851526 0.5 153 63.546 0.000582415 -3.53982 63.546000 Cu 0.576854 0.836895 3.3712e-17 135 63.546 0.000283812 -3.53995 63.546000 Cu 0.59626 0.8128 0.5 136 63.546 3.80101e-05 -3.53994 63.546000 Cu 0.480731 0.832101 0.5 137 63.546 0.000200958 -3.53993 63.546000 Cu 0.461508 0.856289 1.73376e-17 154 63.546 0.000237191 -3.53984 63.546000 Cu 0.692515 0.81767 4.47888e-17 138 63.546 0.000153203 -3.53991 63.546000 Cu 0.76945 0.846658 4.214e-17 139 63.546 0.000510163 -3.53987 63.546000 Cu 0.78867 0.822522 0.5 140 63.546 0.000174125 -3.53989 63.546000 Cu 0.673133 0.84176 0.5 141 63.546 0.000103487 -3.53993 63.546000 Cu 0.884709 0.827329 4.214e-17 142 63.546 3.77244e-05 -3.5399 63.546000 Cu 0.961508 0.856289 1.6856e-18 143 63.546 0.000237191 -3.53984 63.546000 Cu 0.980731 0.832101 0.5 144 63.546 0.000200958 -3.53993 63.546000 Cu 0.865613 0.851526 0.5 145 63.546 0.000582415 -3.53982 63.546000 Cu 0.153556 0.865784 6.95913e-17 147 63.546 0.00103006 -3.53991 63.546000 Cu 0.0574065 0.861014 0.5 149 63.546 0.00103098 -3.53989 63.546000 Cu 0.0382002 0.885224 6.50161e-18 166 63.546 0.0016511 -3.53966 63.546000 Cu 0.134098 0.889849 0.5 168 63.546 0.00433218 -3.53975 63.546000 Cu 0.250096 0.870703 0.5 151 63.546 0.000585512 -3.53981 63.546000 Cu 0.346498 0.8757 0 152 63.546 0.00227613 -3.53972 63.546000 Cu 0.230281 0.894613 1.6856e-18 170 63.546 0.00437514 -3.53971 63.546000 Cu 0.327086 0.899767 0.5 172 63.546 0.00499844 -3.53952 63.546000 Cu 0.5382 0.885224 0 155 63.546 0.0016511 -3.53966 63.546000 Cu 0.557407 0.861014 0.5 156 63.546 0.00103098 -3.53989 63.546000 Cu 0.44258 0.880581 0.5 157 63.546 0.00180468 -3.53958 63.546000 Cu 0.653556 0.865784 0 158 63.546 0.00103006 -3.53991 63.546000 Cu 0.730281 0.894613 8.90961e-18 159 63.546 0.00437514 -3.53971 63.546000 Cu 0.750096 0.870703 0.5 160 63.546 0.000585512 -3.53981 63.546000 Cu 0.634098 0.889849 0.5 161 63.546 0.00433218 -3.53975 63.546000 Cu 0.846498 0.8757 3.8528e-17 162 63.546 0.00227613 -3.53972 63.546000 Cu 0.94258 0.880581 0.5 164 63.546 0.00180468 -3.53958 63.546000 Cu 0.827086 0.899767 0.5 165 63.546 0.00499844 -3.53952 63.546000 Cu 0.114856 0.914077 4.214e-17 167 63.546 0.0162992 -3.53768 63.546000 Cu 0.0199226 0.90967 0.5 169 63.546 0.00847153 -3.53836 63.546000 Cu 0.00240102 0.934016 1 186 63.546 0.077427 -3.52873 63.546000 Cu 0.097403 0.939127 0.5 188 63.546 0.0691562 -3.525 63.546000 Cu 0.188981 0.942953 1 190 63.546 0.1384 -3.52198 63.546000 Cu 0.306011 0.923476 5.53841e-18 171 63.546 0.0183007 -3.53706 63.546000 Cu 0.210147 0.918647 0.5 173 63.546 0.0232137 -3.53876 63.546000 Cu 0.284625 0.947413 0.5 192 63.546 0.121087 -3.52568 63.546000 Cu 0.383941 0.951398 2.35984e-17 194 63.546 0.109148 -3.5209 63.546000 Cu 0.423733 0.904801 0 174 63.546 0.0105056 -3.53882 63.546000 Cu 0.502401 0.934016 4.214e-17 175 63.546 0.077427 -3.52873 63.546000 Cu 0.519923 0.90967 0.5 176 63.546 0.00847153 -3.53836 63.546000 Cu 0.404848 0.92868 0.5 177 63.546 0.0334378 -3.53196 63.546000 Cu 0.597403 0.939127 0.5 181 63.546 0.0691562 -3.525 63.546000 Cu 0.614856 0.914077 0 178 63.546 0.0162992 -3.53768 63.546000 Cu 0.688981 0.942953 2.69696e-17 179 63.546 0.1384 -3.52198 63.546000 Cu 0.710147 0.918647 0.5 180 63.546 0.0232137 -3.53876 63.546000 Cu 0.784625 0.947413 0.5 185 63.546 0.121087 -3.52568 63.546000 Cu 0.923733 0.904801 1.54112e-17 163 63.546 0.0105056 -3.53882 63.546000 Cu 0.806011 0.923476 6.62201e-17 182 63.546 0.0183007 -3.53706 63.546000 Cu 0.883941 0.951398 1 183 63.546 0.109148 -3.5209 63.546000 Cu 0.904848 0.92868 0.5 184 63.546 0.0334378 -3.53196 63.546000 Cu 0.156074 0.995387 2.84144e-17 216 63.546 1.49087 -3.49059 63.546000 Cu 0.0555511 0.995402 0.5 217 63.546 7.49146 -3.28833 63.546000 Cu 0.0812708 0.965225 1 187 63.546 0.799798 -3.42877 63.546000 Cu 0.168908 0.969257 0.5 193 63.546 0.389975 -3.47491 63.546000 Cu 0.263289 0.970721 1 191 63.546 0.509554 -3.49946 63.546000 Cu 0.366188 0.973884 0.5 197 63.546 4.02046 -3.42843 63.546000 Cu 0.253873 0.995374 0.5 209 63.546 0.98314 -3.52263 63.546000 Cu 0.348862 0.995368 4.214e-17 210 63.546 6.76428 -3.42531 63.546000 Cu 0.555551 0.995402 0.5 236 63.546 7.49146 -3.28833 63.546000 Cu 0.463691 0.979338 0 195 63.546 9.02306 -3.33743 63.546000 Cu 0.486265 0.957964 0.5 196 63.546 0.626366 -3.45121 63.546000 Cu 0.581271 0.965225 6.76649e-17 198 63.546 0.799798 -3.42877 63.546000 Cu 0.656074 0.995387 1 211 63.546 1.49087 -3.49059 63.546000 Cu 0.668908 0.969257 0.5 200 63.546 0.389975 -3.47491 63.546000 Cu 0.763289 0.970721 2.67288e-17 202 63.546 0.509554 -3.49946 63.546000 Cu 0.753873 0.995374 0.5 205 63.546 0.98314 -3.52263 63.546000 Cu 0.986265 0.957964 0.5 189 63.546 0.626366 -3.45121 63.546000 Cu 0.848862 0.995368 1 203 63.546 6.76428 -3.42531 63.546000 Cu 0.866188 0.973884 0.5 204 63.546 4.02046 -3.42843 63.546000 Cu 0.963691 0.979338 1.13176e-17 206 63.546 9.02306 -3.33743