Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.3598 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.4059 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62437 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 0.0797377 0.0455425 1 225 63.546 0.74632 -3.29714 63.546000 Cu 0.0482807 0.0145497 0.5 226 63.546 8.40665 -3.88 63.546000 Cu 0.148304 0.0145475 1 228 63.546 2.49529 -3.62943 63.546000 Cu 0.260015 0.0387327 1 229 63.546 0.676374 -3.39911 63.546000 Cu 0.250681 0.0145721 0.5 230 63.546 1.32598 -3.38999 63.546000 Cu 0.164443 0.040463 0.5 231 63.546 0.618542 -3.40807 63.546000 Cu 0.188546 0.0669736 1 249 63.546 0.127635 -3.40711 63.546000 Cu 0.28294 0.0618195 0.5 251 63.546 0.157988 -3.51657 63.546000 Cu 0.0970675 0.0714119 0.5 247 63.546 0.109594 -3.42319 63.546000 Cu 0.34771 0.0145756 1 232 63.546 7.12944 -2.75101 63.546000 Cu 0.648304 0.0145475 1 210 63.546 2.49529 -3.62943 63.546000 Cu 0.548281 0.0145497 0.5 211 63.546 8.40665 -3.88 63.546000 Cu 0.579738 0.0455425 1 216 63.546 0.74632 -3.29714 63.546000 Cu 0.664443 0.040463 0.5 218 63.546 0.618542 -3.40807 63.546000 Cu 0.466234 0.0302053 1 233 63.546 9.21092 -3.01402 63.546000 Cu 0.368945 0.0347388 0.5 235 63.546 3.67585 -3.32061 63.546000 Cu 0.381783 0.0576211 1 253 63.546 0.11082 -3.46017 63.546000 Cu 0.486107 0.0522571 0.5 255 63.546 0.779405 -3.34297 63.546000 Cu 0.597068 0.0714119 0.5 219 63.546 0.109594 -3.42319 63.546000 Cu 0.688546 0.0669736 1 217 63.546 0.127635 -3.40711 63.546000 Cu 0.84771 0.0145756 1 212 63.546 7.12944 -2.75101 63.546000 Cu 0.750681 0.0145721 0.5 213 63.546 1.32598 -3.38999 63.546000 Cu 0.760015 0.0387327 1 220 63.546 0.676374 -3.39911 63.546000 Cu 0.881783 0.0576211 1 221 63.546 0.11082 -3.46017 63.546000 Cu 0.868945 0.0347388 0.5 222 63.546 3.67585 -3.32061 63.546000 Cu 0.78294 0.0618195 0.5 223 63.546 0.157988 -3.51657 63.546000 Cu 0.966234 0.0302053 1 224 63.546 9.21092 -3.01402 63.546000 Cu 0.986107 0.0522571 0.5 227 63.546 0.779405 -3.34297 63.546000 Cu 0.11393 0.095956 1 246 63.546 0.018401 -3.46656 63.546000 Cu 0.305359 0.0860299 1 250 63.546 0.00803705 -3.4897 63.546000 Cu 0.210126 0.0912498 0.5 252 63.546 0.0268941 -3.45888 63.546000 Cu 0.0368114 0.124593 1 267 63.546 0.00304583 -3.48931 63.546000 Cu 0.132931 0.11997 0.5 269 63.546 0.00447203 -3.48719 63.546000 Cu 0.229682 0.115144 1 271 63.546 0.00276489 -3.48491 63.546000 Cu 0.326383 0.109994 0.5 273 63.546 0.00514874 -3.4942 63.546000 Cu 0.24912 0.139035 0.5 274 63.546 0.000766538 -3.49824 63.546000 Cu 0.000803532 0.0758408 1 245 63.546 0.055523 -3.50846 63.546000 Cu 0.0180751 0.100182 0.5 248 63.546 0.00663853 -3.50227 63.546000 Cu 0.345629 0.134083 1.21571e-16 272 63.546 0.0029647 -3.49783 63.546000 Cu 0.536811 0.124593 4.30765e-17 236 63.546 0.00304583 -3.48931 63.546000 Cu 0.61393 0.095956 1 237 63.546 0.018401 -3.46656 63.546000 Cu 0.632931 0.11997 0.5 240 63.546 0.00447203 -3.48719 63.546000 Cu 0.500804 0.0758408 1 254 63.546 0.055523 -3.50846 63.546000 Cu 0.402641 0.0807343 0.5 256 63.546 0.0425012 -3.52204 63.546000 Cu 0.422301 0.104848 1 275 63.546 0.0115216 -3.50977 63.546000 Cu 0.518075 0.100182 0.5 276 63.546 0.00663853 -3.50227 63.546000 Cu 0.441432 0.129238 0.5 277 63.546 0.0012326 -3.4941 63.546000 Cu 0.729682 0.115144 1 238 63.546 0.00276489 -3.48491 63.546000 Cu 0.710126 0.0912498 0.5 239 63.546 0.0268941 -3.45888 63.546000 Cu 0.805359 0.0860299 1 241 63.546 0.00803705 -3.4897 63.546000 Cu 0.922301 0.104848 1 242 63.546 0.0115216 -3.50977 63.546000 Cu 0.902641 0.0807343 0.5 243 63.546 0.0425012 -3.52204 63.546000 Cu 0.826383 0.109994 0.5 244 63.546 0.00514874 -3.4942 63.546000 Cu 0.74912 0.139035 0.5 261 63.546 0.000766538 -3.49824 63.546000 Cu 0.845629 0.134083 1 263 63.546 0.0029647 -3.49783 63.546000 Cu 0.941432 0.129238 0.5 265 63.546 0.0012326 -3.4941 63.546000 Cu 0.152458 0.143963 1.62494e-16 268 63.546 0.000773523 -3.49464 63.546000 Cu 0.0562544 0.148801 0.5 270 63.546 0.00143004 -3.48971 63.546000 Cu 0.0757954 0.172899 6.72472e-17 288 63.546 0.000249223 -3.49301 63.546000 Cu 0.191537 0.192095 2.39314e-19 289 63.546 0.000226633 -3.49615 63.546000 Cu 0.1721 0.168 0.5 290 63.546 0.000135715 -3.49669 63.546000 Cu 0.095343 0.196982 0.5 291 63.546 1.88999e-05 -3.49516 63.546000 Cu 0.26839 0.163096 2.39314e-19 292 63.546 0.000750776 -3.49911 63.546000 Cu 0.28766 0.187255 0.5 295 63.546 0.000219465 -3.49587 63.546000 Cu 0.306937 0.211439 9.74008e-17 314 63.546 3.00358e-05 -3.49421 63.546000 Cu 0.575795 0.172899 1.4287e-16 257 63.546 0.000249223 -3.49301 63.546000 Cu 0.556254 0.148801 0.5 258 63.546 0.00143004 -3.48971 63.546000 Cu 0.652458 0.143963 1.21332e-16 259 63.546 0.000773523 -3.49464 63.546000 Cu 0.595343 0.196982 0.5 279 63.546 1.88999e-05 -3.49516 63.546000 Cu 0.383646 0.182486 9.3811e-17 293 63.546 7.5591e-05 -3.49381 63.546000 Cu 0.364536 0.158272 0.5 294 63.546 0.000490288 -3.49592 63.546000 Cu 0.460396 0.153545 1.56272e-16 296 63.546 0.000468125 -3.48985 63.546000 Cu 0.479642 0.177726 0.5 297 63.546 0.000475635 -3.49196 63.546000 Cu 0.402966 0.206656 0.5 316 63.546 0.000143543 -3.49384 63.546000 Cu 0.499132 0.201847 0 318 63.546 0.000129787 -3.49426 63.546000 Cu 0.6721 0.168 0.5 262 63.546 0.000135715 -3.49669 63.546000 Cu 0.691537 0.192095 1.45981e-16 280 63.546 0.000226633 -3.49615 63.546000 Cu 0.76839 0.163096 5.55208e-17 260 63.546 0.000750776 -3.49911 63.546000 Cu 0.960396 0.153545 1 264 63.546 0.000468125 -3.48985 63.546000 Cu 0.864536 0.158272 0.5 266 63.546 0.000490288 -3.49592 63.546000 Cu 0.806937 0.211439 7.65804e-18 281 63.546 3.00358e-05 -3.49421 63.546000 Cu 0.78766 0.187255 0.5 282 63.546 0.000219465 -3.49587 63.546000 Cu 0.883646 0.182486 9.57256e-19 284 63.546 7.5591e-05 -3.49381 63.546000 Cu 0.999132 0.201847 1.24443e-16 285 63.546 0.000129787 -3.49426 63.546000 Cu 0.979642 0.177726 0.5 286 63.546 0.000475635 -3.49196 63.546000 Cu 0.902966 0.206656 0.5 287 63.546 0.000143543 -3.49384 63.546000 Cu 0.0380789 0.250068 1 307 63.546 1.55245e-05 -3.49565 63.546000 Cu 0.114832 0.22109 2.39314e-19 310 63.546 7.13882e-05 -3.49586 63.546000 Cu 0.230339 0.240416 0 311 63.546 1.63472e-05 -3.4945 63.546000 Cu 0.210952 0.216245 0.5 312 63.546 0.000118139 -3.49536 63.546000 Cu 0.134252 0.245222 0.5 313 63.546 7.91574e-05 -3.49529 63.546000 Cu 0.326351 0.235619 0.5 317 63.546 4.9059e-05 -3.49392 63.546000 Cu 0.0575557 0.274195 0.5 330 63.546 6.0764e-05 -3.49498 63.546000 Cu 0.153633 0.269372 0 332 63.546 3.58507e-05 -3.49435 63.546000 Cu 0.249716 0.26458 0.5 334 63.546 9.59878e-06 -3.49396 63.546000 Cu 0.0186055 0.225951 0.5 308 63.546 9.01526e-06 -3.49571 63.546000 Cu 0.345807 0.25977 1.21332e-16 336 63.546 5.13059e-05 -3.49413 63.546000 Cu 0.614832 0.22109 4.73842e-17 278 63.546 7.13882e-05 -3.49586 63.546000 Cu 0.538079 0.250068 0 298 63.546 1.55245e-05 -3.49565 63.546000 Cu 0.653633 0.269372 0 299 63.546 3.58507e-05 -3.49435 63.546000 Cu 0.634252 0.245222 0.5 300 63.546 7.91574e-05 -3.49529 63.546000 Cu 0.557556 0.274195 0.5 301 63.546 6.0764e-05 -3.49498 63.546000 Cu 0.422408 0.230797 8.13667e-17 315 63.546 8.59693e-05 -3.49474 63.546000 Cu 0.518605 0.225951 0.5 319 63.546 9.01526e-06 -3.49571 63.546000 Cu 0.461398 0.279054 1.43588e-18 337 63.546 7.0142e-06 -3.49572 63.546000 Cu 0.441912 0.254929 0.5 338 63.546 2.13769e-05 -3.49513 63.546000 Cu 0.365193 0.283907 0.5 339 63.546 5.34262e-05 -3.49513 63.546000 Cu 0.710952 0.216245 0.5 283 63.546 0.000118139 -3.49536 63.546000 Cu 0.730339 0.240416 0 302 63.546 1.63472e-05 -3.4945 63.546000 Cu 0.845807 0.25977 6.62899e-17 303 63.546 5.13059e-05 -3.49413 63.546000 Cu 0.826351 0.235619 0.5 304 63.546 4.9059e-05 -3.49392 63.546000 Cu 0.749716 0.26458 0.5 305 63.546 9.59878e-06 -3.49396 63.546000 Cu 0.922408 0.230797 2.03417e-17 306 63.546 8.59693e-05 -3.49474 63.546000 Cu 0.941912 0.254929 0.5 309 63.546 2.13769e-05 -3.49513 63.546000 Cu 0.865193 0.283907 0.5 326 63.546 5.34262e-05 -3.49513 63.546000 Cu 0.961398 0.279054 1.10084e-17 328 63.546 7.0142e-06 -3.49572 63.546000 Cu 0.0770058 0.298341 0 329 63.546 7.71612e-05 -3.49434 63.546000 Cu 0.269091 0.288732 1.21811e-16 333 63.546 3.32278e-05 -3.49419 63.546000 Cu 0.173059 0.293536 0.5 335 63.546 8.39537e-06 -3.49406 63.546000 Cu 0.115638 0.346661 1 350 63.546 2.93538e-05 -3.49335 63.546000 Cu 0.0963588 0.322489 0.5 351 63.546 6.28399e-05 -3.49331 63.546000 Cu 0.192414 0.317707 0 353 63.546 4.63247e-05 -3.49422 63.546000 Cu 0.307829 0.337022 4.78628e-19 354 63.546 9.07357e-05 -3.49664 63.546000 Cu 0.288473 0.312886 0.5 355 63.546 8.54789e-05 -3.49513 63.546000 Cu 0.211652 0.341878 0.5 356 63.546 0.000208442 -3.49623 63.546000 Cu 0.000230655 0.327289 4.78628e-19 349 63.546 0.00011367 -3.49412 63.546000 Cu 0.0196301 0.351418 0.5 352 63.546 0.000303313 -3.49166 63.546000 Cu 0.577006 0.298341 1 320 63.546 7.71612e-05 -3.49434 63.546000 Cu 0.596359 0.322489 0.5 323 63.546 6.28399e-05 -3.49331 63.546000 Cu 0.615638 0.346661 1 341 63.546 2.93538e-05 -3.49335 63.546000 Cu 0.384621 0.308028 1 357 63.546 1.6828e-05 -3.49571 63.546000 Cu 0.500231 0.327289 1.19657e-18 358 63.546 0.00011367 -3.49412 63.546000 Cu 0.480857 0.303171 0.5 359 63.546 4.71988e-05 -3.49545 63.546000 Cu 0.404037 0.332141 0.5 360 63.546 1.64992e-05 -3.49532 63.546000 Cu 0.423478 0.356238 4.54696e-18 379 63.546 0.000207087 -3.49268 63.546000 Cu 0.51963 0.351418 0.5 380 63.546 0.000303313 -3.49166 63.546000 Cu 0.692414 0.317707 3.11108e-18 321 63.546 4.63247e-05 -3.49422 63.546000 Cu 0.673059 0.293536 0.5 322 63.546 8.39537e-06 -3.49406 63.546000 Cu 0.769091 0.288732 6.50934e-17 324 63.546 3.32278e-05 -3.49419 63.546000 Cu 0.884621 0.308028 1 325 63.546 1.6828e-05 -3.49571 63.546000 Cu 0.788473 0.312886 0.5 327 63.546 8.54789e-05 -3.49513 63.546000 Cu 0.980857 0.303171 0.5 331 63.546 4.71988e-05 -3.49545 63.546000 Cu 0.711652 0.341878 0.5 343 63.546 0.000208442 -3.49623 63.546000 Cu 0.807829 0.337022 7.17942e-19 345 63.546 9.07357e-05 -3.49664 63.546000 Cu 0.923478 0.356238 1 346 63.546 0.000207087 -3.49268 63.546000 Cu 0.904037 0.332141 0.5 347 63.546 1.64992e-05 -3.49532 63.546000 Cu 0.0389113 0.375594 6.9401e-17 371 63.546 0.000391637 -3.49031 63.546000 Cu 0.153863 0.395046 1.13913e-16 372 63.546 0.00251146 -3.4977 63.546000 Cu 0.134809 0.37086 0.5 373 63.546 0.000417552 -3.4957 63.546000 Cu 0.0580634 0.399899 0.5 374 63.546 0.00114258 -3.49493 63.546000 Cu 0.230945 0.366032 2.96749e-17 375 63.546 0.000585616 -3.49911 63.546000 Cu 0.327234 0.36113 0.5 377 63.546 0.000127654 -3.49693 63.546000 Cu 0.250305 0.3901 0.5 378 63.546 0.000650194 -3.49754 63.546000 Cu 0.0772795 0.424275 9.71614e-17 392 63.546 0.01047 -3.51055 63.546000 Cu 0.173245 0.419142 0.5 394 63.546 0.00424709 -3.4946 63.546000 Cu 0.269862 0.414011 5.21704e-17 396 63.546 0.00248852 -3.48493 63.546000 Cu 0.346897 0.385177 8.66316e-17 376 63.546 0.000646683 -3.49426 63.546000 Cu 0.538911 0.375594 2.65638e-17 340 63.546 0.000391637 -3.49031 63.546000 Cu 0.634809 0.37086 0.5 344 63.546 0.000417552 -3.4957 63.546000 Cu 0.57728 0.424275 1 361 63.546 0.01047 -3.51055 63.546000 Cu 0.558063 0.399899 0.5 362 63.546 0.00114258 -3.49493 63.546000 Cu 0.653863 0.395046 1 363 63.546 0.00251146 -3.4977 63.546000 Cu 0.443068 0.380341 0.5 381 63.546 0.0012085 -3.48978 63.546000 Cu 0.366509 0.409183 0.5 398 63.546 0.00395895 -3.48762 63.546000 Cu 0.462626 0.40455 3.11108e-18 400 63.546 0.0027789 -3.49008 63.546000 Cu 0.673245 0.419142 0.5 366 63.546 0.00424709 -3.4946 63.546000 Cu 0.730945 0.366032 1.10084e-17 342 63.546 0.000585616 -3.49911 63.546000 Cu 0.827234 0.36113 0.5 348 63.546 0.000127654 -3.49693 63.546000 Cu 0.769862 0.414011 1 364 63.546 0.00248852 -3.48493 63.546000 Cu 0.750305 0.3901 0.5 365 63.546 0.000650194 -3.49754 63.546000 Cu 0.846897 0.385177 6.27002e-17 367 63.546 0.000646683 -3.49426 63.546000 Cu 0.962626 0.40455 7.92129e-17 368 63.546 0.0027789 -3.49008 63.546000 Cu 0.943068 0.380341 0.5 369 63.546 0.0012085 -3.48978 63.546000 Cu 0.866509 0.409183 0.5 370 63.546 0.00395895 -3.48762 63.546000 Cu 0.311178 0.462198 2.15383e-18 208 63.546 0.125795 -3.40715 63.546000 Cu 0.194308 0.443127 1.22768e-16 393 63.546 0.00804079 -3.48999 63.546000 Cu 0.0970069 0.448394 0.5 395 63.546 0.0396918 -3.52211 63.546000 Cu 0.289497 0.437939 0.5 399 63.546 0.0238784 -3.45892 63.546000 Cu 0.117983 0.471535 2.22562e-17 409 63.546 0.110904 -3.46214 63.546000 Cu 0.239857 0.490439 2.39314e-18 410 63.546 0.668342 -3.39725 63.546000 Cu 0.216672 0.46736 0.5 411 63.546 0.15255 -3.51793 63.546000 Cu 0.130857 0.49449 0.5 412 63.546 3.71811 -3.32458 63.546000 Cu 0.013797 0.476873 0.5 408 63.546 0.77694 -3.34437 63.546000 Cu 0.0337511 0.498954 3.82902e-18 407 63.546 9.23403 -3.0144 63.546000 Cu 0.481444 0.428953 0.5 401 63.546 0.00576814 -3.50253 63.546000 Cu 0.335477 0.488687 0.5 7 63.546 0.616725 -3.40777 63.546000 Cu 0.513797 0.476873 0.5 1 63.546 0.77694 -3.34437 63.546000 Cu 0.498907 0.453294 1 3 63.546 0.0535745 -3.50755 63.546000 Cu 0.402681 0.457747 0.5 9 63.546 0.107401 -3.42209 63.546000 Cu 0.420199 0.483589 1 204 63.546 0.748425 -3.29755 63.546000 Cu 0.617983 0.471535 1 382 63.546 0.110904 -3.46214 63.546000 Cu 0.597007 0.448394 0.5 383 63.546 0.0396918 -3.52211 63.546000 Cu 0.385622 0.433213 1 397 63.546 0.0169471 -3.46621 63.546000 Cu 0.630857 0.49449 0.5 403 63.546 3.71811 -3.32458 63.546000 Cu 0.533751 0.498954 1 402 63.546 9.23403 -3.0144 63.546000 Cu 0.981444 0.428953 0.5 390 63.546 0.00576814 -3.50253 63.546000 Cu 0.694308 0.443127 1 384 63.546 0.00804079 -3.48999 63.546000 Cu 0.811178 0.462198 1 385 63.546 0.125795 -3.40715 63.546000 Cu 0.789497 0.437939 0.5 386 63.546 0.0238784 -3.45892 63.546000 Cu 0.716672 0.46736 0.5 387 63.546 0.15255 -3.51793 63.546000 Cu 0.885622 0.433213 1 388 63.546 0.0169471 -3.46621 63.546000 Cu 0.998907 0.453294 1.93844e-17 389 63.546 0.0535745 -3.50755 63.546000 Cu 0.902681 0.457747 0.5 391 63.546 0.107401 -3.42209 63.546000 Cu 0.739857 0.490439 1 404 63.546 0.668342 -3.39725 63.546000 Cu 0.835477 0.488687 0.5 405 63.546 0.616725 -3.40777 63.546000 Cu 0.920199 0.483589 1 406 63.546 0.748425 -3.29755 63.546000 Cu 0.152558 0.514611 1 2 63.546 7.132 -2.75067 63.546000 Cu 0.249512 0.51459 0.5 5 63.546 1.31469 -3.38918 63.546000 Cu 0.0341342 0.530238 3.11108e-18 18 63.546 9.20253 -3.01358 63.546000 Cu 0.118601 0.557652 1 19 63.546 0.111016 -3.45964 63.546000 Cu 0.131405 0.534783 0.5 20 63.546 3.66632 -3.32012 63.546000 Cu 0.0142323 0.552285 0.5 21 63.546 0.778393 -3.34282 63.546000 Cu 0.240329 0.53876 8.9982e-17 22 63.546 0.67992 -3.40022 63.546000 Cu 0.217463 0.561856 0.5 25 63.546 0.158716 -3.51695 63.546000 Cu 0.311858 0.566997 1.38563e-16 23 63.546 0.128628 -3.4068 63.546000 Cu 0.351918 0.514569 3.51791e-17 4 63.546 2.48482 -3.62941 63.546000 Cu 0.451996 0.5146 0.5 6 63.546 8.41211 -3.8812 63.546000 Cu 0.534134 0.530238 1 8 63.546 9.20253 -3.01358 63.546000 Cu 0.631405 0.534783 0.5 13 63.546 3.66632 -3.32012 63.546000 Cu 0.335866 0.540467 0.5 24 63.546 0.61921 -3.40853 63.546000 Cu 0.420563 0.545556 1 26 63.546 0.745869 -3.29841 63.546000 Cu 0.514232 0.552285 0.5 29 63.546 0.778393 -3.34282 63.546000 Cu 0.618601 0.557652 1 30 63.546 0.111016 -3.45964 63.546000 Cu 0.652558 0.514611 1 10 63.546 7.132 -2.75067 63.546000 Cu 0.403287 0.571426 0.5 27 63.546 0.110074 -3.4228 63.546000 Cu 0.740329 0.53876 1 11 63.546 0.67992 -3.40022 63.546000 Cu 0.749512 0.51459 0.5 12 63.546 1.31469 -3.38918 63.546000 Cu 0.851918 0.514569 1 14 63.546 2.48482 -3.62941 63.546000 Cu 0.920563 0.545556 1 15 63.546 0.745869 -3.29841 63.546000 Cu 0.951996 0.5146 0.5 16 63.546 8.41211 -3.8812 63.546000 Cu 0.835866 0.540467 0.5 17 63.546 0.61921 -3.40853 63.546000 Cu 0.717463 0.561856 0.5 32 63.546 0.158716 -3.51695 63.546000 Cu 0.811858 0.566997 1 34 63.546 0.128628 -3.4068 63.546000 Cu 0.903287 0.571426 0.5 36 63.546 0.110074 -3.4228 63.546000 Cu 0.078089 0.604865 1.22529e-16 39 63.546 0.011766 -3.51018 63.546000 Cu 0.0977567 0.580755 0.5 40 63.546 0.0429288 -3.52216 63.546000 Cu 0.195075 0.586055 1.31623e-16 42 63.546 0.00804111 -3.48962 63.546000 Cu 0.270713 0.615164 1.23007e-16 43 63.546 0.0027118 -3.48502 63.546000 Cu 0.290322 0.591282 0.5 44 63.546 0.0274451 -3.45856 63.546000 Cu 0.174009 0.610009 0.5 45 63.546 0.00530469 -3.49408 63.546000 Cu 0.058947 0.629254 0.5 60 63.546 0.00126298 -3.49428 63.546000 Cu 0.154735 0.634099 2.24955e-16 62 63.546 0.0030011 -3.49791 63.546000 Cu 0.251214 0.639048 0.5 64 63.546 0.00087214 -3.49848 63.546000 Cu 0.499564 0.575853 1 28 63.546 0.0567381 -3.50856 63.546000 Cu 0.597757 0.580755 0.5 33 63.546 0.0429288 -3.52216 63.546000 Cu 0.386489 0.595976 1.24204e-16 46 63.546 0.0185656 -3.46657 63.546000 Cu 0.367489 0.620001 0.5 47 63.546 0.00504721 -3.48742 63.546000 Cu 0.463582 0.624616 1.24443e-16 48 63.546 0.00314012 -3.48924 63.546000 Cu 0.482314 0.600198 0.5 49 63.546 0.00687176 -3.50272 63.546000 Cu 0.578089 0.604865 5.98285e-18 50 63.546 0.011766 -3.51018 63.546000 Cu 0.558947 0.629254 0.5 53 63.546 0.00126298 -3.49428 63.546000 Cu 0.654735 0.634099 2.30459e-16 51 63.546 0.0030011 -3.49791 63.546000 Cu 0.999564 0.575853 2.39314e-18 38 63.546 0.0567381 -3.50856 63.546000 Cu 0.982314 0.600198 0.5 41 63.546 0.00687176 -3.50272 63.546000 Cu 0.695075 0.586055 1 31 63.546 0.00804111 -3.48962 63.546000 Cu 0.886489 0.595976 3.11108e-18 35 63.546 0.0185656 -3.46657 63.546000 Cu 0.790322 0.591282 0.5 37 63.546 0.0274451 -3.45856 63.546000 Cu 0.674009 0.610009 0.5 52 63.546 0.00530469 -3.49408 63.546000 Cu 0.770713 0.615164 3.75723e-17 54 63.546 0.0027118 -3.48502 63.546000 Cu 0.867489 0.620001 0.5 56 63.546 0.00504721 -3.48742 63.546000 Cu 0.751214 0.639048 0.5 57 63.546 0.00087214 -3.49848 63.546000 Cu 0.963582 0.624616 1.17503e-16 58 63.546 0.00314012 -3.48924 63.546000 Cu 0.0399496 0.653566 3.41022e-16 59 63.546 0.000483517 -3.49006 63.546000 Cu 0.231928 0.663106 1.2205e-16 63 63.546 0.000829651 -3.49899 63.546000 Cu 0.135775 0.65829 0.5 65 63.546 0.000494148 -3.49587 63.546000 Cu 0.00121319 0.701856 1.22289e-16 79 63.546 0.000133334 -3.49419 63.546000 Cu 0.0206822 0.67775 0.5 80 63.546 0.000559987 -3.4918 63.546000 Cu 0.116701 0.682498 1.23486e-16 82 63.546 9.36212e-05 -3.49377 63.546000 Cu 0.19339 0.711449 2.63245e-18 83 63.546 1.12505e-05 -3.49433 63.546000 Cu 0.212684 0.687261 0.5 84 63.546 0.000249207 -3.49597 63.546000 Cu 0.0973845 0.706665 0.5 85 63.546 0.000162993 -3.49396 63.546000 Cu 0.328229 0.668009 0.5 69 63.546 0.000177221 -3.49683 63.546000 Cu 0.308768 0.692103 1.19657e-18 86 63.546 0.000265434 -3.49641 63.546000 Cu 0.347898 0.643986 2.44339e-16 66 63.546 0.00081212 -3.49475 63.546000 Cu 0.424532 0.672922 1.19657e-18 67 63.546 0.000310607 -3.49309 63.546000 Cu 0.444113 0.648825 0.5 68 63.546 0.00157588 -3.48972 63.546000 Cu 0.53995 0.653566 2.87177e-18 70 63.546 0.000483517 -3.49006 63.546000 Cu 0.616701 0.682498 1.56033e-16 71 63.546 9.36212e-05 -3.49377 63.546000 Cu 0.635775 0.65829 0.5 72 63.546 0.000494148 -3.49587 63.546000 Cu 0.520682 0.67775 0.5 73 63.546 0.000559987 -3.4918 63.546000 Cu 0.40497 0.696993 0.5 88 63.546 3.47087e-05 -3.49529 63.546000 Cu 0.501213 0.701856 2.43143e-16 90 63.546 0.000133334 -3.49419 63.546000 Cu 0.597385 0.706665 0.5 92 63.546 0.000162993 -3.49396 63.546000 Cu 0.847898 0.643986 1.21811e-16 55 63.546 0.00081212 -3.49475 63.546000 Cu 0.944113 0.648825 0.5 61 63.546 0.00157588 -3.48972 63.546000 Cu 0.731928 0.663106 1.21093e-16 74 63.546 0.000829651 -3.49899 63.546000 Cu 0.808768 0.692103 2.45536e-16 75 63.546 0.000265434 -3.49641 63.546000 Cu 0.828229 0.668009 0.5 76 63.546 0.000177221 -3.49683 63.546000 Cu 0.712684 0.687261 0.5 77 63.546 0.000249207 -3.49597 63.546000 Cu 0.924532 0.672922 2.43382e-16 78 63.546 0.000310607 -3.49309 63.546000 Cu 0.90497 0.696993 0.5 81 63.546 3.47087e-05 -3.49529 63.546000 Cu 0.69339 0.711449 2.8239e-16 94 63.546 1.12505e-05 -3.49433 63.546000 Cu 0.28938 0.716248 0.5 89 63.546 0.000140407 -3.49531 63.546000 Cu 0.0779439 0.7308 2.441e-16 102 63.546 8.13838e-05 -3.49493 63.546000 Cu 0.154678 0.759755 1.23486e-16 103 63.546 5.87695e-05 -3.4942 63.546000 Cu 0.174037 0.735617 0.5 104 63.546 5.83173e-05 -3.49408 63.546000 Cu 0.0585035 0.754919 0.5 105 63.546 3.0956e-05 -3.49531 63.546000 Cu 0.270088 0.740407 1.23965e-16 106 63.546 1.05459e-05 -3.49423 63.546000 Cu 0.250785 0.764557 0.5 109 63.546 1.29423e-05 -3.49379 63.546000 Cu 0.0391234 0.779025 1.23007e-16 122 63.546 3.0898e-06 -3.49557 63.546000 Cu 0.13533 0.783873 0.5 124 63.546 5.5139e-05 -3.49503 63.546000 Cu 0.385524 0.721088 2.39314e-18 87 63.546 8.7427e-05 -3.49575 63.546000 Cu 0.577944 0.7308 2.89091e-16 91 63.546 8.13838e-05 -3.49493 63.546000 Cu 0.481758 0.725952 0.5 93 63.546 1.12878e-05 -3.49559 63.546000 Cu 0.346858 0.769352 2.34767e-16 107 63.546 2.64255e-05 -3.49409 63.546000 Cu 0.366168 0.745209 0.5 108 63.546 8.98701e-05 -3.49469 63.546000 Cu 0.442925 0.774171 0.5 110 63.546 6.58383e-05 -3.49472 63.546000 Cu 0.462311 0.750056 2.43861e-16 111 63.546 2.95699e-05 -3.49522 63.546000 Cu 0.539123 0.779025 1.22289e-16 112 63.546 3.0898e-06 -3.49557 63.546000 Cu 0.558504 0.754919 0.5 113 63.546 3.0956e-05 -3.49531 63.546000 Cu 0.63533 0.783873 0.5 117 63.546 5.5139e-05 -3.49503 63.546000 Cu 0.654678 0.759755 2.43382e-16 114 63.546 5.87695e-05 -3.4942 63.546000 Cu 0.981758 0.725952 0.5 100 63.546 1.12878e-05 -3.49559 63.546000 Cu 0.770088 0.740407 1.22768e-16 95 63.546 1.05459e-05 -3.49423 63.546000 Cu 0.78938 0.716248 0.5 96 63.546 0.000140407 -3.49531 63.546000 Cu 0.674037 0.735617 0.5 97 63.546 5.83173e-05 -3.49408 63.546000 Cu 0.885524 0.721088 2.66117e-16 98 63.546 8.7427e-05 -3.49575 63.546000 Cu 0.962311 0.750056 1.2205e-16 99 63.546 2.95699e-05 -3.49522 63.546000 Cu 0.866168 0.745209 0.5 101 63.546 8.98701e-05 -3.49469 63.546000 Cu 0.750785 0.764557 0.5 116 63.546 1.29423e-05 -3.49379 63.546000 Cu 0.846858 0.769352 2.43622e-16 118 63.546 2.64255e-05 -3.49409 63.546000 Cu 0.942925 0.774171 0.5 120 63.546 6.58383e-05 -3.49472 63.546000 Cu 0.115903 0.807991 9.57256e-19 123 63.546 2.54133e-05 -3.4958 63.546000 Cu 0.0196925 0.803126 0.5 125 63.546 4.35217e-05 -3.4951 63.546000 Cu 0.231426 0.788699 1.22768e-16 126 63.546 2.88249e-05 -3.49389 63.546000 Cu 0.212051 0.812838 0.5 129 63.546 7.41502e-05 -3.49482 63.546000 Cu 0.00028646 0.827237 7.17942e-19 142 63.546 0.000117618 -3.49409 63.546000 Cu 0.0770548 0.856177 4.78628e-19 143 63.546 0.000237416 -3.4927 63.546000 Cu 0.0964768 0.83209 0.5 144 63.546 1.2281e-05 -3.49526 63.546000 Cu 0.192716 0.836965 0 146 63.546 0.000115052 -3.4965 63.546000 Cu 0.288859 0.841809 0.5 148 63.546 0.000143886 -3.49603 63.546000 Cu 0.308126 0.817648 1.94562e-16 127 63.546 1.68865e-05 -3.49372 63.546000 Cu 0.32746 0.793501 0.5 128 63.546 8.83849e-06 -3.49376 63.546000 Cu 0.423561 0.798299 1.22289e-16 130 63.546 4.66768e-05 -3.49404 63.546000 Cu 0.404179 0.822434 0.5 131 63.546 5.27854e-05 -3.49343 63.546000 Cu 0.500286 0.827237 1.21332e-16 132 63.546 0.000117618 -3.49409 63.546000 Cu 0.519692 0.803126 0.5 133 63.546 4.35217e-05 -3.4951 63.546000 Cu 0.615903 0.807991 1.22768e-16 134 63.546 2.54133e-05 -3.4958 63.546000 Cu 0.596477 0.83209 0.5 137 63.546 1.2281e-05 -3.49526 63.546000 Cu 0.384842 0.846598 1.66084e-16 150 63.546 5.46216e-05 -3.4937 63.546000 Cu 0.480895 0.851361 0.5 153 63.546 0.000260217 -3.49195 63.546000 Cu 0.577055 0.856177 9.30931e-17 154 63.546 0.000237416 -3.4927 63.546000 Cu 0.980895 0.851361 0.5 145 63.546 0.000260217 -3.49195 63.546000 Cu 0.731426 0.788699 1.91451e-18 115 63.546 2.88249e-05 -3.49389 63.546000 Cu 0.923561 0.798299 1.21093e-16 119 63.546 4.66768e-05 -3.49404 63.546000 Cu 0.82746 0.793501 0.5 121 63.546 8.83849e-06 -3.49376 63.546000 Cu 0.692716 0.836965 1.23007e-16 135 63.546 0.000115052 -3.4965 63.546000 Cu 0.712051 0.812838 0.5 136 63.546 7.41502e-05 -3.49482 63.546000 Cu 0.808126 0.817648 9.57256e-19 138 63.546 1.68865e-05 -3.49372 63.546000 Cu 0.884842 0.846598 1.21332e-16 139 63.546 5.46216e-05 -3.4937 63.546000 Cu 0.904179 0.822434 0.5 140 63.546 5.27854e-05 -3.49343 63.546000 Cu 0.788859 0.841809 0.5 141 63.546 0.000143886 -3.49603 63.546000 Cu 0.269542 0.865969 9.57256e-19 147 63.546 0.000594502 -3.49909 63.546000 Cu 0.173286 0.86107 0.5 149 63.546 0.00014041 -3.49675 63.546000 Cu 0.0377521 0.904494 1.43588e-18 163 63.546 0.00282047 -3.49018 63.546000 Cu 0.0574265 0.880278 0.5 164 63.546 0.00119597 -3.48983 63.546000 Cu 0.153569 0.885116 1 166 63.546 0.000649563 -3.49429 63.546000 Cu 0.2305 0.913951 2.39314e-18 167 63.546 0.00251505 -3.48536 63.546000 Cu 0.250176 0.890037 0.5 168 63.546 0.000747541 -3.4979 63.546000 Cu 0.133852 0.909121 0.5 169 63.546 0.00411326 -3.48777 63.546000 Cu 0.327094 0.919085 0.5 173 63.546 0.00425756 -3.49456 63.546000 Cu 0.365692 0.870794 0.5 151 63.546 0.000393591 -3.49576 63.546000 Cu 0.461563 0.875529 9.26145e-17 152 63.546 0.000476732 -3.49047 63.546000 Cu 0.557426 0.880278 0.5 157 63.546 0.00119597 -3.48983 63.546000 Cu 0.346591 0.894982 1.6752e-18 170 63.546 0.00264137 -3.49792 63.546000 Cu 0.422989 0.924221 1 171 63.546 0.0105766 -3.5101 63.546000 Cu 0.442375 0.899837 0.5 172 63.546 0.00118657 -3.49516 63.546000 Cu 0.537752 0.904494 1.05298e-16 174 63.546 0.00282047 -3.49018 63.546000 Cu 0.633852 0.909121 0.5 176 63.546 0.00411326 -3.48777 63.546000 Cu 0.653569 0.885116 4.30765e-18 155 63.546 0.000649563 -3.49429 63.546000 Cu 0.673286 0.86107 0.5 156 63.546 0.00014041 -3.49675 63.546000 Cu 0.769542 0.865969 9.57256e-19 158 63.546 0.000594502 -3.49909 63.546000 Cu 0.846591 0.894982 1.21571e-16 159 63.546 0.00264137 -3.49792 63.546000 Cu 0.865692 0.870794 0.5 160 63.546 0.000393591 -3.49576 63.546000 Cu 0.750176 0.890037 0.5 161 63.546 0.000747541 -3.4979 63.546000 Cu 0.961563 0.875529 0 162 63.546 0.000476732 -3.49047 63.546000 Cu 0.942375 0.899837 0.5 165 63.546 0.00118657 -3.49516 63.546000 Cu 0.7305 0.913951 2.15383e-18 178 63.546 0.00251505 -3.48536 63.546000 Cu 0.827094 0.919085 0.5 180 63.546 0.00425756 -3.49456 63.546000 Cu 0.922989 0.924221 1.43588e-18 182 63.546 0.0105766 -3.5101 63.546000 Cu 0.0188241 0.928897 0.5 184 63.546 0.00607398 -3.50247 63.546000 Cu 0.00132167 0.953236 1 183 63.546 0.0531148 -3.50781 63.546000 Cu 0.114657 0.933156 1 186 63.546 0.0170786 -3.46653 63.546000 Cu 0.189057 0.962154 1 187 63.546 0.124626 -3.4073 63.546000 Cu 0.210747 0.937881 0.5 188 63.546 0.0237741 -3.45927 63.546000 Cu 0.097524 0.957703 0.5 189 63.546 0.105971 -3.42307 63.546000 Cu 0.283512 0.96731 0.5 193 63.546 0.152955 -3.51702 63.546000 Cu 0.0799894 0.983549 1 205 63.546 0.744554 -3.29879 63.546000 Cu 0.164757 0.988648 0.5 206 63.546 0.612802 -3.40821 63.546000 Cu 0.26037 0.9904 1 207 63.546 0.665812 -3.39782 63.546000 Cu 0.305937 0.943072 1 190 63.546 0.00799605 -3.48969 63.546000 Cu 0.466412 0.998912 1 209 63.546 9.23022 -3.01455 63.546000 Cu 0.369272 0.99444 0.5 234 63.546 3.69861 -3.32375 63.546000 Cu 0.518824 0.928897 0.5 177 63.546 0.00607398 -3.50247 63.546000 Cu 0.614657 0.933156 1 175 63.546 0.0170786 -3.46653 63.546000 Cu 0.382216 0.971487 1 191 63.546 0.11016 -3.46191 63.546000 Cu 0.403218 0.94834 0.5 192 63.546 0.039783 -3.52181 63.546000 Cu 0.501322 0.953236 1 194 63.546 0.0531148 -3.50781 63.546000 Cu 0.579989 0.983549 1 195 63.546 0.744554 -3.29879 63.546000 Cu 0.597524 0.957703 0.5 196 63.546 0.105971 -3.42307 63.546000 Cu 0.486366 0.976831 0.5 197 63.546 0.771682 -3.34476 63.546000 Cu 0.664757 0.988648 0.5 201 63.546 0.612802 -3.40821 63.546000 Cu 0.966412 0.998912 1 214 63.546 9.23022 -3.01455 63.546000 Cu 0.869272 0.99444 0.5 215 63.546 3.69861 -3.32375 63.546000 Cu 0.986366 0.976831 0.5 203 63.546 0.771682 -3.34476 63.546000 Cu 0.805937 0.943072 1 179 63.546 0.00799605 -3.48969 63.546000 Cu 0.710747 0.937881 0.5 181 63.546 0.0237741 -3.45927 63.546000 Cu 0.903218 0.94834 0.5 185 63.546 0.039783 -3.52181 63.546000 Cu 0.689057 0.962154 1 198 63.546 0.124626 -3.4073 63.546000 Cu 0.76037 0.9904 1 199 63.546 0.665812 -3.39782 63.546000 Cu 0.783512 0.96731 0.5 200 63.546 0.152955 -3.51702 63.546000 Cu 0.882216 0.971487 1 202 63.546 0.11016 -3.46191