Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.3807 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.7391 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61483 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 0.151504 0.00460706 4.67818e-17 214 63.546 2.1798 -3.52077 63.546000 Cu 0.0513631 0.00455718 0.5 215 63.546 8.10658 -3.45394 63.546000 Cu 0.0806931 0.0358906 4.67818e-17 222 63.546 0.761223 -3.42661 63.546000 Cu 0.166908 0.0306924 0.5 224 63.546 0.533362 -3.47483 63.546000 Cu 0.349021 0.00457769 1 216 63.546 6.77977 -3.25053 63.546000 Cu 0.25258 0.00457964 0.5 217 63.546 1.11384 -3.51499 63.546000 Cu 0.261681 0.0288798 1 226 63.546 0.611736 -3.50713 63.546000 Cu 0.3679 0.0252685 0.5 228 63.546 3.70084 -3.44971 63.546000 Cu 0.466539 0.0204619 2.17113e-17 230 63.546 9.25885 -3.2993 63.546000 Cu 0.580693 0.0358906 4.67818e-17 231 63.546 0.761223 -3.42661 63.546000 Cu 0.551363 0.00455718 0.5 232 63.546 8.10658 -3.45394 63.546000 Cu 0.485806 0.0425947 0.5 233 63.546 0.697201 -3.46818 63.546000 Cu 0.651504 0.00460706 2.99932e-19 234 63.546 2.1798 -3.52077 63.546000 Cu 0.761681 0.0288798 7.41993e-17 235 63.546 0.611736 -3.50713 63.546000 Cu 0.75258 0.00457964 0.5 236 63.546 1.11384 -3.51499 63.546000 Cu 0.666908 0.0306924 0.5 237 63.546 0.533362 -3.47483 63.546000 Cu 0.849021 0.00457769 4.67818e-17 211 63.546 6.77977 -3.25053 63.546000 Cu 0.966539 0.0204619 1.49966e-20 212 63.546 9.25885 -3.2993 63.546000 Cu 0.8679 0.0252685 0.5 213 63.546 3.70084 -3.44971 63.546000 Cu 0.985806 0.0425947 0.5 220 63.546 0.697201 -3.46818 63.546000 Cu 0.00176997 0.0660743 4.67818e-17 219 63.546 0.0456493 -3.54524 63.546000 Cu 0.097706 0.0614048 0.5 225 63.546 0.0730096 -3.51938 63.546000 Cu 0.019414 0.0903628 0.5 241 63.546 0.00539527 -3.54265 63.546000 Cu 0.115084 0.0859913 4.67818e-17 243 63.546 0.0115918 -3.53504 63.546000 Cu 0.189707 0.0570286 2.92321e-17 223 63.546 0.0977603 -3.51028 63.546000 Cu 0.383315 0.0478872 6.93592e-19 227 63.546 0.0640029 -3.53378 63.546000 Cu 0.284296 0.0522531 0.5 229 63.546 0.120098 -3.54035 63.546000 Cu 0.210845 0.0813489 0.5 245 63.546 0.0183253 -3.53218 63.546000 Cu 0.306407 0.0762726 4.67818e-17 247 63.546 0.00683353 -3.53913 63.546000 Cu 0.403748 0.0711082 0.5 249 63.546 0.0261696 -3.54637 63.546000 Cu 0.50177 0.0660743 4.67818e-17 251 63.546 0.0456493 -3.54524 63.546000 Cu 0.519414 0.0903628 0.5 254 63.546 0.00539527 -3.54265 63.546000 Cu 0.597706 0.0614048 0.5 253 63.546 0.0730096 -3.51938 63.546000 Cu 0.423465 0.0951307 2.0837e-16 248 63.546 0.00796621 -3.54335 63.546000 Cu 0.615084 0.0859913 4.67818e-17 252 63.546 0.0115918 -3.53504 63.546000 Cu 0.689707 0.0570286 3.29437e-17 255 63.546 0.0977603 -3.51028 63.546000 Cu 0.784296 0.0522531 0.5 257 63.546 0.120098 -3.54035 63.546000 Cu 0.710845 0.0813489 0.5 258 63.546 0.0183253 -3.53218 63.546000 Cu 0.883315 0.0478872 4.67818e-17 218 63.546 0.0640029 -3.53378 63.546000 Cu 0.903748 0.0711082 0.5 221 63.546 0.0261696 -3.54637 63.546000 Cu 0.806407 0.0762726 4.67818e-17 256 63.546 0.00683353 -3.53913 63.546000 Cu 0.923465 0.0951307 4.67818e-17 239 63.546 0.00796621 -3.54335 63.546000 Cu 0.0383719 0.114736 5.15995e-17 240 63.546 0.00168242 -3.53889 63.546000 Cu 0.134326 0.110087 0.5 246 63.546 0.0031943 -3.5384 63.546000 Cu 0.0580502 0.138941 0.5 263 63.546 0.00056085 -3.53894 63.546000 Cu 0.154185 0.134121 7.49829e-20 265 63.546 0.000349423 -3.53993 63.546000 Cu 0.230806 0.105283 4.67818e-17 244 63.546 0.0016166 -3.53842 63.546000 Cu 0.327293 0.100232 0.5 250 63.546 0.00234972 -3.53995 63.546000 Cu 0.250572 0.129243 0.5 267 63.546 0.000518049 -3.54077 63.546000 Cu 0.346907 0.124321 3.96247e-17 269 63.546 0.00142916 -3.54073 63.546000 Cu 0.442774 0.119439 0.5 271 63.546 0.000901296 -3.54011 63.546000 Cu 0.538372 0.114736 4.67818e-17 273 63.546 0.00168242 -3.53889 63.546000 Cu 0.55805 0.138941 0.5 276 63.546 0.00056085 -3.53894 63.546000 Cu 0.654185 0.134121 4.04908e-19 274 63.546 0.000349423 -3.53993 63.546000 Cu 0.634326 0.110087 0.5 275 63.546 0.0031943 -3.5384 63.546000 Cu 0.730806 0.105283 1.15849e-18 277 63.546 0.0016166 -3.53842 63.546000 Cu 0.750572 0.129243 0.5 279 63.546 0.000518049 -3.54077 63.546000 Cu 0.846907 0.124321 5.99863e-19 238 63.546 0.00142916 -3.54073 63.546000 Cu 0.942774 0.119439 0.5 242 63.546 0.000901296 -3.54011 63.546000 Cu 0.827293 0.100232 0.5 278 63.546 0.00234972 -3.53995 63.546000 Cu 0.0777816 0.163069 7.04839e-19 262 63.546 8.16704e-05 -3.53977 63.546000 Cu 0.173923 0.158221 0.5 268 63.546 7.0225e-05 -3.5404 63.546000 Cu 0.097311 0.187202 0.5 284 63.546 2.31191e-05 -3.5401 63.546000 Cu 0.193453 0.18236 5.39127e-18 286 63.546 2.7676e-05 -3.54016 63.546000 Cu 0.270074 0.153353 3.32174e-17 266 63.546 0.000151941 -3.54081 63.546000 Cu 0.36618 0.148503 0.5 272 63.546 0.000162194 -3.5403 63.546000 Cu 0.289558 0.177514 0.5 288 63.546 2.99312e-05 -3.54015 63.546000 Cu 0.385592 0.172683 4.67818e-17 290 63.546 2.22126e-05 -3.53986 63.546000 Cu 0.462141 0.143711 1.66612e-17 270 63.546 0.000230975 -3.53918 63.546000 Cu 0.481646 0.16788 0.5 292 63.546 5.18311e-05 -3.53956 63.546000 Cu 0.577782 0.163069 4.67818e-17 294 63.546 8.16704e-05 -3.53977 63.546000 Cu 0.597311 0.187202 0.5 297 63.546 2.31191e-05 -3.5401 63.546000 Cu 0.693453 0.18236 4.67818e-17 295 63.546 2.7676e-05 -3.54016 63.546000 Cu 0.673923 0.158221 0.5 296 63.546 7.0225e-05 -3.5404 63.546000 Cu 0.770074 0.153353 2.4107e-18 298 63.546 0.000151941 -3.54081 63.546000 Cu 0.789558 0.177514 0.5 299 63.546 2.99312e-05 -3.54015 63.546000 Cu 0.885592 0.172683 4.67818e-17 259 63.546 2.22126e-05 -3.53986 63.546000 Cu 0.86618 0.148503 0.5 260 63.546 0.000162194 -3.5403 63.546000 Cu 0.962141 0.143711 4.67818e-17 261 63.546 0.000230975 -3.53918 63.546000 Cu 0.981646 0.16788 0.5 264 63.546 5.18311e-05 -3.53956 63.546000 Cu 0.00118258 0.19203 4.67818e-17 282 63.546 3.82023e-05 -3.53993 63.546000 Cu 0.116751 0.211331 4.67818e-17 283 63.546 5.27549e-05 -3.53997 63.546000 Cu 0.0205833 0.216166 0.5 285 63.546 3.42036e-05 -3.53998 63.546000 Cu 0.135995 0.235458 0.5 306 63.546 8.47811e-06 -3.53982 63.546000 Cu 0.308967 0.201665 1.07484e-16 287 63.546 3.14749e-05 -3.53984 63.546000 Cu 0.212879 0.206492 0.5 289 63.546 5.39637e-05 -3.53987 63.546000 Cu 0.232125 0.230628 4.67818e-17 308 63.546 8.95566e-06 -3.53982 63.546000 Cu 0.328261 0.225802 0.5 310 63.546 1.306e-05 -3.53991 63.546000 Cu 0.501183 0.19203 4.67818e-17 291 63.546 3.82023e-05 -3.53993 63.546000 Cu 0.405079 0.196844 0.5 293 63.546 4.19261e-05 -3.53983 63.546000 Cu 0.424419 0.220984 4.67818e-17 312 63.546 1.67258e-05 -3.53998 63.546000 Cu 0.520583 0.216166 0.5 314 63.546 3.42036e-05 -3.53998 63.546000 Cu 0.616751 0.211331 4.67818e-17 316 63.546 5.27549e-05 -3.53997 63.546000 Cu 0.732125 0.230628 2.36196e-19 317 63.546 8.95566e-06 -3.53982 63.546000 Cu 0.712879 0.206492 0.5 318 63.546 5.39637e-05 -3.53987 63.546000 Cu 0.635995 0.235458 0.5 319 63.546 8.47811e-06 -3.53982 63.546000 Cu 0.924419 0.220984 1.68487e-17 280 63.546 1.67258e-05 -3.53998 63.546000 Cu 0.905079 0.196844 0.5 281 63.546 4.19261e-05 -3.53983 63.546000 Cu 0.808967 0.201665 7.25834e-17 320 63.546 3.14749e-05 -3.53984 63.546000 Cu 0.828261 0.225802 0.5 321 63.546 1.306e-05 -3.53991 63.546000 Cu 0.0398548 0.240297 9.37961e-17 304 63.546 1.94137e-05 -3.53992 63.546000 Cu 0.155175 0.259587 4.67818e-17 305 63.546 7.13009e-06 -3.53972 63.546000 Cu 0.0590783 0.26441 0.5 307 63.546 1.74323e-05 -3.53965 63.546000 Cu 0.174394 0.283711 0.5 328 63.546 1.92677e-05 -3.53996 63.546000 Cu 0.347474 0.24994 7.8732e-19 309 63.546 5.02375e-06 -3.54 63.546000 Cu 0.251306 0.254757 0.5 311 63.546 9.68605e-06 -3.53991 63.546000 Cu 0.270531 0.278898 4.67818e-17 330 63.546 1.3863e-05 -3.54003 63.546000 Cu 0.366709 0.274066 0.5 332 63.546 9.64417e-06 -3.53995 63.546000 Cu 0.539855 0.240297 4.57396e-19 313 63.546 1.94137e-05 -3.53992 63.546000 Cu 0.443673 0.245126 0.5 315 63.546 2.80888e-05 -3.54002 63.546000 Cu 0.462888 0.269236 4.67818e-17 334 63.546 4.62072e-06 -3.53972 63.546000 Cu 0.559078 0.26441 0.5 336 63.546 1.74323e-05 -3.53965 63.546000 Cu 0.655175 0.259587 4.00371e-17 338 63.546 7.13009e-06 -3.53972 63.546000 Cu 0.770531 0.278898 4.8364e-19 339 63.546 1.3863e-05 -3.54003 63.546000 Cu 0.751306 0.254757 0.5 340 63.546 9.68605e-06 -3.53991 63.546000 Cu 0.674394 0.283711 0.5 341 63.546 1.92677e-05 -3.53996 63.546000 Cu 0.847474 0.24994 6.14485e-17 300 63.546 5.02375e-06 -3.54 63.546000 Cu 0.962888 0.269236 1.20408e-16 301 63.546 4.62072e-06 -3.53972 63.546000 Cu 0.943673 0.245126 0.5 302 63.546 2.80888e-05 -3.54002 63.546000 Cu 0.866709 0.274066 0.5 303 63.546 9.64417e-06 -3.53995 63.546000 Cu 0.0013424 0.31749 7.79822e-19 323 63.546 3.42141e-05 -3.53979 63.546000 Cu 0.0782152 0.288528 4.67818e-17 326 63.546 3.62892e-05 -3.53986 63.546000 Cu 0.0974216 0.31268 0.5 329 63.546 8.51922e-06 -3.53977 63.546000 Cu 0.193524 0.307863 4.67818e-17 327 63.546 3.42865e-05 -3.54005 63.546000 Cu 0.385971 0.298183 4.67818e-17 331 63.546 2.1411e-05 -3.54009 63.546000 Cu 0.289736 0.30303 0.5 333 63.546 1.6465e-05 -3.54013 63.546000 Cu 0.212726 0.33201 0.5 349 63.546 6.18514e-05 -3.54014 63.546000 Cu 0.308937 0.327151 2.70951e-17 351 63.546 1.09438e-05 -3.54019 63.546000 Cu 0.578215 0.288528 1.00477e-18 335 63.546 3.62892e-05 -3.53986 63.546000 Cu 0.482128 0.293346 0.5 337 63.546 4.58643e-05 -3.53988 63.546000 Cu 0.405148 0.322308 0.5 353 63.546 1.5323e-05 -3.53998 63.546000 Cu 0.501342 0.31749 1.98705e-19 355 63.546 3.42141e-05 -3.53979 63.546000 Cu 0.597422 0.31268 0.5 357 63.546 8.51922e-06 -3.53977 63.546000 Cu 0.693524 0.307863 2.24949e-20 359 63.546 3.42865e-05 -3.54005 63.546000 Cu 0.789736 0.30303 0.5 361 63.546 1.6465e-05 -3.54013 63.546000 Cu 0.712726 0.33201 0.5 362 63.546 6.18514e-05 -3.54014 63.546000 Cu 0.885971 0.298183 9.54682e-17 322 63.546 2.1411e-05 -3.54009 63.546000 Cu 0.982128 0.293346 0.5 324 63.546 4.58643e-05 -3.53988 63.546000 Cu 0.905148 0.322308 0.5 325 63.546 1.5323e-05 -3.53998 63.546000 Cu 0.808937 0.327151 4.67818e-17 360 63.546 1.09438e-05 -3.54019 63.546000 Cu 0.039656 0.365796 4.67818e-17 344 63.546 0.00018455 -3.53928 63.546000 Cu 0.020516 0.341617 0.5 345 63.546 8.09453e-05 -3.53947 63.546000 Cu 0.116629 0.33683 1.81796e-17 347 63.546 3.45749e-05 -3.5397 63.546000 Cu 0.135707 0.361003 0.5 350 63.546 0.000237656 -3.54024 63.546000 Cu 0.231905 0.356149 8.93871e-17 348 63.546 0.000177238 -3.54068 63.546000 Cu 0.328163 0.351268 0.5 354 63.546 4.96397e-05 -3.54028 63.546000 Cu 0.251032 0.380234 0.5 371 63.546 0.000445925 -3.54067 63.546000 Cu 0.347513 0.375352 7.49829e-20 373 63.546 0.000466847 -3.53985 63.546000 Cu 0.424346 0.346418 4.67818e-17 352 63.546 0.000128562 -3.53957 63.546000 Cu 0.520516 0.341617 0.5 358 63.546 8.09453e-05 -3.53947 63.546000 Cu 0.443701 0.370548 0.5 375 63.546 0.000607634 -3.5389 63.546000 Cu 0.539656 0.365796 9.78114e-17 377 63.546 0.00018455 -3.53928 63.546000 Cu 0.616629 0.33683 2.09855e-16 356 63.546 3.45749e-05 -3.5397 63.546000 Cu 0.635707 0.361003 0.5 379 63.546 0.000237656 -3.54024 63.546000 Cu 0.731905 0.356149 3.74914e-21 381 63.546 0.000177238 -3.54068 63.546000 Cu 0.751032 0.380234 0.5 383 63.546 0.000445925 -3.54067 63.546000 Cu 0.847513 0.375352 7.49829e-20 342 63.546 0.000466847 -3.53985 63.546000 Cu 0.924346 0.346418 1.00053e-16 343 63.546 0.000128562 -3.53957 63.546000 Cu 0.943701 0.370548 0.5 346 63.546 0.000607634 -3.5389 63.546000 Cu 0.828163 0.351268 0.5 382 63.546 4.96397e-05 -3.54028 63.546000 Cu 0.0775673 0.414361 4.67818e-17 366 63.546 0.0081643 -3.54341 63.546000 Cu 0.0586157 0.390056 0.5 367 63.546 0.00100656 -3.54012 63.546000 Cu 0.154605 0.385169 4.95637e-18 369 63.546 0.00143994 -3.54065 63.546000 Cu 0.173854 0.409255 0.5 372 63.546 0.00255045 -3.53998 63.546000 Cu 0.270455 0.404189 1.85658e-17 370 63.546 0.00196097 -3.53848 63.546000 Cu 0.366955 0.39939 0.5 376 63.546 0.00350158 -3.5384 63.546000 Cu 0.290118 0.428132 0.5 392 63.546 0.0194865 -3.53205 63.546000 Cu 0.385815 0.42352 4.67818e-17 394 63.546 0.0108799 -3.53485 63.546000 Cu 0.462944 0.394763 4.61145e-19 374 63.546 0.00148836 -3.539 63.546000 Cu 0.558616 0.390056 0.5 380 63.546 0.00100656 -3.54012 63.546000 Cu 0.481505 0.419151 0.5 396 63.546 0.00591771 -3.54282 63.546000 Cu 0.577567 0.414361 1.7321e-18 398 63.546 0.0081643 -3.54341 63.546000 Cu 0.654605 0.385169 1 378 63.546 0.00143994 -3.54065 63.546000 Cu 0.673854 0.409255 0.5 400 63.546 0.00255045 -3.53998 63.546000 Cu 0.770455 0.404189 4.67818e-17 402 63.546 0.00196097 -3.53848 63.546000 Cu 0.790118 0.428132 0.5 403 63.546 0.0194865 -3.53205 63.546000 Cu 0.885815 0.42352 8.74675e-17 363 63.546 0.0108799 -3.53485 63.546000 Cu 0.866955 0.39939 0.5 364 63.546 0.00350158 -3.5384 63.546000 Cu 0.962944 0.394763 4.67818e-17 365 63.546 0.00148836 -3.539 63.546000 Cu 0.981505 0.419151 0.5 368 63.546 0.00591771 -3.54282 63.546000 Cu 0.117283 0.461562 4.67818e-17 387 63.546 0.064193 -3.53335 63.546000 Cu 0.0970038 0.438371 0.5 388 63.546 0.0260023 -3.54604 63.546000 Cu 0.0146912 0.466884 0.5 389 63.546 0.677183 -3.46779 63.546000 Cu 0.194451 0.433196 6.74921e-17 390 63.546 0.00722876 -3.53915 63.546000 Cu 0.310843 0.452466 4.67818e-17 391 63.546 0.0993172 -3.51048 63.546000 Cu 0.216316 0.457215 0.5 393 63.546 0.121159 -3.54056 63.546000 Cu 0.514691 0.466884 0.5 210 63.546 0.677183 -3.46779 63.546000 Cu 0.498844 0.443434 2.04103e-17 395 63.546 0.0485094 -3.54472 63.546000 Cu 0.40285 0.448132 0.5 397 63.546 0.0744772 -3.51898 63.546000 Cu 0.419586 0.473683 4.67818e-17 411 63.546 0.743285 -3.42957 63.546000 Cu 0.597004 0.438371 0.5 401 63.546 0.0260023 -3.54604 63.546000 Cu 0.716316 0.457215 0.5 12 63.546 0.121159 -3.54056 63.546000 Cu 0.617283 0.461562 4.67818e-17 205 63.546 0.064193 -3.53335 63.546000 Cu 0.694451 0.433196 4.67818e-17 399 63.546 0.00722876 -3.53915 63.546000 Cu 0.998844 0.443434 1 386 63.546 0.0485094 -3.54472 63.546000 Cu 0.810843 0.452466 4.67818e-17 5 63.546 0.0993172 -3.51048 63.546000 Cu 0.919586 0.473683 4.67818e-17 384 63.546 0.743285 -3.42957 63.546000 Cu 0.90285 0.448132 0.5 385 63.546 0.0744772 -3.51898 63.546000 Cu 0.0335101 0.520819 6.7001e-17 4 63.546 9.26991 -3.29902 63.546000 Cu 0.150982 0.50495 1.01227e-18 7 63.546 6.77186 -3.25061 63.546000 Cu 0.0340018 0.48898 6.03612e-19 406 63.546 9.21851 -3.29799 63.546000 Cu 0.132557 0.484189 0.5 407 63.546 3.66402 -3.45081 63.546000 Cu 0.333261 0.478838 0.5 410 63.546 0.512443 -3.47604 63.546000 Cu 0.247352 0.504941 0.5 9 63.546 1.10935 -3.51498 63.546000 Cu 0.238527 0.480625 4.22154e-17 408 63.546 0.603117 -3.50903 63.546000 Cu 0.348444 0.504972 5.96114e-19 409 63.546 2.17521 -3.52043 63.546000 Cu 0.53351 0.520819 4.67818e-17 14 63.546 9.26991 -3.29902 63.546000 Cu 0.448667 0.504736 0.5 209 63.546 8.12541 -3.45341 63.546000 Cu 0.534002 0.48898 4.55146e-18 412 63.546 9.21851 -3.29799 63.546000 Cu 0.650982 0.50495 1 1 63.546 6.77186 -3.25061 63.546000 Cu 0.747352 0.504941 0.5 3 63.546 1.10935 -3.51498 63.546000 Cu 0.632557 0.484189 0.5 10 63.546 3.66402 -3.45081 63.546000 Cu 0.738527 0.480625 1 203 63.546 0.603117 -3.50903 63.546000 Cu 0.833261 0.478838 0.5 2 63.546 0.512443 -3.47604 63.546000 Cu 0.848444 0.504972 8.59679e-18 404 63.546 2.17521 -3.52043 63.546000 Cu 0.948667 0.504736 0.5 405 63.546 8.12541 -3.45341 63.546000 Cu 0.132259 0.525672 0.5 6 63.546 3.70313 -3.44934 63.546000 Cu 0.0144045 0.542957 0.5 24 63.546 0.716043 -3.46648 63.546000 Cu 0.116894 0.548251 4.15443e-17 26 63.546 0.0627763 -3.53331 63.546000 Cu 0.238432 0.529251 6.71097e-19 8 63.546 0.609724 -3.5076 63.546000 Cu 0.333259 0.53103 0.5 13 63.546 0.548737 -3.47452 63.546000 Cu 0.216012 0.552619 0.5 29 63.546 0.121993 -3.54033 63.546000 Cu 0.310579 0.557367 1.49441e-17 30 63.546 0.0980004 -3.50997 63.546000 Cu 0.402546 0.561736 0.5 32 63.546 0.074384 -3.51903 63.546000 Cu 0.419428 0.536247 1.75321e-16 11 63.546 0.788452 -3.42432 63.546000 Cu 0.514405 0.542957 0.5 17 63.546 0.716043 -3.46648 63.546000 Cu 0.498513 0.566411 2.92883e-17 34 63.546 0.0460104 -3.54514 63.546000 Cu 0.616894 0.548251 1 15 63.546 0.0627763 -3.53331 63.546000 Cu 0.632259 0.525672 0.5 16 63.546 3.70313 -3.44934 63.546000 Cu 0.738432 0.529251 4.67818e-17 18 63.546 0.609724 -3.5076 63.546000 Cu 0.716012 0.552619 0.5 21 63.546 0.121993 -3.54033 63.546000 Cu 0.810579 0.557367 1 19 63.546 0.0980004 -3.50997 63.546000 Cu 0.833259 0.53103 0.5 20 63.546 0.548737 -3.47452 63.546000 Cu 0.919428 0.536247 2.43694e-18 22 63.546 0.788452 -3.42432 63.546000 Cu 0.998513 0.566411 4.67818e-17 23 63.546 0.0460104 -3.54514 63.546000 Cu 0.902546 0.561736 0.5 25 63.546 0.074384 -3.51903 63.546000 Cu 0.0966112 0.571451 0.5 27 63.546 0.0258231 -3.54643 63.546000 Cu 0.193995 0.57661 8.21025e-17 28 63.546 0.00698822 -3.53929 63.546000 Cu 0.0770362 0.595448 4.67818e-17 46 63.546 0.00771808 -3.54346 63.546000 Cu 0.173267 0.600535 0.5 49 63.546 0.00249048 -3.54 63.546000 Cu 0.385347 0.586304 1.1466e-16 31 63.546 0.0112522 -3.53504 63.546000 Cu 0.289605 0.581681 0.5 33 63.546 0.0191906 -3.53204 63.546000 Cu 0.269815 0.605592 2.03579e-17 50 63.546 0.00193262 -3.53844 63.546000 Cu 0.366304 0.61039 0.5 52 63.546 0.00317937 -3.53843 63.546000 Cu 0.577036 0.595448 1.00177e-17 35 63.546 0.00771808 -3.54346 63.546000 Cu 0.596611 0.571451 0.5 36 63.546 0.0258231 -3.54643 63.546000 Cu 0.481033 0.590679 0.5 37 63.546 0.00530153 -3.54288 63.546000 Cu 0.462297 0.615022 2.1745e-19 54 63.546 0.00139955 -3.53894 63.546000 Cu 0.693995 0.57661 4.67818e-17 38 63.546 0.00698822 -3.53929 63.546000 Cu 0.769815 0.605592 4.67818e-17 39 63.546 0.00193262 -3.53844 63.546000 Cu 0.789605 0.581681 0.5 40 63.546 0.0191906 -3.53204 63.546000 Cu 0.673267 0.600535 0.5 41 63.546 0.00249048 -3.54 63.546000 Cu 0.885347 0.586304 1.19167e-16 42 63.546 0.0112522 -3.53504 63.546000 Cu 0.962297 0.615022 7.97031e-17 43 63.546 0.00139955 -3.53894 63.546000 Cu 0.981033 0.590679 0.5 44 63.546 0.00530153 -3.54288 63.546000 Cu 0.866304 0.61039 0.5 45 63.546 0.00317937 -3.53843 63.546000 Cu 0.0579229 0.619717 0.5 47 63.546 0.000948231 -3.54007 63.546000 Cu 0.153874 0.624586 9.81301e-17 48 63.546 0.00157209 -3.54065 63.546000 Cu 0.0388817 0.643944 4.67818e-17 66 63.546 0.000178424 -3.53916 63.546000 Cu 0.134876 0.648721 0.5 68 63.546 0.000240282 -3.54017 63.546000 Cu 0.346789 0.634398 9.06356e-17 51 63.546 0.000495862 -3.53994 63.546000 Cu 0.250308 0.62951 0.5 53 63.546 0.000411651 -3.54076 63.546000 Cu 0.231021 0.653563 4.67818e-17 70 63.546 0.000270538 -3.54071 63.546000 Cu 0.327282 0.658439 0.5 72 63.546 3.81823e-05 -3.54036 63.546000 Cu 0.538882 0.643944 1.55215e-18 55 63.546 0.000178424 -3.53916 63.546000 Cu 0.557923 0.619717 0.5 56 63.546 0.000948231 -3.54007 63.546000 Cu 0.442932 0.639196 0.5 57 63.546 0.000619313 -3.53891 63.546000 Cu 0.423527 0.663286 2.9727e-17 74 63.546 0.000158549 -3.53973 63.546000 Cu 0.653874 0.624586 5.56635e-17 58 63.546 0.00157209 -3.54065 63.546000 Cu 0.731021 0.653563 4.67818e-17 59 63.546 0.000270538 -3.54071 63.546000 Cu 0.750308 0.62951 0.5 60 63.546 0.000411651 -3.54076 63.546000 Cu 0.634876 0.648721 0.5 61 63.546 0.000240282 -3.54017 63.546000 Cu 0.846789 0.634398 1.04976e-19 62 63.546 0.000495862 -3.53994 63.546000 Cu 0.923527 0.663286 1 63 63.546 0.000158549 -3.53973 63.546000 Cu 0.942932 0.639196 0.5 64 63.546 0.000619313 -3.53891 63.546000 Cu 0.827282 0.658439 0.5 65 63.546 3.81823e-05 -3.54036 63.546000 Cu 0.115706 0.672869 1.49966e-20 67 63.546 4.18643e-05 -3.53994 63.546000 Cu 0.0196707 0.668083 0.5 69 63.546 0.000145729 -3.5396 63.546000 Cu 0.0963539 0.697006 0.5 88 63.546 9.47815e-05 -3.5399 63.546000 Cu 0.192406 0.701791 4.67818e-17 90 63.546 2.52899e-05 -3.53984 63.546000 Cu 0.000251675 0.692195 4.67818e-17 86 63.546 0.000119984 -3.53994 63.546000 Cu 0.307886 0.6825 1.25829e-16 71 63.546 7.56193e-05 -3.54008 63.546000 Cu 0.211764 0.677673 0.5 73 63.546 9.65615e-05 -3.5401 63.546000 Cu 0.288451 0.706584 0.5 92 63.546 8.51067e-05 -3.53995 63.546000 Cu 0.384546 0.711418 7.21485e-17 94 63.546 3.03884e-05 -3.54009 63.546000 Cu 0.404096 0.687354 0.5 77 63.546 3.89031e-05 -3.54003 63.546000 Cu 0.500252 0.692195 4.67818e-17 75 63.546 0.000119984 -3.53994 63.546000 Cu 0.519671 0.668083 0.5 76 63.546 0.000145729 -3.5396 63.546000 Cu 0.596354 0.697006 0.5 81 63.546 9.47815e-05 -3.5399 63.546000 Cu 0.615706 0.672869 1.30436e-16 78 63.546 4.18643e-05 -3.53994 63.546000 Cu 0.692406 0.701791 4.67818e-17 79 63.546 2.52899e-05 -3.53984 63.546000 Cu 0.711764 0.677673 0.5 80 63.546 9.65615e-05 -3.5401 63.546000 Cu 0.788451 0.706584 0.5 85 63.546 8.51067e-05 -3.53995 63.546000 Cu 0.807886 0.6825 9.97272e-19 82 63.546 7.56193e-05 -3.54008 63.546000 Cu 0.884546 0.711418 4.67818e-17 83 63.546 3.03884e-05 -3.54009 63.546000 Cu 0.904096 0.687354 0.5 84 63.546 3.89031e-05 -3.54003 63.546000 Cu 0.0768653 0.721099 2.19512e-17 87 63.546 7.37629e-05 -3.53992 63.546000 Cu 0.172934 0.725899 0.5 93 63.546 3.52724e-05 -3.5398 63.546000 Cu 0.057254 0.745179 0.5 108 63.546 2.48415e-05 -3.54009 63.546000 Cu 0.153344 0.750002 4.67818e-17 111 63.546 4.68702e-05 -3.53998 63.546000 Cu 0.26894 0.730693 5.14495e-17 91 63.546 1.3264e-05 -3.53984 63.546000 Cu 0.364972 0.735502 0.5 97 63.546 4.68728e-05 -3.54005 63.546000 Cu 0.24937 0.754797 0.5 113 63.546 1.26828e-05 -3.5399 63.546000 Cu 0.345435 0.759591 3.86237e-17 114 63.546 3.53852e-05 -3.53986 63.546000 Cu 0.461116 0.740339 5.07297e-17 95 63.546 5.86355e-06 -3.54014 63.546000 Cu 0.480703 0.716271 0.5 96 63.546 1.71745e-05 -3.54007 63.546000 Cu 0.576865 0.721099 4.67818e-17 98 63.546 7.37629e-05 -3.53992 63.546000 Cu 0.557254 0.745179 0.5 101 63.546 2.48415e-05 -3.54009 63.546000 Cu 0.653344 0.750002 7.77835e-17 99 63.546 4.68702e-05 -3.53998 63.546000 Cu 0.672934 0.725899 0.5 100 63.546 3.52724e-05 -3.5398 63.546000 Cu 0.76894 0.730693 4.67818e-17 102 63.546 1.3264e-05 -3.53984 63.546000 Cu 0.74937 0.754797 0.5 105 63.546 1.26828e-05 -3.5399 63.546000 Cu 0.980703 0.716271 0.5 89 63.546 1.71745e-05 -3.54007 63.546000 Cu 0.845435 0.759591 4.67818e-17 103 63.546 3.53852e-05 -3.53986 63.546000 Cu 0.864972 0.735502 0.5 104 63.546 4.68728e-05 -3.54005 63.546000 Cu 0.961116 0.740339 3.0743e-19 106 63.546 5.86355e-06 -3.54014 63.546000 Cu 0.0376159 0.769246 4.67818e-17 107 63.546 1.03854e-05 -3.53992 63.546000 Cu 0.133749 0.774087 0.5 110 63.546 5.86857e-05 -3.54007 63.546000 Cu 0.0180335 0.793303 0.5 128 63.546 0.000137776 -3.54004 63.546000 Cu 0.114236 0.798149 4.67818e-17 130 63.546 1.24624e-05 -3.54018 63.546000 Cu 0.229892 0.778907 4.67818e-17 112 63.546 6.13245e-05 -3.54005 63.546000 Cu 0.325933 0.783694 0.5 117 63.546 1.79933e-05 -3.53995 63.546000 Cu 0.210432 0.802993 0.5 133 63.546 5.8409e-05 -3.5401 63.546000 Cu 0.306548 0.807811 2.30197e-18 134 63.546 6.25244e-05 -3.53994 63.546000 Cu 0.421964 0.788486 6.94154e-17 115 63.546 0.00010515 -3.53991 63.546000 Cu 0.441499 0.764405 0.5 116 63.546 4.97106e-05 -3.53983 63.546000 Cu 0.537616 0.769246 4.67818e-17 118 63.546 1.03854e-05 -3.53992 63.546000 Cu 0.518034 0.793303 0.5 121 63.546 0.000137776 -3.54004 63.546000 Cu 0.614236 0.798149 4.67818e-17 119 63.546 1.24624e-05 -3.54018 63.546000 Cu 0.633749 0.774087 0.5 120 63.546 5.86857e-05 -3.54007 63.546000 Cu 0.729892 0.778907 5.44001e-18 122 63.546 6.13245e-05 -3.54005 63.546000 Cu 0.710432 0.802993 0.5 125 63.546 5.8409e-05 -3.5401 63.546000 Cu 0.806548 0.807811 6.76421e-17 123 63.546 6.25244e-05 -3.53994 63.546000 Cu 0.941499 0.764405 0.5 109 63.546 4.97106e-05 -3.53983 63.546000 Cu 0.825933 0.783694 0.5 124 63.546 1.79933e-05 -3.53995 63.546000 Cu 0.921964 0.788486 2.88347e-17 126 63.546 0.00010515 -3.53991 63.546000 Cu 0.0948051 0.822212 0.5 131 63.546 5.25341e-05 -3.54005 63.546000 Cu 0.190989 0.827062 4.67818e-17 132 63.546 5.06734e-05 -3.54019 63.546000 Cu 0.0754955 0.846272 4.67818e-17 150 63.546 0.000138805 -3.53952 63.546000 Cu 0.171698 0.851115 0.5 153 63.546 5.086e-05 -3.54018 63.546000 Cu 0.383311 0.8367 1.20366e-16 135 63.546 4.9912e-05 -3.53965 63.546000 Cu 0.287199 0.831903 0.5 137 63.546 0.000113018 -3.5401 63.546000 Cu 0.26799 0.855978 3.32287e-17 154 63.546 0.000190567 -3.5407 63.546000 Cu 0.402586 0.812604 0.5 136 63.546 2.9976e-05 -3.53975 63.546000 Cu 0.498642 0.817391 7.93244e-17 138 63.546 9.68652e-05 -3.53987 63.546000 Cu 0.575495 0.846272 5.62372e-19 139 63.546 0.000138805 -3.53952 63.546000 Cu 0.594805 0.822212 0.5 140 63.546 5.25341e-05 -3.54005 63.546000 Cu 0.479397 0.841477 0.5 141 63.546 8.42188e-05 -3.53935 63.546000 Cu 0.690989 0.827062 9.91536e-17 142 63.546 5.06734e-05 -3.54019 63.546000 Cu 0.76799 0.855978 5.62372e-20 143 63.546 0.000190567 -3.5407 63.546000 Cu 0.787199 0.831903 0.5 144 63.546 0.000113018 -3.5401 63.546000 Cu 0.671698 0.851115 0.5 145 63.546 5.086e-05 -3.54018 63.546000 Cu 0.998642 0.817391 4.67818e-17 127 63.546 9.68652e-05 -3.53987 63.546000 Cu 0.902586 0.812604 0.5 129 63.546 2.9976e-05 -3.53975 63.546000 Cu 0.883311 0.8367 7.78322e-18 146 63.546 4.9912e-05 -3.53965 63.546000 Cu 0.979397 0.841477 0.5 148 63.546 8.42188e-05 -3.53935 63.546000 Cu 0.0561651 0.870351 0.5 151 63.546 0.000628215 -3.53885 63.546000 Cu 0.152358 0.875134 1.5439e-17 152 63.546 0.000481779 -3.53983 63.546000 Cu 0.0369265 0.894514 4.67818e-17 170 63.546 0.00136623 -3.53916 63.546000 Cu 0.132926 0.89914 0.5 172 63.546 0.00321266 -3.5386 63.546000 Cu 0.345275 0.884949 2.01363e-16 155 63.546 0.00151696 -3.54073 63.546000 Cu 0.364218 0.860825 0.5 156 63.546 0.000292021 -3.5403 63.546000 Cu 0.248852 0.880008 0.5 157 63.546 0.000401949 -3.54071 63.546000 Cu 0.229415 0.903929 4.67818e-17 174 63.546 0.00204443 -3.53846 63.546000 Cu 0.460212 0.865608 7.19461e-18 158 63.546 0.000195384 -3.53919 63.546000 Cu 0.536926 0.894514 1.22035e-17 159 63.546 0.00136623 -3.53916 63.546000 Cu 0.556165 0.870351 0.5 160 63.546 0.000628215 -3.53885 63.546000 Cu 0.44126 0.889829 0.5 161 63.546 0.00109757 -3.54017 63.546000 Cu 0.652358 0.875134 6.61199e-17 162 63.546 0.000481779 -3.53983 63.546000 Cu 0.729415 0.903929 2.17338e-17 163 63.546 0.00204443 -3.53846 63.546000 Cu 0.748852 0.880008 0.5 164 63.546 0.000401949 -3.54071 63.546000 Cu 0.632926 0.89914 0.5 165 63.546 0.00321266 -3.5386 63.546000 Cu 0.960212 0.865608 3.5242e-19 147 63.546 0.000195384 -3.53919 63.546000 Cu 0.864218 0.860825 0.5 149 63.546 0.000292021 -3.5403 63.546000 Cu 0.845275 0.884949 4.67818e-17 166 63.546 0.00151696 -3.54073 63.546000 Cu 0.94126 0.889829 0.5 168 63.546 0.00109757 -3.54017 63.546000 Cu 0.114048 0.923235 9.34624e-17 171 63.546 0.0105173 -3.53504 63.546000 Cu 0.0182957 0.918859 0.5 173 63.546 0.00558236 -3.54299 63.546000 Cu 0.0969649 0.947799 0.5 192 63.546 0.0758531 -3.51907 63.546000 Cu 0.188961 0.952172 1.62027e-16 194 63.546 0.0967548 -3.51007 63.546000 Cu 0.000937084 0.943098 2.8366e-17 190 63.546 0.0468935 -3.54488 63.546000 Cu 0.305386 0.932894 4.67818e-17 175 63.546 0.00757917 -3.53912 63.546000 Cu 0.32599 0.908988 0.5 176 63.546 0.00233727 -3.53994 63.546000 Cu 0.209747 0.927853 0.5 177 63.546 0.018845 -3.53188 63.546000 Cu 0.402799 0.938066 0.5 181 63.546 0.0265352 -3.54616 63.546000 Cu 0.422248 0.91409 3.93773e-17 178 63.546 0.00818169 -3.54346 63.546000 Cu 0.500937 0.943098 4.67818e-17 179 63.546 0.0468935 -3.54488 63.546000 Cu 0.518296 0.918859 0.5 180 63.546 0.00558236 -3.54299 63.546000 Cu 0.596965 0.947799 0.5 185 63.546 0.0758531 -3.51907 63.546000 Cu 0.614048 0.923235 4.49897e-20 182 63.546 0.0105173 -3.53504 63.546000 Cu 0.688961 0.952172 4.67818e-17 183 63.546 0.0967548 -3.51007 63.546000 Cu 0.709747 0.927853 0.5 184 63.546 0.018845 -3.53188 63.546000 Cu 0.805386 0.932894 4.14205e-17 186 63.546 0.00757917 -3.53912 63.546000 Cu 0.922248 0.91409 4.67818e-17 167 63.546 0.00818169 -3.54346 63.546000 Cu 0.82599 0.908988 0.5 169 63.546 0.00233727 -3.53994 63.546000 Cu 0.902799 0.938066 0.5 188 63.546 0.0265352 -3.54616 63.546000 Cu 0.080241 0.97331 2.03579e-18 191 63.546 0.760399 -3.42688 63.546000 Cu 0.166467 0.978514 0.5 197 63.546 0.534932 -3.47614 63.546000 Cu 0.261254 0.980289 1.04976e-19 195 63.546 0.606321 -3.50889 63.546000 Cu 0.283433 0.956898 0.5 196 63.546 0.124419 -3.54033 63.546000 Cu 0.382512 0.961223 4.67818e-17 198 63.546 0.0662344 -3.53277 63.546000 Cu 0.367328 0.983802 0.5 201 63.546 3.66592 -3.45001 63.546000 Cu 0.466031 0.988628 4.67818e-17 199 63.546 9.23683 -3.29738 63.546000 Cu 0.485139 0.966531 0.5 200 63.546 0.697045 -3.46632 63.546000 Cu 0.580241 0.97331 4.67818e-17 202 63.546 0.760399 -3.42688 63.546000 Cu 0.783433 0.956898 0.5 189 63.546 0.124419 -3.54033 63.546000 Cu 0.666467 0.978514 0.5 204 63.546 0.534932 -3.47614 63.546000 Cu 0.761254 0.980289 4.67818e-17 206 63.546 0.606321 -3.50889 63.546000 Cu 0.882512 0.961223 1 187 63.546 0.0662344 -3.53277 63.546000 Cu 0.985139 0.966531 0.5 193 63.546 0.697045 -3.46632 63.546000 Cu 0.867328 0.983802 0.5 207 63.546 3.66592 -3.45001 63.546000 Cu 0.966031 0.988628 1.18098e-18 208 63.546 9.23683 -3.29738