Number of particles = 400 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0284 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.5064 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62202 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 0.122359 0.043224 1 208 63.546 0.293404 -3.522 63.546000 Cu 0.0623427 0.0230057 0.5 209 63.546 0.32605 -3.51414 63.546000 Cu 0.0423046 0.059196 0.5 210 63.546 0.0629914 -3.53348 63.546000 Cu 0.143847 0.00496479 8.9322e-17 211 63.546 4.20607 -3.59102 63.546000 Cu 0.278856 0.0206075 2.71798e-16 212 63.546 7.26758 -3.27237 63.546000 Cu 0.198039 0.028239 0.5 213 63.546 5.15675 -3.46707 63.546000 Cu 0.179695 0.06466 0.5 223 63.546 0.109178 -3.52893 63.546000 Cu 0.258536 0.0526921 3.14064e-16 225 63.546 0.529869 -3.46445 63.546000 Cu 0.320304 0.0720077 0.5 228 63.546 0.106177 -3.52183 63.546000 Cu 0.340532 0.0385019 0.5 227 63.546 0.453601 -3.48151 63.546000 Cu 0.351864 0.00495368 0.5 214 63.546 3.0983 -3.46175 63.546000 Cu 0.401615 0.0565471 2.37075e-17 226 63.546 0.0228018 -3.52757 63.546000 Cu 0.42116 0.0222199 2.19833e-16 229 63.546 0.199541 -3.51663 63.546000 Cu 0.562343 0.0230057 0 230 63.546 0.32605 -3.51414 63.546000 Cu 0.495937 0.00498287 0.5 231 63.546 0.315743 -3.5357 63.546000 Cu 0.482875 0.0402611 0.5 232 63.546 0.0545161 -3.52783 63.546000 Cu 0.643847 0.00496479 0.5 233 63.546 4.20607 -3.59102 63.546000 Cu 0.461932 0.0753055 0.5 249 63.546 0.011671 -3.53768 63.546000 Cu 0.542305 0.059196 1.44999e-16 251 63.546 0.0629914 -3.53348 63.546000 Cu 0.622359 0.043224 0.5 253 63.546 0.293404 -3.522 63.546000 Cu 0.851864 0.00495368 2.41026e-16 201 63.546 3.0983 -3.46175 63.546000 Cu 0.995937 0.00498287 1.81278e-16 202 63.546 0.315743 -3.5357 63.546000 Cu 0.92116 0.0222199 0.5 203 63.546 0.199541 -3.51663 63.546000 Cu 0.961932 0.0753055 3.13705e-17 204 63.546 0.011671 -3.53768 63.546000 Cu 0.901615 0.0565471 0.5 205 63.546 0.0228018 -3.52757 63.546000 Cu 0.982875 0.0402611 0 207 63.546 0.0545161 -3.52783 63.546000 Cu 0.679695 0.06466 1 252 63.546 0.109178 -3.52893 63.546000 Cu 0.698039 0.028239 1.91575e-18 255 63.546 5.15675 -3.46707 63.546000 Cu 0.840532 0.0385019 3.1131e-18 256 63.546 0.453601 -3.48151 63.546000 Cu 0.778856 0.0206075 0.5 257 63.546 7.26758 -3.27237 63.546000 Cu 0.758536 0.0526921 0.5 258 63.546 0.529869 -3.46445 63.546000 Cu 0.820304 0.0720077 8.38142e-17 283 63.546 0.106177 -3.52183 63.546000 Cu 0.0806921 0.114817 5.02885e-18 218 63.546 0.0122649 -3.54246 63.546000 Cu 0.0214942 0.0947553 0.5 219 63.546 0.0186242 -3.54163 63.546000 Cu 0.101317 0.0793304 1 221 63.546 0.0572502 -3.54283 63.546000 Cu 0.239514 0.0862387 1.56852e-16 222 63.546 0.0659135 -3.51896 63.546000 Cu 0.160166 0.100054 0.5 224 63.546 0.014451 -3.54069 63.546000 Cu 0.0599577 0.150001 1 239 63.546 0.00255447 -3.5413 63.546000 Cu 0.139961 0.135148 0.5 241 63.546 0.00230464 -3.54067 63.546000 Cu 0.219875 0.120644 3.62796e-17 243 63.546 0.00933639 -3.53491 63.546000 Cu 0.30027 0.106114 0.5 245 63.546 0.0245578 -3.53327 63.546000 Cu 0.2799 0.140619 0.5 246 63.546 0.00541793 -3.53686 63.546000 Cu 0.000692422 0.129987 0.5 220 63.546 0.00517223 -3.54113 63.546000 Cu 0.360559 0.125628 7.68696e-17 244 63.546 0.00376132 -3.53781 63.546000 Cu 0.381102 0.0910127 2.04148e-16 247 63.546 0.0112503 -3.5361 63.546000 Cu 0.521494 0.0947553 1.07761e-18 248 63.546 0.0186242 -3.54163 63.546000 Cu 0.441152 0.110303 0.5 250 63.546 0.0035241 -3.53929 63.546000 Cu 0.601317 0.0793304 0.5 254 63.546 0.0572502 -3.54283 63.546000 Cu 0.420265 0.145238 0.5 273 63.546 0.000969024 -3.53978 63.546000 Cu 0.500692 0.129987 1.46076e-17 275 63.546 0.00517223 -3.54113 63.546000 Cu 0.639961 0.135148 1 276 63.546 0.00230464 -3.54067 63.546000 Cu 0.580692 0.114817 0.5 277 63.546 0.0122649 -3.54246 63.546000 Cu 0.559958 0.150001 0.5 278 63.546 0.00255447 -3.5413 63.546000 Cu 0.660166 0.100054 1 279 63.546 0.014451 -3.54069 63.546000 Cu 0.881102 0.0910127 0.5 206 63.546 0.0112503 -3.5361 63.546000 Cu 0.920265 0.145238 0 215 63.546 0.000969024 -3.53978 63.546000 Cu 0.860559 0.125628 0.5 216 63.546 0.00376132 -3.53781 63.546000 Cu 0.941152 0.110303 1 217 63.546 0.0035241 -3.53929 63.546000 Cu 0.80027 0.106114 1 280 63.546 0.0245578 -3.53327 63.546000 Cu 0.739514 0.0862387 0.5 281 63.546 0.0659135 -3.51896 63.546000 Cu 0.719875 0.120644 0.5 282 63.546 0.00933639 -3.53491 63.546000 Cu 0.7799 0.140619 8.30958e-17 307 63.546 0.00541793 -3.53686 63.546000 Cu 0.0390819 0.185038 0 236 63.546 0.000484849 -3.54054 63.546000 Cu 0.199485 0.155352 0 240 63.546 0.0015102 -3.53797 63.546000 Cu 0.119262 0.170117 0.5 242 63.546 0.000490224 -3.54013 63.546000 Cu 0.0185734 0.21999 1 263 63.546 0.000239835 -3.54024 63.546000 Cu 0.158528 0.22504 1 264 63.546 0.000130114 -3.53979 63.546000 Cu 0.098622 0.205049 0.5 265 63.546 0.000288932 -3.54009 63.546000 Cu 0.17883 0.190165 8.48919e-17 267 63.546 0.000308838 -3.53917 63.546000 Cu 0.318864 0.195173 9.3393e-17 268 63.546 0.000297366 -3.53909 63.546000 Cu 0.259173 0.175311 0.5 269 63.546 0.000947568 -3.5383 63.546000 Cu 0.238576 0.210113 0.5 270 63.546 0.000350755 -3.53931 63.546000 Cu 0.298596 0.230021 1 295 63.546 5.30133e-05 -3.5395 63.546000 Cu 0.339681 0.160364 1 271 63.546 0.000948366 -3.53859 63.546000 Cu 0.47967 0.16506 1 272 63.546 0.00107332 -3.54088 63.546000 Cu 0.399284 0.180152 0.5 274 63.546 0.000249551 -3.53983 63.546000 Cu 0.378646 0.21504 0.5 297 63.546 0.000215742 -3.5395 63.546000 Cu 0.458816 0.200041 0 299 63.546 0.000347564 -3.54 63.546000 Cu 0.598622 0.205049 1.04049e-16 300 63.546 0.000288932 -3.54009 63.546000 Cu 0.539082 0.185038 0.5 301 63.546 0.000484849 -3.54054 63.546000 Cu 0.518573 0.21999 0.5 302 63.546 0.000239835 -3.54024 63.546000 Cu 0.619262 0.170117 1.26919e-17 303 63.546 0.000490224 -3.54013 63.546000 Cu 0.658528 0.22504 0.5 329 63.546 0.000130114 -3.53979 63.546000 Cu 0.878646 0.21504 3.32862e-17 234 63.546 0.000215742 -3.5395 63.546000 Cu 0.899284 0.180152 2.44259e-17 235 63.546 0.000249551 -3.53983 63.546000 Cu 0.97967 0.16506 0.5 237 63.546 0.00107332 -3.54088 63.546000 Cu 0.958816 0.200041 0.5 238 63.546 0.000347564 -3.54 63.546000 Cu 0.759173 0.175311 1 304 63.546 0.000947568 -3.5383 63.546000 Cu 0.699485 0.155352 0.5 305 63.546 0.0015102 -3.53797 63.546000 Cu 0.67883 0.190165 0.5 306 63.546 0.000308838 -3.53917 63.546000 Cu 0.839681 0.160364 0.5 308 63.546 0.000948366 -3.53859 63.546000 Cu 0.738576 0.210113 4.40623e-17 331 63.546 0.000350755 -3.53931 63.546000 Cu 0.818864 0.195173 0.5 332 63.546 0.000297366 -3.53909 63.546000 Cu 0.798596 0.230021 0.5 333 63.546 5.30133e-05 -3.5395 63.546000 Cu 0.0786008 0.239975 0.5 266 63.546 1.51943e-05 -3.54004 63.546000 Cu 0.118671 0.294833 1 288 63.546 8.39413e-05 -3.53967 63.546000 Cu 0.0586134 0.27489 0.5 289 63.546 4.99074e-05 -3.53997 63.546000 Cu 0.138599 0.259927 0 291 63.546 2.63674e-05 -3.53967 63.546000 Cu 0.27863 0.264892 1 292 63.546 2.35208e-05 -3.53948 63.546000 Cu 0.218593 0.244977 0.5 293 63.546 2.64753e-05 -3.53937 63.546000 Cu 0.198672 0.279853 0.5 294 63.546 1.84788e-05 -3.53945 63.546000 Cu 0.258827 0.299757 1 319 63.546 0.000143039 -3.5392 63.546000 Cu 0.338732 0.284832 0.5 321 63.546 4.95942e-05 -3.5397 63.546000 Cu 0.43862 0.23496 1 296 63.546 7.01853e-05 -3.53985 63.546000 Cu 0.358662 0.249924 0.5 298 63.546 4.65801e-05 -3.53982 63.546000 Cu 0.398866 0.304805 1.39012e-16 320 63.546 8.44349e-05 -3.54014 63.546000 Cu 0.418689 0.269875 1.33384e-16 323 63.546 2.56452e-05 -3.5401 63.546000 Cu 0.558613 0.27489 0 324 63.546 4.99074e-05 -3.53997 63.546000 Cu 0.498638 0.254917 0.5 325 63.546 8.35332e-06 -3.53997 63.546000 Cu 0.478727 0.289854 0.5 326 63.546 2.53161e-05 -3.54014 63.546000 Cu 0.578601 0.239975 1.07162e-16 327 63.546 1.51943e-05 -3.54004 63.546000 Cu 0.638599 0.259927 0.5 330 63.546 2.63674e-05 -3.53967 63.546000 Cu 0.618671 0.294833 0.5 353 63.546 8.39413e-05 -3.53967 63.546000 Cu 0.858662 0.249924 4.01111e-17 259 63.546 4.65801e-05 -3.53982 63.546000 Cu 0.998638 0.254917 1 260 63.546 8.35332e-06 -3.53997 63.546000 Cu 0.93862 0.23496 0.5 261 63.546 7.01853e-05 -3.53985 63.546000 Cu 0.918689 0.269875 0.5 262 63.546 2.56452e-05 -3.5401 63.546000 Cu 0.898866 0.304805 0.5 285 63.546 8.44349e-05 -3.54014 63.546000 Cu 0.978727 0.289854 0 287 63.546 2.53161e-05 -3.54014 63.546000 Cu 0.718593 0.244977 1 328 63.546 2.64753e-05 -3.53937 63.546000 Cu 0.698672 0.279853 0 355 63.546 1.84788e-05 -3.53945 63.546000 Cu 0.838732 0.284832 1 356 63.546 4.95942e-05 -3.5397 63.546000 Cu 0.77863 0.264892 0.5 357 63.546 2.35208e-05 -3.53948 63.546000 Cu 0.758827 0.299757 0.5 358 63.546 0.000143039 -3.5392 63.546000 Cu 0.0387602 0.309829 0.5 290 63.546 0.00018592 -3.54006 63.546000 Cu 0.0788938 0.36469 1 312 63.546 0.00103469 -3.54036 63.546000 Cu 0.0188103 0.344831 0.5 313 63.546 0.000993 -3.54105 63.546000 Cu 0.0987672 0.329736 5.66345e-17 315 63.546 0.000238766 -3.54006 63.546000 Cu 0.239041 0.334595 1 316 63.546 0.000755499 -3.53856 63.546000 Cu 0.178805 0.314712 0.5 317 63.546 0.000143674 -3.53932 63.546000 Cu 0.158983 0.34955 0.5 318 63.546 0.000873827 -3.53912 63.546000 Cu 0.318986 0.319718 0.5 322 63.546 0.000216728 -3.53926 63.546000 Cu 0.219382 0.369312 1 343 63.546 0.00511971 -3.53684 63.546000 Cu 0.29936 0.354555 0.5 345 63.546 0.00154717 -3.53786 63.546000 Cu 0.139078 0.384321 0.5 341 63.546 0.00331772 -3.538 63.546000 Cu 0.359446 0.374767 1.50866e-17 344 63.546 0.00227303 -3.54048 63.546000 Cu 0.379102 0.339766 1 347 63.546 0.000397669 -3.53995 63.546000 Cu 0.51881 0.344831 0 348 63.546 0.000993 -3.54105 63.546000 Cu 0.458847 0.324838 0.5 349 63.546 0.000397896 -3.54053 63.546000 Cu 0.439071 0.359894 0.5 350 63.546 0.00217809 -3.54143 63.546000 Cu 0.53876 0.309829 7.65104e-17 351 63.546 0.00018592 -3.54006 63.546000 Cu 0.598767 0.329736 0.5 354 63.546 0.000238766 -3.54006 63.546000 Cu 0.498851 0.37994 0 373 63.546 0.00505822 -3.54157 63.546000 Cu 0.578894 0.36469 0.5 375 63.546 0.00103469 -3.54036 63.546000 Cu 0.658983 0.34955 2.87363e-17 377 63.546 0.000873827 -3.53912 63.546000 Cu 0.639078 0.384321 1.7158e-16 374 63.546 0.00331772 -3.538 63.546000 Cu 0.958847 0.324838 0 284 63.546 0.000397896 -3.54053 63.546000 Cu 0.879102 0.339766 0.5 286 63.546 0.000397669 -3.53995 63.546000 Cu 0.859446 0.374767 0.5 310 63.546 0.00227303 -3.54048 63.546000 Cu 0.939071 0.359894 4.99293e-17 311 63.546 0.00217809 -3.54143 63.546000 Cu 0.998851 0.37994 0.5 314 63.546 0.00505822 -3.54157 63.546000 Cu 0.678805 0.314712 1 352 63.546 0.000143674 -3.53932 63.546000 Cu 0.79936 0.354555 1.87864e-16 378 63.546 0.00154717 -3.53786 63.546000 Cu 0.739041 0.334595 0.5 379 63.546 0.000755499 -3.53856 63.546000 Cu 0.719382 0.369312 0.5 380 63.546 0.00511971 -3.53684 63.546000 Cu 0.818986 0.319718 7.36368e-17 381 63.546 0.000216728 -3.53926 63.546000 Cu 0.0377898 0.434661 2.07141e-17 336 63.546 0.0126896 -3.53715 63.546000 Cu 0.0586449 0.399648 4.70557e-17 339 63.546 0.00372597 -3.53955 63.546000 Cu 0.199556 0.403834 0 340 63.546 0.0242659 -3.53312 63.546000 Cu 0.118741 0.41895 0.5 342 63.546 0.0111626 -3.53561 63.546000 Cu 0.279854 0.389283 0.5 346 63.546 0.00981764 -3.53471 63.546000 Cu 0.0979457 0.453399 0.5 363 63.546 0.0239127 -3.52745 63.546000 Cu 0.17945 0.437931 1 365 63.546 0.108554 -3.52155 63.546000 Cu 0.32001 0.445287 1 366 63.546 0.10969 -3.52905 63.546000 Cu 0.260283 0.423714 0.5 367 63.546 0.0652919 -3.51895 63.546000 Cu 0.241112 0.457258 0.5 368 63.546 0.535996 -3.46387 63.546000 Cu 0.339695 0.409877 6.68119e-17 369 63.546 0.0139853 -3.54076 63.546000 Cu 0.478369 0.415201 0 370 63.546 0.0192419 -3.5416 63.546000 Cu 0.419062 0.395105 0.5 371 63.546 0.0116021 -3.5424 63.546000 Cu 0.398484 0.430609 0.5 372 63.546 0.0554391 -3.54261 63.546000 Cu 0.558645 0.399648 0.5 376 63.546 0.00372597 -3.53955 63.546000 Cu 0.457277 0.450775 0 387 63.546 0.065851 -3.53322 63.546000 Cu 0.597946 0.453399 1 388 63.546 0.0239127 -3.52745 63.546000 Cu 0.53779 0.434661 0.5 389 63.546 0.0126896 -3.53715 63.546000 Cu 0.618741 0.41895 1 391 63.546 0.0111626 -3.53561 63.546000 Cu 0.82001 0.445287 0.5 16 63.546 0.10969 -3.52905 63.546000 Cu 0.919062 0.395105 1.2201e-16 309 63.546 0.0116021 -3.5424 63.546000 Cu 0.898484 0.430609 1 335 63.546 0.0554391 -3.54261 63.546000 Cu 0.978369 0.415201 0.5 337 63.546 0.0192419 -3.5416 63.546000 Cu 0.957277 0.450775 0.5 338 63.546 0.065851 -3.53322 63.546000 Cu 0.760283 0.423714 0 392 63.546 0.0652919 -3.51895 63.546000 Cu 0.699556 0.403834 0.5 393 63.546 0.0242659 -3.53312 63.546000 Cu 0.67945 0.437931 0.5 394 63.546 0.108554 -3.52155 63.546000 Cu 0.779854 0.389283 7.54328e-18 395 63.546 0.00981764 -3.53471 63.546000 Cu 0.839695 0.409877 0.5 396 63.546 0.0139853 -3.54076 63.546000 Cu 0.741112 0.457258 3.01731e-17 400 63.546 0.535996 -3.46387 63.546000 Cu 0.00408229 0.505 1 1 63.546 0.313946 -3.53581 63.546000 Cu 0.0788357 0.522235 0.5 2 63.546 0.200729 -3.51681 63.546000 Cu 0.148142 0.50497 1.42963e-16 32 63.546 3.08004 -3.46212 63.546000 Cu 0.221161 0.520631 0.5 34 63.546 7.25605 -3.2725 63.546000 Cu 0.301921 0.528231 0 35 63.546 5.15157 -3.46719 63.546000 Cu 0.0166948 0.469711 1 361 63.546 0.0585135 -3.52803 63.546000 Cu 0.158998 0.471439 1 362 63.546 0.46739 -3.48071 63.546000 Cu 0.078517 0.487735 0.5 364 63.546 0.210332 -3.51673 63.546000 Cu 0.220697 0.489298 0.5 382 63.546 7.2704 -3.27026 63.546000 Cu 0.301521 0.481758 0 383 63.546 5.14258 -3.46775 63.546000 Cu 0.648142 0.50497 0.5 4 63.546 3.08004 -3.46212 63.546000 Cu 0.437646 0.522996 6.34594e-17 14 63.546 0.329347 -3.51436 63.546000 Cu 0.504082 0.505 0.5 15 63.546 0.313946 -3.53581 63.546000 Cu 0.578836 0.522235 1 17 63.546 0.200729 -3.51681 63.546000 Cu 0.437323 0.486973 6.54948e-17 384 63.546 0.334649 -3.51506 63.546000 Cu 0.377191 0.466751 0.5 385 63.546 0.295548 -3.52234 63.546000 Cu 0.356157 0.50498 0.5 386 63.546 4.19972 -3.59148 63.546000 Cu 0.516695 0.469711 0.5 390 63.546 0.0585135 -3.52803 63.546000 Cu 0.578517 0.487735 0 397 63.546 0.210332 -3.51673 63.546000 Cu 0.658998 0.471439 0.5 399 63.546 0.46739 -3.48071 63.546000 Cu 0.721161 0.520631 0 3 63.546 7.25605 -3.2725 63.546000 Cu 0.801521 0.481758 0.5 5 63.546 5.14258 -3.46775 63.546000 Cu 0.937646 0.522996 0.5 7 63.546 0.329347 -3.51436 63.546000 Cu 0.801921 0.528231 0.5 8 63.546 5.15157 -3.46719 63.546000 Cu 0.877191 0.466751 4.39426e-17 334 63.546 0.295548 -3.52234 63.546000 Cu 0.856157 0.50498 1 359 63.546 4.19972 -3.59148 63.546000 Cu 0.937323 0.486973 0.5 360 63.546 0.334649 -3.51506 63.546000 Cu 0.720697 0.489298 1 398 63.546 7.2704 -3.27026 63.546000 Cu 0.159449 0.53851 1 33 63.546 0.456967 -3.481 63.546000 Cu 0.0171145 0.540269 1 9 63.546 0.0555133 -3.52766 63.546000 Cu 0.038141 0.575304 1 10 63.546 0.0119469 -3.53759 63.546000 Cu 0.0984295 0.55655 0.5 11 63.546 0.0232593 -3.52738 63.546000 Cu 0.119031 0.590997 0.5 13 63.546 0.0112082 -3.53605 63.546000 Cu 0.0590782 0.610296 1 29 63.546 0.00342617 -3.53934 63.546000 Cu 0.320425 0.564659 1 36 63.546 0.108458 -3.52948 63.546000 Cu 0.241516 0.552675 0.5 38 63.546 0.525733 -3.46418 63.546000 Cu 0.179798 0.571999 1 58 63.546 0.105561 -3.52182 63.546000 Cu 0.199923 0.606093 1 59 63.546 0.0241001 -3.53291 63.546000 Cu 0.260604 0.586225 0.5 60 63.546 0.065136 -3.51904 63.546000 Cu 0.659449 0.53851 0.5 19 63.546 0.456967 -3.481 63.546000 Cu 0.59843 0.55655 1 18 63.546 0.0232593 -3.52738 63.546000 Cu 0.517114 0.540269 0.5 20 63.546 0.0555133 -3.52766 63.546000 Cu 0.377679 0.543207 0.5 37 63.546 0.294636 -3.52238 63.546000 Cu 0.457732 0.559191 0 39 63.546 0.0640682 -3.53333 63.546000 Cu 0.478668 0.594749 1 40 63.546 0.0183596 -3.54166 63.546000 Cu 0.538141 0.575304 0.5 41 63.546 0.0119469 -3.53759 63.546000 Cu 0.398804 0.579327 0.5 42 63.546 0.0570079 -3.54273 63.546000 Cu 0.619031 0.590997 1 43 63.546 0.0112082 -3.53605 63.546000 Cu 0.559078 0.610296 0.5 46 63.546 0.00342617 -3.53934 63.546000 Cu 0.34 0.600043 1 61 63.546 0.0143957 -3.54065 63.546000 Cu 0.41956 0.614805 0.5 63 63.546 0.012024 -3.54251 63.546000 Cu 0.877679 0.543207 0 6 63.546 0.294636 -3.52238 63.546000 Cu 0.957732 0.559191 0.5 12 63.546 0.0640682 -3.53333 63.546000 Cu 0.741516 0.552675 1 21 63.546 0.525733 -3.46418 63.546000 Cu 0.760604 0.586225 1 22 63.546 0.065136 -3.51904 63.546000 Cu 0.820425 0.564659 0.5 23 63.546 0.108458 -3.52948 63.546000 Cu 0.679798 0.571999 0.5 24 63.546 0.105561 -3.52182 63.546000 Cu 0.898804 0.579327 1 25 63.546 0.0570079 -3.54273 63.546000 Cu 0.91956 0.614805 1 26 63.546 0.012024 -3.54251 63.546000 Cu 0.978668 0.594749 0.5 27 63.546 0.0183596 -3.54166 63.546000 Cu 0.84 0.600043 0.5 28 63.546 0.0143957 -3.54065 63.546000 Cu 0.699923 0.606093 0.5 45 63.546 0.0241001 -3.53291 63.546000 Cu 0.0800445 0.645218 1 30 63.546 0.000833858 -3.53966 63.546000 Cu 0.0205185 0.665033 0.5 53 63.546 0.00108278 -3.54064 63.546000 Cu 0.10072 0.680126 1 55 63.546 0.000275363 -3.5398 63.546000 Cu 0.280371 0.620609 0.5 64 63.546 0.00872918 -3.53471 63.546000 Cu 0.139737 0.625606 0.5 82 63.546 0.00368076 -3.53763 63.546000 Cu 0.220396 0.640579 0 83 63.546 0.0049803 -3.53679 63.546000 Cu 0.240888 0.675281 1 84 63.546 0.00101022 -3.53859 63.546000 Cu 0.30072 0.655318 0.5 85 63.546 0.00141176 -3.53814 63.546000 Cu 0.160522 0.660334 0.5 86 63.546 0.000963941 -3.53862 63.546000 Cu 0.321041 0.690142 0.5 90 63.546 0.000432888 -3.53949 63.546000 Cu 0.639737 0.625606 1 44 63.546 0.00368076 -3.53763 63.546000 Cu 0.360338 0.635118 0 62 63.546 0.00224349 -3.54071 63.546000 Cu 0.499631 0.629978 1 65 63.546 0.00462467 -3.54107 63.546000 Cu 0.520518 0.665033 1 66 63.546 0.00108278 -3.54064 63.546000 Cu 0.580045 0.645218 0.5 67 63.546 0.000833858 -3.53966 63.546000 Cu 0.440303 0.649972 0.5 68 63.546 0.00260445 -3.54125 63.546000 Cu 0.60072 0.680126 0.5 72 63.546 0.000275363 -3.5398 63.546000 Cu 0.380859 0.670082 1 87 63.546 0.000585058 -3.54023 63.546000 Cu 0.460849 0.685 0.5 89 63.546 0.000662557 -3.54054 63.546000 Cu 0.660522 0.660334 1 69 63.546 0.000963941 -3.53862 63.546000 Cu 0.999631 0.629978 0.5 31 63.546 0.00462467 -3.54107 63.546000 Cu 0.780371 0.620609 1 47 63.546 0.00872918 -3.53471 63.546000 Cu 0.80072 0.655318 1 48 63.546 0.00141176 -3.53814 63.546000 Cu 0.860338 0.635118 0.5 49 63.546 0.00224349 -3.54071 63.546000 Cu 0.720396 0.640579 0.5 50 63.546 0.0049803 -3.53679 63.546000 Cu 0.940303 0.649972 1 51 63.546 0.00260445 -3.54125 63.546000 Cu 0.960849 0.685 1 52 63.546 0.000662557 -3.54054 63.546000 Cu 0.880859 0.670082 0.5 54 63.546 0.000585058 -3.54023 63.546000 Cu 0.740888 0.675281 0.5 71 63.546 0.00101022 -3.53859 63.546000 Cu 0.821041 0.690142 3.44836e-17 73 63.546 0.000432888 -3.53949 63.546000 Cu 0.120806 0.715022 8.24972e-17 56 63.546 0.000110487 -3.5396 63.546000 Cu 0.0408492 0.700006 0.5 57 63.546 0.000379797 -3.54012 63.546000 Cu 0.000423881 0.754919 1.01774e-16 78 63.546 2.03382e-05 -3.54019 63.546000 Cu 0.0606269 0.734939 0.5 79 63.546 0.00010991 -3.54005 63.546000 Cu 0.180911 0.695155 0.5 108 63.546 0.000353264 -3.53936 63.546000 Cu 0.260951 0.710101 3.20889e-17 109 63.546 0.000247025 -3.53937 63.546000 Cu 0.280581 0.744966 0 110 63.546 2.28148e-05 -3.53918 63.546000 Cu 0.200717 0.730009 0.5 112 63.546 3.11417e-05 -3.53931 63.546000 Cu 0.140463 0.749913 6.59738e-17 132 63.546 5.47103e-05 -3.53979 63.546000 Cu 0.220368 0.764879 0.5 134 63.546 3.32192e-05 -3.53946 63.546000 Cu 0.40098 0.705033 2.5264e-17 88 63.546 0.000189681 -3.54026 63.546000 Cu 0.540849 0.700006 1 91 63.546 0.000379797 -3.54012 63.546000 Cu 0.560627 0.734939 1 92 63.546 0.00010991 -3.54005 63.546000 Cu 0.620806 0.715022 0.5 93 63.546 0.000110487 -3.5396 63.546000 Cu 0.480803 0.719972 0.5 94 63.546 0.000143587 -3.54038 63.546000 Cu 0.640463 0.749913 0.5 98 63.546 5.47103e-05 -3.53979 63.546000 Cu 0.340832 0.725033 0.5 111 63.546 0.000123463 -3.53967 63.546000 Cu 0.420611 0.739975 1 113 63.546 3.91731e-05 -3.54009 63.546000 Cu 0.500424 0.754919 0.5 115 63.546 2.03382e-05 -3.54019 63.546000 Cu 0.360412 0.75993 0.5 116 63.546 8.06603e-05 -3.53966 63.546000 Cu 0.680911 0.695155 1 70 63.546 0.000353264 -3.53936 63.546000 Cu 0.840832 0.725033 1 74 63.546 0.000123463 -3.53967 63.546000 Cu 0.90098 0.705033 0.5 75 63.546 0.000189681 -3.54026 63.546000 Cu 0.760951 0.710101 0.5 76 63.546 0.000247025 -3.53937 63.546000 Cu 0.980803 0.719972 0 77 63.546 0.000143587 -3.54038 63.546000 Cu 0.920611 0.739975 0.5 80 63.546 3.91731e-05 -3.54009 63.546000 Cu 0.700717 0.730009 1 95 63.546 3.11417e-05 -3.53931 63.546000 Cu 0.720368 0.764879 1 96 63.546 3.32192e-05 -3.53946 63.546000 Cu 0.780581 0.744966 0.5 97 63.546 2.28148e-05 -3.53918 63.546000 Cu 0.860412 0.75993 0 99 63.546 8.06603e-05 -3.53966 63.546000 Cu 0.0802648 0.769865 0.5 81 63.546 0.000103123 -3.54017 63.546000 Cu 0.0202383 0.789856 3.79559e-17 103 63.546 0.000140759 -3.54007 63.546000 Cu 0.0405539 0.824826 1 104 63.546 0.000359617 -3.54038 63.546000 Cu 0.100244 0.804799 0.5 105 63.546 0.000128941 -3.54012 63.546000 Cu 0.120482 0.839753 0.5 107 63.546 0.000367978 -3.54009 63.546000 Cu 0.160215 0.784817 2.27855e-16 133 63.546 0.000127161 -3.53983 63.546000 Cu 0.300287 0.77985 5.99871e-17 135 63.546 9.28729e-05 -3.53953 63.546000 Cu 0.320447 0.814718 1 136 63.546 0.000108861 -3.53929 63.546000 Cu 0.240236 0.799753 0.5 138 63.546 0.000222495 -3.53929 63.546000 Cu 0.180346 0.819702 1 158 63.546 0.000262909 -3.53934 63.546000 Cu 0.260472 0.834591 0.5 160 63.546 0.000774157 -3.53863 63.546000 Cu 0.440321 0.774902 0 114 63.546 0.000124727 -3.53995 63.546000 Cu 0.580265 0.769865 0 117 63.546 0.000103123 -3.54017 63.546000 Cu 0.600244 0.804799 1 118 63.546 0.000128941 -3.54012 63.546000 Cu 0.520238 0.789856 0.5 120 63.546 0.000140759 -3.54007 63.546000 Cu 0.38033 0.794844 0.5 137 63.546 0.000167754 -3.53963 63.546000 Cu 0.460424 0.809834 1.00817e-16 139 63.546 0.000222854 -3.53982 63.546000 Cu 0.480809 0.844811 3.59204e-19 140 63.546 0.000906151 -3.5409 63.546000 Cu 0.540554 0.824826 0.5 141 63.546 0.000359617 -3.54038 63.546000 Cu 0.400695 0.829741 0.5 142 63.546 0.000278275 -3.53992 63.546000 Cu 0.620482 0.839753 1.50746e-16 143 63.546 0.000367978 -3.54009 63.546000 Cu 0.660215 0.784817 0.5 119 63.546 0.000127161 -3.53983 63.546000 Cu 0.88033 0.794844 1 100 63.546 0.000167754 -3.53963 63.546000 Cu 0.940321 0.774902 0.5 101 63.546 0.000124727 -3.53995 63.546000 Cu 0.800287 0.77985 0.5 102 63.546 9.28729e-05 -3.53953 63.546000 Cu 0.960424 0.809834 0.5 106 63.546 0.000222854 -3.53982 63.546000 Cu 0.740236 0.799753 1 121 63.546 0.000222495 -3.53929 63.546000 Cu 0.760472 0.834591 1 122 63.546 0.000774157 -3.53863 63.546000 Cu 0.820447 0.814718 0.5 123 63.546 0.000108861 -3.53929 63.546000 Cu 0.680346 0.819702 0.5 124 63.546 0.000262909 -3.53934 63.546000 Cu 0.900695 0.829741 1.07043e-16 125 63.546 0.000278275 -3.53992 63.546000 Cu 0.980809 0.844811 0.5 127 63.546 0.000906151 -3.5409 63.546000 Cu 0.0607132 0.859867 8.30958e-17 129 63.546 0.00199595 -3.54135 63.546000 Cu 0.0809314 0.895063 4.78939e-19 130 63.546 0.0111432 -3.54237 63.546000 Cu 0.00104612 0.879896 0.5 131 63.546 0.00453845 -3.54138 63.546000 Cu 0.0216374 0.915149 0.5 153 63.546 0.0184322 -3.54169 63.546000 Cu 0.200347 0.854546 7.10026e-17 159 63.546 0.00148841 -3.53798 63.546000 Cu 0.280432 0.869304 0.5 164 63.546 0.00479335 -3.5369 63.546000 Cu 0.140411 0.874747 0.5 180 63.546 0.00228366 -3.54045 63.546000 Cu 0.220134 0.889267 3.35257e-18 181 63.546 0.00915414 -3.53477 63.546000 Cu 0.300483 0.903812 0.5 183 63.546 0.0232549 -3.53317 63.546000 Cu 0.16032 0.90984 0.5 184 63.546 0.0139637 -3.54074 63.546000 Cu 0.640411 0.874747 1 144 63.546 0.00228366 -3.54045 63.546000 Cu 0.560713 0.859867 0.5 146 63.546 0.00199595 -3.54135 63.546000 Cu 0.340658 0.849548 2.87363e-18 161 63.546 0.000732095 -3.53909 63.546000 Cu 0.360879 0.884295 1.92174e-16 162 63.546 0.00322839 -3.53781 63.546000 Cu 0.420922 0.864666 0.5 163 63.546 0.00100958 -3.54018 63.546000 Cu 0.501046 0.879896 8.18985e-17 165 63.546 0.00453845 -3.54138 63.546000 Cu 0.521637 0.915149 1 166 63.546 0.0184322 -3.54169 63.546000 Cu 0.580931 0.895063 0.5 167 63.546 0.0111432 -3.54237 63.546000 Cu 0.44137 0.899604 0.5 168 63.546 0.00362556 -3.53935 63.546000 Cu 0.381309 0.918912 1.09677e-16 185 63.546 0.0112147 -3.53575 63.546000 Cu 0.66032 0.90984 8.09406e-17 169 63.546 0.0139637 -3.54074 63.546000 Cu 0.920922 0.864666 1.6236e-16 126 63.546 0.00100958 -3.54018 63.546000 Cu 0.840658 0.849548 0.5 128 63.546 0.000732095 -3.53909 63.546000 Cu 0.700347 0.854546 0.5 145 63.546 0.00148841 -3.53798 63.546000 Cu 0.780432 0.869304 5.98673e-19 147 63.546 0.00479335 -3.5369 63.546000 Cu 0.800483 0.903812 7.06434e-18 148 63.546 0.0232549 -3.53317 63.546000 Cu 0.860879 0.884295 0.5 149 63.546 0.00322839 -3.53781 63.546000 Cu 0.720134 0.889267 0.5 150 63.546 0.00915414 -3.53477 63.546000 Cu 0.94137 0.899604 1.04768e-16 151 63.546 0.00362556 -3.53935 63.546000 Cu 0.881309 0.918912 0.5 154 63.546 0.0112147 -3.53575 63.546000 Cu 0.101525 0.930557 3.59204e-19 155 63.546 0.0540606 -3.54283 63.546000 Cu 0.122748 0.966702 1 156 63.546 0.291553 -3.5216 63.546000 Cu 0.0427032 0.950742 0.5 157 63.546 0.0660828 -3.53342 63.546000 Cu 0.0627096 0.986957 0.5 178 63.546 0.341485 -3.51478 63.546000 Cu 0.239748 0.923686 1.00457e-16 182 63.546 0.0639125 -3.51903 63.546000 Cu 0.320575 0.93791 0.5 188 63.546 0.106238 -3.52161 63.546000 Cu 0.179987 0.94524 0.5 195 63.546 0.107874 -3.52885 63.546000 Cu 0.258858 0.957229 1.13628e-16 196 63.546 0.529565 -3.46461 63.546000 Cu 0.279198 0.989303 1 197 63.546 7.26994 -3.27108 63.546000 Cu 0.198405 0.981679 0.5 199 63.546 5.15714 -3.46726 63.546000 Cu 0.601525 0.930557 0.5 172 63.546 0.0540606 -3.54283 63.546000 Cu 0.402068 0.953375 1 186 63.546 0.0242184 -3.52752 63.546000 Cu 0.462225 0.934619 0.5 187 63.546 0.0126056 -3.53739 63.546000 Cu 0.542703 0.950742 0 189 63.546 0.0660828 -3.53342 63.546000 Cu 0.56271 0.986957 7.44749e-17 190 63.546 0.341485 -3.51478 63.546000 Cu 0.622748 0.966702 0.5 191 63.546 0.291553 -3.5216 63.546000 Cu 0.483295 0.969688 0.5 192 63.546 0.0586065 -3.52786 63.546000 Cu 0.340983 0.971413 0.5 198 63.546 0.462627 -3.48141 63.546000 Cu 0.4215 0.98772 8.62089e-18 200 63.546 0.211388 -3.51686 63.546000 Cu 0.962225 0.934619 2.39469e-19 152 63.546 0.0126056 -3.53739 63.546000 Cu 0.679987 0.94524 1 170 63.546 0.107874 -3.52885 63.546000 Cu 0.739748 0.923686 0.5 171 63.546 0.0639125 -3.51903 63.546000 Cu 0.820575 0.93791 1.20573e-16 173 63.546 0.106238 -3.52161 63.546000 Cu 0.840983 0.971413 1.22369e-16 174 63.546 0.462627 -3.48141 63.546000 Cu 0.902068 0.953375 0.5 175 63.546 0.0242184 -3.52752 63.546000 Cu 0.758858 0.957229 0.5 176 63.546 0.529565 -3.46461 63.546000 Cu 0.983295 0.969688 1 177 63.546 0.0586065 -3.52786 63.546000 Cu 0.9215 0.98772 0.5 179 63.546 0.211388 -3.51686 63.546000 Cu 0.698405 0.981679 3.02809e-16 193 63.546 5.15714 -3.46726 63.546000 Cu 0.779198 0.989303 0.5 194 63.546 7.26994 -3.27108