Number of particles = 396 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0835 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.3064 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60711 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 0.0665804 0.00258562 1.05802e-17 204 63.546 0.424724 -3.52504 63.546000 Cu 0.0524472 0.0386971 0 209 63.546 0.0698485 -3.52756 63.546000 Cu 0.190879 0.0423078 0 210 63.546 0.235158 -3.52693 63.546000 Cu 0.13174 0.0210289 0.5 211 63.546 0.395253 -3.4983 63.546000 Cu 0.214225 0.00260652 6.68477e-17 213 63.546 4.69308 -3.57901 63.546000 Cu 0.349133 0.0186314 6.56454e-17 214 63.546 7.74256 -3.27251 63.546000 Cu 0.26602 0.0266781 0.5 215 63.546 5.6619 -3.47509 63.546000 Cu 0.423099 0.00259295 0.5 216 63.546 3.41937 -3.49441 63.546000 Cu 0.32806 0.0514852 4.76109e-17 227 63.546 0.470067 -3.48057 63.546000 Cu 0.471405 0.0555204 8.19966e-17 228 63.546 0.0313896 -3.52844 63.546000 Cu 0.41026 0.0371175 0.5 229 63.546 0.496433 -3.48976 63.546000 Cu 0.490833 0.0203033 3.60689e-18 231 63.546 0.181867 -3.52641 63.546000 Cu 0.63174 0.0210289 3.99162e-17 232 63.546 0.395253 -3.4983 63.546000 Cu 0.56658 0.00258562 0.5 233 63.546 0.424724 -3.52504 63.546000 Cu 0.552447 0.0386971 0.5 234 63.546 0.0698485 -3.52756 63.546000 Cu 0.714225 0.00260652 0.5 235 63.546 4.69308 -3.57901 63.546000 Cu 0.690879 0.0423078 0.5 255 63.546 0.235158 -3.52693 63.546000 Cu 0.923099 0.00259295 0 203 63.546 3.41937 -3.49441 63.546000 Cu 0.990833 0.0203033 0.5 205 63.546 0.181867 -3.52641 63.546000 Cu 0.971405 0.0555204 0.5 207 63.546 0.0313896 -3.52844 63.546000 Cu 0.76602 0.0266781 5.00155e-17 257 63.546 5.6619 -3.47509 63.546000 Cu 0.91026 0.0371175 0 258 63.546 0.496433 -3.48976 63.546000 Cu 0.849133 0.0186314 0.5 259 63.546 7.74256 -3.27251 63.546000 Cu 0.82806 0.0514852 0.5 260 63.546 0.470067 -3.48057 63.546000 Cu 0.0313135 0.0745159 0 206 63.546 0.0145367 -3.53803 63.546000 Cu 0.111534 0.0582293 0.5 212 63.546 0.0747816 -3.53603 63.546000 Cu 0.010696 0.109826 0 219 63.546 0.00363907 -3.54067 63.546000 Cu 0.0909317 0.0941525 0.5 221 63.546 0.023991 -3.54209 63.546000 Cu 0.170543 0.0787894 0 223 63.546 0.0488717 -3.5409 63.546000 Cu 0.229752 0.0996786 0.5 226 63.546 0.0106095 -3.54045 63.546000 Cu 0.248987 0.0640588 0.5 225 63.546 0.0827941 -3.53428 63.546000 Cu 0.309237 0.0857779 0 224 63.546 0.069522 -3.52018 63.546000 Cu 0.389716 0.0712413 0.5 230 63.546 0.100445 -3.52155 63.546000 Cu 0.369865 0.10573 0.5 247 63.546 0.0262501 -3.52936 63.546000 Cu 0.450596 0.0904198 2.86146e-17 249 63.546 0.00934745 -3.53494 63.546000 Cu 0.590932 0.0941525 0 250 63.546 0.023991 -3.54209 63.546000 Cu 0.531313 0.0745159 0.5 251 63.546 0.0145367 -3.53803 63.546000 Cu 0.510696 0.109826 0.5 252 63.546 0.00363907 -3.54067 63.546000 Cu 0.611534 0.0582293 3.60689e-18 253 63.546 0.0747816 -3.53603 63.546000 Cu 0.670543 0.0787894 0.5 256 63.546 0.0488717 -3.5409 63.546000 Cu 0.729752 0.0996786 5.04964e-18 281 63.546 0.0106095 -3.54045 63.546000 Cu 0.748987 0.0640588 0 254 63.546 0.0827941 -3.53428 63.546000 Cu 0.950596 0.0904198 0.5 208 63.546 0.00934745 -3.53494 63.546000 Cu 0.869865 0.10573 0 282 63.546 0.0262501 -3.52936 63.546000 Cu 0.809237 0.0857779 0.5 283 63.546 0.069522 -3.52018 63.546000 Cu 0.889716 0.0712413 0 285 63.546 0.100445 -3.52155 63.546000 Cu 0.150302 0.114396 2.40459e-19 220 63.546 0.0143438 -3.54289 63.546000 Cu 0.0704658 0.129584 0.5 222 63.546 0.0076374 -3.54285 63.546000 Cu 0.0502287 0.164807 0.5 239 63.546 0.00206998 -3.54186 63.546000 Cu 0.130127 0.149698 1 241 63.546 0.0043016 -3.54225 63.546000 Cu 0.209807 0.134873 0.5 243 63.546 0.00222721 -3.54046 63.546000 Cu 0.269726 0.155214 9.23363e-17 242 63.546 0.00291532 -3.53665 63.546000 Cu 0.289585 0.120405 2.40459e-19 245 63.546 0.0132213 -3.53194 63.546000 Cu 0.430214 0.125309 2.40459e-19 246 63.546 0.00371545 -3.53727 63.546000 Cu 0.349844 0.140417 0.5 248 63.546 0.00704805 -3.53512 63.546000 Cu 0.410083 0.160199 0 273 63.546 0.00124392 -3.53863 63.546000 Cu 0.490306 0.144953 0.5 275 63.546 0.0010546 -3.54073 63.546000 Cu 0.550229 0.164807 3.29429e-17 274 63.546 0.00206998 -3.54186 63.546000 Cu 0.570466 0.129584 0 277 63.546 0.0076374 -3.54285 63.546000 Cu 0.709807 0.134873 0 278 63.546 0.00222721 -3.54046 63.546000 Cu 0.650302 0.114396 0.5 279 63.546 0.0143438 -3.54289 63.546000 Cu 0.630127 0.149698 0.5 280 63.546 0.0043016 -3.54225 63.546000 Cu 0.990306 0.144953 6.90118e-17 217 63.546 0.0010546 -3.54073 63.546000 Cu 0.930214 0.125309 0.5 218 63.546 0.00371545 -3.53727 63.546000 Cu 0.789585 0.120405 0.5 284 63.546 0.0132213 -3.53194 63.546000 Cu 0.769726 0.155214 0.5 307 63.546 0.00291532 -3.53665 63.546000 Cu 0.849844 0.140417 4.78514e-17 309 63.546 0.00704805 -3.53512 63.546000 Cu 0.910083 0.160199 0.5 310 63.546 0.00124392 -3.53863 63.546000 Cu 0.110034 0.184847 2.54887e-17 238 63.546 0.00122236 -3.54129 63.546000 Cu 0.0300974 0.199909 0.5 240 63.546 0.000548677 -3.54115 63.546000 Cu 0.189884 0.169941 0.5 244 63.546 0.00063251 -3.54003 63.546000 Cu 0.0900063 0.219923 1.05802e-16 265 63.546 0.000316392 -3.54122 63.546000 Cu 0.169934 0.204961 0.5 267 63.546 0.000212719 -3.54047 63.546000 Cu 0.249871 0.190101 0 269 63.546 0.000554485 -3.53849 63.546000 Cu 0.390036 0.195123 2.26032e-17 270 63.546 0.0004712 -3.53905 63.546000 Cu 0.329894 0.175235 0.5 271 63.546 0.0020028 -3.53761 63.546000 Cu 0.309975 0.210119 0.5 272 63.546 0.000478152 -3.5384 63.546000 Cu 0.470167 0.180002 0.5 276 63.546 0.000279853 -3.54033 63.546000 Cu 0.450067 0.21502 0.5 299 63.546 8.91426e-05 -3.54022 63.546000 Cu 0.530097 0.199909 3.99162e-17 301 63.546 0.000548677 -3.54115 63.546000 Cu 0.669934 0.204961 2.40459e-19 302 63.546 0.000212719 -3.54047 63.546000 Cu 0.610034 0.184847 0.5 303 63.546 0.00122236 -3.54129 63.546000 Cu 0.590006 0.219923 0.5 304 63.546 0.000316392 -3.54122 63.546000 Cu 0.689884 0.169941 0 305 63.546 0.00063251 -3.54003 63.546000 Cu 0.749871 0.190101 0.5 308 63.546 0.000554485 -3.53849 63.546000 Cu 0.950067 0.21502 6.54049e-17 236 63.546 8.91426e-05 -3.54022 63.546000 Cu 0.970167 0.180002 7.55042e-17 237 63.546 0.000279853 -3.54033 63.546000 Cu 0.829894 0.175235 5.43438e-17 306 63.546 0.0020028 -3.53761 63.546000 Cu 0.809975 0.210119 4.54468e-17 333 63.546 0.000478152 -3.5384 63.546000 Cu 0.890036 0.195123 0.5 334 63.546 0.0004712 -3.53905 63.546000 Cu 0.06999 0.254959 9.35386e-17 262 63.546 7.31899e-05 -3.5404 63.546000 Cu 0.0100249 0.234972 0.5 263 63.546 4.94249e-05 -3.54106 63.546000 Cu 0.229955 0.225033 1.80344e-17 266 63.546 0.000100003 -3.53897 63.546000 Cu 0.149976 0.239957 0.5 268 63.546 0.000123192 -3.53977 63.546000 Cu 0.129978 0.27492 0.5 291 63.546 0.000190673 -3.5393 63.546000 Cu 0.209987 0.259959 7.21378e-17 293 63.546 4.48785e-05 -3.53872 63.546000 Cu 0.350045 0.265035 0 294 63.546 0.000128692 -3.54023 63.546000 Cu 0.290008 0.24503 0.5 295 63.546 4.39981e-05 -3.5388 63.546000 Cu 0.370033 0.230066 5.07369e-17 297 63.546 0.000164252 -3.53919 63.546000 Cu 0.430045 0.25003 0.5 300 63.546 6.99175e-05 -3.54062 63.546000 Cu 0.49 0.270017 0 325 63.546 4.88278e-05 -3.54085 63.546000 Cu 0.510025 0.234972 2.40459e-19 298 63.546 4.94249e-05 -3.54106 63.546000 Cu 0.629978 0.27492 5.00155e-17 326 63.546 0.000190673 -3.5393 63.546000 Cu 0.56999 0.254959 0.5 327 63.546 7.31899e-05 -3.5404 63.546000 Cu 0.649976 0.239957 0 329 63.546 0.000123192 -3.53977 63.546000 Cu 0.729955 0.225033 0.5 331 63.546 0.000100003 -3.53897 63.546000 Cu 0.709987 0.259959 0.5 332 63.546 4.48785e-05 -3.53872 63.546000 Cu 0.930045 0.25003 6.78095e-17 261 63.546 6.99175e-05 -3.54062 63.546000 Cu 0.99 0.270017 0.5 264 63.546 4.88278e-05 -3.54085 63.546000 Cu 0.790008 0.24503 1.26001e-16 330 63.546 4.39981e-05 -3.5388 63.546000 Cu 0.870033 0.230066 0.5 335 63.546 0.000164252 -3.53919 63.546000 Cu 0.850045 0.265035 0.5 359 63.546 0.000128692 -3.54023 63.546000 Cu 0.0298587 0.324983 0 286 63.546 0.000285019 -3.54053 63.546000 Cu 0.0499382 0.289968 0 289 63.546 8.20909e-05 -3.54018 63.546000 Cu 0.190051 0.294877 9.59432e-17 290 63.546 0.000413235 -3.53868 63.546000 Cu 0.10998 0.309867 0.5 292 63.546 0.000439861 -3.53917 63.546000 Cu 0.170122 0.329756 2.40459e-19 317 63.546 0.00178619 -3.53743 63.546000 Cu 0.27006 0.279961 0.5 296 63.546 7.89807e-05 -3.53917 63.546000 Cu 0.250169 0.314884 0.5 319 63.546 0.000597204 -3.53817 63.546000 Cu 0.330079 0.300031 0 321 63.546 0.00024198 -3.54003 63.546000 Cu 0.469923 0.305073 2.38055e-17 322 63.546 0.000468642 -3.54127 63.546000 Cu 0.410023 0.285065 0.5 323 63.546 0.000296631 -3.54115 63.546000 Cu 0.389956 0.320136 0.5 324 63.546 0.00124415 -3.54112 63.546000 Cu 0.549938 0.289968 0.5 328 63.546 8.20909e-05 -3.54018 63.546000 Cu 0.529859 0.324983 0.5 351 63.546 0.000285019 -3.54053 63.546000 Cu 0.60998 0.309867 3.60689e-18 353 63.546 0.000439861 -3.53917 63.546000 Cu 0.690051 0.294877 0.5 355 63.546 0.000413235 -3.53868 63.546000 Cu 0.670122 0.329756 0.5 356 63.546 0.00178619 -3.53743 63.546000 Cu 0.969923 0.305073 0.5 287 63.546 0.000468642 -3.54127 63.546000 Cu 0.750169 0.314884 1 354 63.546 0.000597204 -3.53817 63.546000 Cu 0.77006 0.279961 1.00993e-16 357 63.546 7.89807e-05 -3.53917 63.546000 Cu 0.910023 0.285065 3.27024e-17 358 63.546 0.000296631 -3.54115 63.546000 Cu 0.830079 0.300031 0.5 360 63.546 0.00024198 -3.54003 63.546000 Cu 0.889956 0.320136 1 383 63.546 0.00124415 -3.54112 63.546000 Cu 0.00969871 0.360026 4.80918e-19 313 63.546 0.00103458 -3.54081 63.546000 Cu 0.150195 0.364563 4.80918e-19 314 63.546 0.00713504 -3.535 63.546000 Cu 0.0899541 0.344783 0.5 315 63.546 0.00127686 -3.53862 63.546000 Cu 0.0697939 0.379677 0.5 316 63.546 0.003418 -3.53728 63.546000 Cu 0.230275 0.349768 0.5 320 63.546 0.00287195 -3.53665 63.546000 Cu 0.21044 0.384568 0.5 343 63.546 0.0135806 -3.53207 63.546000 Cu 0.310153 0.335034 2.88551e-18 318 63.546 0.000587093 -3.54004 63.546000 Cu 0.290207 0.370107 1 345 63.546 0.00227124 -3.54059 63.546000 Cu 0.429568 0.37539 4.80918e-19 346 63.546 0.00737495 -3.54283 63.546000 Cu 0.369912 0.35528 0.5 347 63.546 0.00423026 -3.54237 63.546000 Cu 0.449783 0.340177 7.3821e-17 349 63.546 0.0021725 -3.54185 63.546000 Cu 0.589954 0.344783 0 350 63.546 0.00127686 -3.53862 63.546000 Cu 0.509699 0.360026 0.5 352 63.546 0.00103458 -3.54081 63.546000 Cu 0.569794 0.379677 0 375 63.546 0.003418 -3.53728 63.546000 Cu 0.71044 0.384568 9.85883e-18 376 63.546 0.0135806 -3.53207 63.546000 Cu 0.650195 0.364563 0.5 377 63.546 0.00713504 -3.535 63.546000 Cu 0.730275 0.349768 0 379 63.546 0.00287195 -3.53665 63.546000 Cu 0.949783 0.340177 0.5 288 63.546 0.0021725 -3.54185 63.546000 Cu 0.929568 0.37539 0.5 312 63.546 0.00737495 -3.54283 63.546000 Cu 0.869912 0.35528 2.21222e-17 380 63.546 0.00423026 -3.54237 63.546000 Cu 0.810153 0.335034 0.5 381 63.546 0.000587093 -3.54004 63.546000 Cu 0.790207 0.370107 0.5 382 63.546 0.00227124 -3.54059 63.546000 Cu 0.1103 0.433731 1 338 63.546 0.100085 -3.52132 63.546000 Cu 0.0494113 0.41455 0.5 339 63.546 0.00956184 -3.53491 63.546000 Cu 0.130135 0.399248 1 341 63.546 0.0259199 -3.52948 63.546000 Cu 0.190759 0.419202 0.5 344 63.546 0.0680642 -3.52017 63.546000 Cu 0.270283 0.405294 4.80918e-19 342 63.546 0.0103789 -3.54058 63.546000 Cu 0.349714 0.390582 0.5 348 63.546 0.0145584 -3.54288 63.546000 Cu 0.250967 0.440904 4.80918e-19 367 63.546 0.0821437 -3.53423 63.546000 Cu 0.329466 0.426177 0.5 369 63.546 0.0482744 -3.54109 63.546000 Cu 0.409077 0.410819 2.40459e-19 371 63.546 0.023943 -3.54206 63.546000 Cu 0.489343 0.395148 0.5 373 63.546 0.00360661 -3.54049 63.546000 Cu 0.468692 0.430454 0.5 374 63.546 0.0144188 -3.53818 63.546000 Cu 0.549411 0.41455 0 372 63.546 0.00956184 -3.53491 63.546000 Cu 0.630135 0.399248 0.5 378 63.546 0.0259199 -3.52948 63.546000 Cu 0.6103 0.433731 0.5 391 63.546 0.100085 -3.52132 63.546000 Cu 0.690759 0.419202 0 393 63.546 0.0680642 -3.52017 63.546000 Cu 0.909077 0.410819 0.5 198 63.546 0.023943 -3.54206 63.546000 Cu 0.849714 0.390582 1 202 63.546 0.0145584 -3.54288 63.546000 Cu 0.989343 0.395148 2.40459e-19 311 63.546 0.00360661 -3.54049 63.546000 Cu 0.968692 0.430454 0 337 63.546 0.0144188 -3.53818 63.546000 Cu 0.829466 0.426177 6.92522e-17 394 63.546 0.0482744 -3.54109 63.546000 Cu 0.770283 0.405294 0.5 395 63.546 0.0103789 -3.54058 63.546000 Cu 0.750967 0.440904 0.5 396 63.546 0.0821437 -3.53423 63.546000 Cu 0.0285927 0.44945 0.5 340 63.546 0.031011 -3.5282 63.546000 Cu 0.00915352 0.48465 0.5 362 63.546 0.182409 -3.52629 63.546000 Cu 0.089714 0.467843 0 363 63.546 0.495029 -3.48999 63.546000 Cu 0.233972 0.47827 2.40459e-19 364 63.546 5.65627 -3.47507 63.546000 Cu 0.171954 0.453476 0.5 365 63.546 0.470587 -3.48044 63.546000 Cu 0.150894 0.486339 0.5 366 63.546 7.74084 -3.27322 63.546000 Cu 0.388492 0.446731 0 368 63.546 0.0739017 -3.53642 63.546000 Cu 0.309121 0.462651 0.5 370 63.546 0.234855 -3.52716 63.546000 Cu 0.36823 0.483914 2.23627e-17 385 63.546 0.39478 -3.49858 63.546000 Cu 0.447584 0.46626 0.5 387 63.546 0.0688988 -3.52731 63.546000 Cu 0.733972 0.47827 0.5 16 63.546 5.65627 -3.47507 63.546000 Cu 0.650894 0.486339 0 195 63.546 7.74084 -3.27322 63.546000 Cu 0.509154 0.48465 0 386 63.546 0.182409 -3.52629 63.546000 Cu 0.528593 0.44945 2.88551e-18 389 63.546 0.031011 -3.5282 63.546000 Cu 0.671954 0.453476 3.10192e-17 390 63.546 0.470587 -3.48044 63.546000 Cu 0.589714 0.467843 0.5 392 63.546 0.495029 -3.48999 63.546000 Cu 0.86823 0.483914 0.5 1 63.546 0.39478 -3.49858 63.546000 Cu 0.888492 0.446731 0.5 5 63.546 0.0739017 -3.53642 63.546000 Cu 0.809121 0.462651 0 15 63.546 0.234855 -3.52716 63.546000 Cu 0.947584 0.46626 0 336 63.546 0.0688988 -3.52731 63.546000 Cu 0.00916536 0.520071 0.5 2 63.546 0.182397 -3.52642 63.546000 Cu 0.0286396 0.555303 0.5 11 63.546 0.033618 -3.52851 63.546000 Cu 0.076886 0.502361 4.80918e-19 32 63.546 3.4238 -3.49427 63.546000 Cu 0.0897081 0.536872 4.80918e-19 33 63.546 0.496675 -3.49072 63.546000 Cu 0.150982 0.518352 0.5 34 63.546 7.73832 -3.27385 63.546000 Cu 0.23402 0.52646 4.80918e-19 35 63.546 5.65593 -3.47464 63.546000 Cu 0.172025 0.551208 0.5 38 63.546 0.455598 -3.48158 63.546000 Cu 0.285773 0.50233 0.5 384 63.546 4.68809 -3.57936 63.546000 Cu 0.36823 0.52078 2.59696e-17 14 63.546 0.399997 -3.49817 63.546000 Cu 0.447542 0.538448 0.5 20 63.546 0.0698331 -3.52717 63.546000 Cu 0.309153 0.542041 0.5 37 63.546 0.23554 -3.52601 63.546000 Cu 0.433428 0.502359 0.5 388 63.546 0.423167 -3.52526 63.546000 Cu 0.650982 0.518352 6.32408e-17 3 63.546 7.73832 -3.27385 63.546000 Cu 0.576886 0.502361 0.5 4 63.546 3.4238 -3.49427 63.546000 Cu 0.73402 0.52646 0.5 8 63.546 5.65593 -3.47464 63.546000 Cu 0.509165 0.520071 7.47828e-17 17 63.546 0.182397 -3.52642 63.546000 Cu 0.52864 0.555303 0 18 63.546 0.033618 -3.52851 63.546000 Cu 0.589708 0.536872 0.5 19 63.546 0.496675 -3.49072 63.546000 Cu 0.672025 0.551208 6.25194e-17 21 63.546 0.455598 -3.48158 63.546000 Cu 0.785773 0.50233 9.13745e-18 194 63.546 4.68809 -3.57936 63.546000 Cu 0.809153 0.542041 1.99581e-17 6 63.546 0.23554 -3.52601 63.546000 Cu 0.86823 0.52078 0.5 7 63.546 0.399997 -3.49817 63.546000 Cu 0.947542 0.538448 6.44431e-17 9 63.546 0.0698331 -3.52717 63.546000 Cu 0.933428 0.502359 3.34238e-17 361 63.546 0.423167 -3.52526 63.546000 Cu 0.04962 0.590188 0.5 13 63.546 0.00974556 -3.53469 63.546000 Cu 0.110434 0.57099 6.94927e-17 58 63.546 0.0990866 -3.52163 63.546000 Cu 0.130286 0.605487 1.61108e-17 59 63.546 0.0253384 -3.52952 63.546000 Cu 0.19096 0.585527 0.5 60 63.546 0.0673073 -3.5203 63.546000 Cu 0.251096 0.563828 1 36 63.546 0.0795999 -3.53442 63.546000 Cu 0.388447 0.557981 0 39 63.546 0.0769547 -3.53618 63.546000 Cu 0.409246 0.593916 1.05802e-17 40 63.546 0.0244895 -3.54187 63.546000 Cu 0.468736 0.574269 0.5 41 63.546 0.0154619 -3.53774 63.546000 Cu 0.329562 0.578556 0.5 42 63.546 0.0482783 -3.5407 63.546000 Cu 0.489424 0.60958 0.5 46 63.546 0.00392582 -3.54053 63.546000 Cu 0.270433 0.599463 9.61837e-18 61 63.546 0.009952 -3.54029 63.546000 Cu 0.69096 0.585527 0 22 63.546 0.0673073 -3.5203 63.546000 Cu 0.610434 0.57099 0.5 24 63.546 0.0990866 -3.52163 63.546000 Cu 0.54962 0.590188 0 43 63.546 0.00974556 -3.53469 63.546000 Cu 0.630286 0.605487 0.5 45 63.546 0.0253384 -3.52952 63.546000 Cu 0.968736 0.574269 1 10 63.546 0.0154619 -3.53774 63.546000 Cu 0.888447 0.557981 0.5 12 63.546 0.0769547 -3.53618 63.546000 Cu 0.751096 0.563828 0.5 23 63.546 0.0795999 -3.53442 63.546000 Cu 0.829562 0.578556 3.84735e-18 25 63.546 0.0482783 -3.5407 63.546000 Cu 0.909246 0.593916 0.5 27 63.546 0.0244895 -3.54187 63.546000 Cu 0.770433 0.599463 0.5 28 63.546 0.009952 -3.54029 63.546000 Cu 0.989424 0.60958 1 29 63.546 0.00392582 -3.54053 63.546000 Cu 0.00966592 0.644739 1 30 63.546 0.00113896 -3.54083 63.546000 Cu 0.210475 0.620176 0.5 64 63.546 0.0123484 -3.53225 63.546000 Cu 0.0698309 0.62509 0.5 82 63.546 0.00388982 -3.53753 63.546000 Cu 0.150133 0.640214 0 83 63.546 0.00722824 -3.53542 63.546000 Cu 0.230222 0.655023 0.5 85 63.546 0.00271265 -3.53672 63.546000 Cu 0.0898863 0.660019 0.5 86 63.546 0.00140178 -3.53862 63.546000 Cu 0.290173 0.63467 1.00993e-17 62 63.546 0.00192318 -3.54037 63.546000 Cu 0.349824 0.614176 0.5 63 63.546 0.0137707 -3.54264 63.546000 Cu 0.429561 0.629357 0 65 63.546 0.00807706 -3.54275 63.546000 Cu 0.449738 0.664616 8.70462e-17 66 63.546 0.00226543 -3.5419 63.546000 Cu 0.369848 0.649498 0.5 68 63.546 0.00426989 -3.54214 63.546000 Cu 0.569831 0.62509 1 44 63.546 0.00388982 -3.53753 63.546000 Cu 0.710475 0.620176 7.52637e-17 47 63.546 0.0123484 -3.53225 63.546000 Cu 0.730222 0.655023 3.60689e-18 48 63.546 0.00271265 -3.53672 63.546000 Cu 0.650133 0.640214 0.5 50 63.546 0.00722824 -3.53542 63.546000 Cu 0.509666 0.644739 0.5 67 63.546 0.00113896 -3.54083 63.546000 Cu 0.589886 0.660019 7.86302e-17 69 63.546 0.00140178 -3.53862 63.546000 Cu 0.849824 0.614176 8.68058e-17 26 63.546 0.0137707 -3.54264 63.546000 Cu 0.929561 0.629357 0.5 31 63.546 0.00807706 -3.54275 63.546000 Cu 0.790173 0.63467 0.5 49 63.546 0.00192318 -3.54037 63.546000 Cu 0.869848 0.649498 3.8233e-17 51 63.546 0.00426989 -3.54214 63.546000 Cu 0.949738 0.664616 0.5 53 63.546 0.00226543 -3.5419 63.546000 Cu 0.0298095 0.679838 1 55 63.546 0.000301495 -3.54039 63.546000 Cu 0.0499161 0.714915 1 56 63.546 9.07564e-05 -3.54034 63.546000 Cu 0.170071 0.675076 0 84 63.546 0.0021538 -3.53761 63.546000 Cu 0.109932 0.694992 0.5 108 63.546 0.000537109 -3.53901 63.546000 Cu 0.190008 0.710012 7.21378e-19 109 63.546 0.000525458 -3.53855 63.546000 Cu 0.310073 0.669767 7.04545e-17 87 63.546 0.000584243 -3.54 63.546000 Cu 0.330047 0.704837 2.42864e-17 88 63.546 0.000219432 -3.54051 63.546000 Cu 0.389937 0.684686 0.5 89 63.546 0.00134262 -3.54134 63.546000 Cu 0.250091 0.689958 0.5 90 63.546 0.000551018 -3.53864 63.546000 Cu 0.469886 0.699774 5.8672e-17 91 63.546 0.000582913 -3.54121 63.546000 Cu 0.409979 0.719818 0.5 94 63.546 0.000387841 -3.54121 63.546000 Cu 0.609932 0.694992 6.4924e-18 70 63.546 0.000537109 -3.53901 63.546000 Cu 0.670071 0.675076 0.5 71 63.546 0.0021538 -3.53761 63.546000 Cu 0.529809 0.679838 0.5 72 63.546 0.000301495 -3.54039 63.546000 Cu 0.690008 0.710012 0.5 76 63.546 0.000525458 -3.53855 63.546000 Cu 0.549916 0.714915 0.5 93 63.546 9.07564e-05 -3.54034 63.546000 Cu 0.889937 0.684686 1.80344e-17 52 63.546 0.00134262 -3.54134 63.546000 Cu 0.810073 0.669767 0.5 54 63.546 0.000584243 -3.54 63.546000 Cu 0.969886 0.699774 0.5 57 63.546 0.000582913 -3.54121 63.546000 Cu 0.750091 0.689958 0 73 63.546 0.000551018 -3.53864 63.546000 Cu 0.830047 0.704837 0.5 75 63.546 0.000219432 -3.54051 63.546000 Cu 0.909979 0.719818 7.11759e-17 77 63.546 0.000387841 -3.54121 63.546000 Cu 0.0100127 0.770011 0.5 81 63.546 4.97805e-05 -3.54089 63.546000 Cu 0.209993 0.744982 6.30003e-17 110 63.546 5.28198e-05 -3.53879 63.546000 Cu 0.129957 0.729996 0.5 112 63.546 0.000209268 -3.53933 63.546000 Cu 0.0699576 0.749993 0 132 63.546 8.94324e-05 -3.54066 63.546000 Cu 0.149961 0.765025 0.5 134 63.546 0.00015446 -3.54019 63.546000 Cu 0.489968 0.734901 3.94353e-17 92 63.546 5.08941e-05 -3.54113 63.546000 Cu 0.270033 0.724947 0.5 111 63.546 9.99132e-05 -3.53904 63.546000 Cu 0.350025 0.73989 7.69469e-17 113 63.546 0.00014941 -3.53976 63.546000 Cu 0.370041 0.774914 5.74697e-17 114 63.546 0.000233903 -3.53938 63.546000 Cu 0.430013 0.754918 0.5 115 63.546 9.32514e-05 -3.54045 63.546000 Cu 0.29002 0.75993 0.5 116 63.546 5.20467e-05 -3.53871 63.546000 Cu 0.629957 0.729996 0 95 63.546 0.000209268 -3.53933 63.546000 Cu 0.649961 0.765025 2.40459e-19 96 63.546 0.00015446 -3.54019 63.546000 Cu 0.709993 0.744982 0.5 97 63.546 5.28198e-05 -3.53879 63.546000 Cu 0.569958 0.749993 0.5 98 63.546 8.94324e-05 -3.54066 63.546000 Cu 0.510013 0.770011 6.25194e-18 117 63.546 4.97805e-05 -3.54089 63.546000 Cu 0.770033 0.724947 0 74 63.546 9.99132e-05 -3.53904 63.546000 Cu 0.930013 0.754918 3.75116e-17 78 63.546 9.32514e-05 -3.54045 63.546000 Cu 0.989968 0.734901 0.5 79 63.546 5.08941e-05 -3.54113 63.546000 Cu 0.850025 0.73989 0.5 80 63.546 0.00014941 -3.53976 63.546000 Cu 0.79002 0.75993 0 99 63.546 5.20467e-05 -3.53871 63.546000 Cu 0.870041 0.774914 0.5 101 63.546 0.000233903 -3.53938 63.546000 Cu 0.0301037 0.805133 0.5 105 63.546 0.000496165 -3.54125 63.546000 Cu 0.0899944 0.785093 3.60689e-18 133 63.546 0.000364935 -3.54112 63.546000 Cu 0.22996 0.779971 2.62101e-17 135 63.546 8.14799e-05 -3.53927 63.546000 Cu 0.169945 0.800081 0.5 138 63.546 0.000248367 -3.54009 63.546000 Cu 0.110078 0.820224 5.26606e-17 158 63.546 0.00130801 -3.54115 63.546000 Cu 0.249875 0.814956 8.10347e-17 136 63.546 0.000579813 -3.53834 63.546000 Cu 0.450085 0.789997 0.5 120 63.546 8.43453e-05 -3.54028 63.546000 Cu 0.309977 0.794909 0.5 137 63.546 0.00046003 -3.5388 63.546000 Cu 0.39006 0.809926 5.55461e-17 139 63.546 0.000509932 -3.53922 63.546000 Cu 0.47018 0.825078 0.5 141 63.546 0.000308196 -3.54062 63.546000 Cu 0.329921 0.829848 0.5 142 63.546 0.00193351 -3.53759 63.546000 Cu 0.72996 0.779971 0.5 102 63.546 8.14799e-05 -3.53927 63.546000 Cu 0.530104 0.805133 6.56454e-17 118 63.546 0.000496165 -3.54125 63.546000 Cu 0.589994 0.785093 0.5 119 63.546 0.000364935 -3.54112 63.546000 Cu 0.669945 0.800081 2.45268e-17 121 63.546 0.000248367 -3.54009 63.546000 Cu 0.610078 0.820224 0.5 124 63.546 0.00130801 -3.54115 63.546000 Cu 0.749875 0.814956 0.5 123 63.546 0.000579813 -3.53834 63.546000 Cu 0.809977 0.794909 1.09649e-16 100 63.546 0.00046003 -3.5388 63.546000 Cu 0.950085 0.789997 0 103 63.546 8.43453e-05 -3.54028 63.546000 Cu 0.97018 0.825078 9.54623e-17 104 63.546 0.000308196 -3.54062 63.546000 Cu 0.89006 0.809926 0.5 106 63.546 0.000509932 -3.53922 63.546000 Cu 0.829921 0.829848 6.51644e-17 125 63.546 0.00193351 -3.53759 63.546000 Cu 0.0502535 0.840301 0.5 107 63.546 0.00231856 -3.54196 63.546000 Cu 0.130131 0.855418 9.1615e-17 159 63.546 0.00417324 -3.54229 63.546000 Cu 0.189905 0.835141 0.5 160 63.546 0.000535195 -3.53996 63.546000 Cu 0.209821 0.870251 0.5 164 63.546 0.00193489 -3.54051 63.546000 Cu 0.0704135 0.875562 0.5 180 63.546 0.00785069 -3.54273 63.546000 Cu 0.410091 0.844901 1.94772e-17 140 63.546 0.00139357 -3.53862 63.546000 Cu 0.490332 0.860181 0.5 146 63.546 0.00113474 -3.54087 63.546000 Cu 0.269782 0.849897 3.60689e-18 161 63.546 0.00268447 -3.53675 63.546000 Cu 0.289522 0.884747 2.62101e-17 162 63.546 0.0124735 -3.53235 63.546000 Cu 0.349843 0.864709 0.5 163 63.546 0.00717612 -3.53526 63.546000 Cu 0.430161 0.879841 1 165 63.546 0.00367178 -3.53745 63.546000 Cu 0.689905 0.835141 0 122 63.546 0.000535195 -3.53996 63.546000 Cu 0.550253 0.840301 0 143 63.546 0.00231856 -3.54196 63.546000 Cu 0.570413 0.875562 7.43019e-17 144 63.546 0.00785069 -3.54273 63.546000 Cu 0.630131 0.855418 0.5 145 63.546 0.00417324 -3.54229 63.546000 Cu 0.709821 0.870251 5.53056e-18 147 63.546 0.00193489 -3.54051 63.546000 Cu 0.849843 0.864709 7.57446e-17 126 63.546 0.00717612 -3.53526 63.546000 Cu 0.910091 0.844901 0.5 127 63.546 0.00139357 -3.53862 63.546000 Cu 0.769782 0.849897 0.5 128 63.546 0.00268447 -3.53675 63.546000 Cu 0.990332 0.860181 9.57028e-17 129 63.546 0.00113474 -3.54087 63.546000 Cu 0.930161 0.879841 0.5 131 63.546 0.00367178 -3.53745 63.546000 Cu 0.789522 0.884747 0.5 149 63.546 0.0124735 -3.53235 63.546000 Cu 0.01055 0.895346 3.70307e-17 130 63.546 0.0039043 -3.54043 63.546000 Cu 0.0312389 0.930669 1.92367e-18 155 63.546 0.0153318 -3.53792 63.546000 Cu 0.15017 0.890749 6.85309e-17 181 63.546 0.0138803 -3.54254 63.546000 Cu 0.170417 0.92637 1.13978e-16 182 63.546 0.0474071 -3.54079 63.546000 Cu 0.229535 0.905462 0.5 183 63.546 0.00973809 -3.54035 63.546000 Cu 0.0907431 0.91101 0.5 184 63.546 0.0243164 -3.54179 63.546000 Cu 0.248932 0.941102 0.5 188 63.546 0.0786153 -3.53441 63.546000 Cu 0.450363 0.914742 0 166 63.546 0.00985426 -3.53493 63.546000 Cu 0.369713 0.899444 0.5 168 63.546 0.0250352 -3.52969 63.546000 Cu 0.309042 0.919413 1 185 63.546 0.0658405 -3.52056 63.546000 Cu 0.389541 0.933956 0.5 187 63.546 0.097866 -3.52158 63.546000 Cu 0.729535 0.905462 1.03397e-17 148 63.546 0.00973809 -3.54035 63.546000 Cu 0.65017 0.890749 0.5 150 63.546 0.0138803 -3.54254 63.546000 Cu 0.51055 0.895346 0.5 167 63.546 0.0039043 -3.54043 63.546000 Cu 0.590743 0.91101 0 169 63.546 0.0243164 -3.54179 63.546000 Cu 0.670417 0.92637 0.5 171 63.546 0.0474071 -3.54079 63.546000 Cu 0.531239 0.930669 0.5 172 63.546 0.0153318 -3.53792 63.546000 Cu 0.748932 0.941102 0 173 63.546 0.0786153 -3.53441 63.546000 Cu 0.869713 0.899444 7.62256e-17 151 63.546 0.0250352 -3.52969 63.546000 Cu 0.889541 0.933956 0 152 63.546 0.097866 -3.52158 63.546000 Cu 0.950363 0.914742 0.5 153 63.546 0.00985426 -3.53493 63.546000 Cu 0.809042 0.919413 0.5 154 63.546 0.0658405 -3.52056 63.546000 Cu 0.052423 0.966488 2.14009e-17 156 63.546 0.0694746 -3.52692 63.546000 Cu 0.111508 0.94695 0.5 196 63.546 0.0761301 -3.53632 63.546000 Cu 0.190825 0.96289 5.43438e-17 197 63.546 0.234581 -3.52613 63.546000 Cu 0.131765 0.984158 0.5 200 63.546 0.400913 -3.49812 63.546000 Cu 0.327961 0.953733 1.16382e-16 186 63.546 0.454524 -3.48165 63.546000 Cu 0.471342 0.949645 1.12294e-16 189 63.546 0.0331159 -3.52825 63.546000 Cu 0.49082 0.984873 1.09409e-16 190 63.546 0.182461 -3.5265 63.546000 Cu 0.410291 0.968072 0.5 192 63.546 0.494726 -3.49084 63.546000 Cu 0.265975 0.97847 0.5 199 63.546 5.65938 -3.47437 63.546000 Cu 0.348986 0.986608 8.65653e-17 201 63.546 7.74428 -3.2752 63.546000 Cu 0.611508 0.94695 4.73705e-17 170 63.546 0.0761301 -3.53632 63.546000 Cu 0.690825 0.96289 0.5 176 63.546 0.234581 -3.52613 63.546000 Cu 0.552423 0.966488 0.5 191 63.546 0.0694746 -3.52692 63.546000 Cu 0.631765 0.984158 0 193 63.546 0.400913 -3.49812 63.546000 Cu 0.971342 0.949645 0.5 157 63.546 0.0331159 -3.52825 63.546000 Cu 0.765975 0.97847 3.84735e-18 174 63.546 5.65938 -3.47437 63.546000 Cu 0.827961 0.953733 0.5 175 63.546 0.454524 -3.48165 63.546000 Cu 0.910291 0.968072 0 177 63.546 0.494726 -3.49084 63.546000 Cu 0.99082 0.984873 0.5 178 63.546 0.182461 -3.5265 63.546000 Cu 0.848986 0.986608 0.5 179 63.546 7.74428 -3.2752