Number of particles = 398 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0331 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.3072 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62137 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 0.0995117 0.0447873 0 210 63.546 0.060618 -3.54285 63.546000 Cu 0.0404585 0.0243493 0.5 211 63.546 0.0882077 -3.53609 63.546000 Cu 0.120094 0.00852828 1 213 63.546 0.28067 -3.52039 63.546000 Cu 0.177751 0.0302903 0.5 215 63.546 0.0764756 -3.52598 63.546000 Cu 0.237948 0.0519295 1 227 63.546 0.0743443 -3.52155 63.546000 Cu 0.256818 0.0180806 2.13525e-16 214 63.546 0.482122 -3.47472 63.546000 Cu 0.338837 0.00372663 0.5 216 63.546 0.439641 -3.4959 63.546000 Cu 0.379536 0.0565541 0 228 63.546 0.0113068 -3.53663 63.546000 Cu 0.318399 0.0375446 0.5 229 63.546 0.114845 -3.52437 63.546000 Cu 0.399859 0.0218393 1 231 63.546 0.0241949 -3.53071 63.546000 Cu 0.480952 0.00521802 0.5 233 63.546 0.0594238 -3.52585 63.546000 Cu 0.460153 0.0406138 0.5 234 63.546 0.0161973 -3.53866 63.546000 Cu 0.540458 0.0243493 1 232 63.546 0.0882077 -3.53609 63.546000 Cu 0.620094 0.00852828 0.5 235 63.546 0.28067 -3.52039 63.546000 Cu 0.599512 0.0447873 0.5 255 63.546 0.060618 -3.54285 63.546000 Cu 0.677751 0.0302903 4.49085e-17 257 63.546 0.0764756 -3.52598 63.546000 Cu 0.737948 0.0519295 0.5 260 63.546 0.0743443 -3.52155 63.546000 Cu 0.756818 0.0180806 0.5 259 63.546 0.482122 -3.47472 63.546000 Cu 0.838837 0.00372663 9.98764e-17 203 63.546 0.439641 -3.4959 63.546000 Cu 0.980952 0.00521802 0 204 63.546 0.0594238 -3.52585 63.546000 Cu 0.899859 0.0218393 0.5 205 63.546 0.0241949 -3.53071 63.546000 Cu 0.879536 0.0565541 0.5 207 63.546 0.0113068 -3.53663 63.546000 Cu 0.960153 0.0406138 2.43583e-16 209 63.546 0.0161973 -3.53866 63.546000 Cu 0.818399 0.0375446 1.21552e-16 258 63.546 0.114845 -3.52437 63.546000 Cu 0.0200451 0.0601681 0.5 212 63.546 0.0282095 -3.54275 63.546000 Cu 0.0607261 0.115768 1 220 63.546 0.00398346 -3.54167 63.546000 Cu 0.0797762 0.0804205 1 223 63.546 0.015761 -3.54248 63.546000 Cu 0.219166 0.0864586 4.80221e-17 224 63.546 0.0133467 -3.5339 63.546000 Cu 0.158763 0.0657432 0.5 225 63.546 0.0120375 -3.53827 63.546000 Cu 0.139895 0.100921 0.5 226 63.546 0.00266246 -3.53983 63.546000 Cu 0.000391695 0.0956323 0.5 221 63.546 0.00776912 -3.54225 63.546000 Cu 0.299062 0.0718594 0.5 230 63.546 0.0315989 -3.53277 63.546000 Cu 0.280149 0.106494 0.5 247 63.546 0.00835184 -3.53634 63.546000 Cu 0.360071 0.091369 1 249 63.546 0.00423274 -3.5382 63.546000 Cu 0.440146 0.0758546 0.5 251 63.546 0.00537772 -3.54072 63.546000 Cu 0.420796 0.110999 0.5 252 63.546 0.00146128 -3.54062 63.546000 Cu 0.500392 0.0956323 0 250 63.546 0.00776912 -3.54225 63.546000 Cu 0.520045 0.0601681 1.41192e-16 253 63.546 0.0282095 -3.54275 63.546000 Cu 0.658763 0.0657432 2.39512e-19 254 63.546 0.0120375 -3.53827 63.546000 Cu 0.579776 0.0804205 0.5 256 63.546 0.015761 -3.54248 63.546000 Cu 0.560726 0.115768 0.5 279 63.546 0.00398346 -3.54167 63.546000 Cu 0.639895 0.100921 0 281 63.546 0.00266246 -3.53983 63.546000 Cu 0.719166 0.0864586 0.5 283 63.546 0.0133467 -3.5339 63.546000 Cu 0.940146 0.0758546 1.24546e-17 206 63.546 0.00537772 -3.54072 63.546000 Cu 0.860071 0.091369 0.5 208 63.546 0.00423274 -3.5382 63.546000 Cu 0.920796 0.110999 0 219 63.546 0.00146128 -3.54062 63.546000 Cu 0.780149 0.106494 4.41899e-17 282 63.546 0.00835184 -3.53634 63.546000 Cu 0.799062 0.0718594 2.39512e-19 285 63.546 0.0315989 -3.53277 63.546000 Cu 0.042125 0.150969 7.5566e-17 241 63.546 0.00102942 -3.54089 63.546000 Cu 0.182098 0.156211 1 242 63.546 0.000692028 -3.53889 63.546000 Cu 0.121314 0.13604 0.5 243 63.546 0.000572957 -3.5401 63.546000 Cu 0.102648 0.171109 0.5 244 63.546 0.000303978 -3.53982 63.546000 Cu 0.20061 0.121274 1.11373e-17 245 63.546 0.00272463 -3.53775 63.546000 Cu 0.24277 0.17623 0.5 271 63.546 0.000448044 -3.53895 63.546000 Cu 0.261588 0.141319 0.5 248 63.546 0.00199263 -3.53833 63.546000 Cu 0.341161 0.126258 1 246 63.546 0.00120787 -3.53903 63.546000 Cu 0.322478 0.161218 0 273 63.546 0.000534295 -3.5395 63.546000 Cu 0.462694 0.166034 1.21552e-16 274 63.546 0.000681009 -3.54099 63.546000 Cu 0.402051 0.146083 0.5 275 63.546 0.000426431 -3.54063 63.546000 Cu 0.481484 0.130881 0 277 63.546 0.00218629 -3.54141 63.546000 Cu 0.621314 0.13604 0 278 63.546 0.000572957 -3.5401 63.546000 Cu 0.542125 0.150969 0.5 280 63.546 0.00102942 -3.54089 63.546000 Cu 0.70061 0.121274 0.5 284 63.546 0.00272463 -3.53775 63.546000 Cu 0.602648 0.171109 1 305 63.546 0.000303978 -3.53982 63.546000 Cu 0.74277 0.17623 4.71838e-17 306 63.546 0.000448044 -3.53895 63.546000 Cu 0.682098 0.156211 0.5 307 63.546 0.000692028 -3.53889 63.546000 Cu 0.761588 0.141319 1.64066e-17 309 63.546 0.00199263 -3.53833 63.546000 Cu 0.902051 0.146083 1 217 63.546 0.000426431 -3.54063 63.546000 Cu 0.841161 0.126258 0.5 218 63.546 0.00120787 -3.53903 63.546000 Cu 0.981484 0.130881 0.5 222 63.546 0.00218629 -3.54141 63.546000 Cu 0.962694 0.166034 0.5 239 63.546 0.000681009 -3.54099 63.546000 Cu 0.822478 0.161218 0.5 310 63.546 0.000534295 -3.5395 63.546000 Cu 0.0230912 0.186085 0 238 63.546 0.000280353 -3.54065 63.546000 Cu 0.143589 0.226159 5.86804e-17 266 63.546 5.22658e-05 -3.53954 63.546000 Cu 0.0833334 0.206148 0.5 267 63.546 8.75961e-05 -3.54016 63.546000 Cu 0.163042 0.191173 1 269 63.546 0.000174732 -3.53934 63.546000 Cu 0.223449 0.211168 0.5 272 63.546 4.08556e-05 -3.5393 63.546000 Cu 0.00353463 0.221164 1.21193e-16 265 63.546 2.21651e-05 -3.54046 63.546000 Cu 0.303281 0.196183 2.61068e-16 270 63.546 0.000149282 -3.53933 63.546000 Cu 0.383031 0.181137 0.5 276 63.546 0.0002087 -3.54008 63.546000 Cu 0.283706 0.231148 8.33501e-17 297 63.546 0.000101359 -3.53953 63.546000 Cu 0.363597 0.216143 0.5 299 63.546 0.000145037 -3.54004 63.546000 Cu 0.443357 0.201123 1 301 63.546 0.000117254 -3.54045 63.546000 Cu 0.503535 0.221164 0.5 304 63.546 2.21651e-05 -3.54046 63.546000 Cu 0.583333 0.206148 1.2275e-16 302 63.546 8.75961e-05 -3.54016 63.546000 Cu 0.523091 0.186085 0.5 303 63.546 0.000280353 -3.54065 63.546000 Cu 0.663042 0.191173 0.5 308 63.546 0.000174732 -3.53934 63.546000 Cu 0.643589 0.226159 0.5 331 63.546 5.22658e-05 -3.53954 63.546000 Cu 0.723449 0.211168 1 333 63.546 4.08556e-05 -3.5393 63.546000 Cu 0.863597 0.216143 1.22151e-16 236 63.546 0.000145037 -3.54004 63.546000 Cu 0.883031 0.181137 2.17956e-16 237 63.546 0.0002087 -3.54008 63.546000 Cu 0.943357 0.201123 0.5 240 63.546 0.000117254 -3.54045 63.546000 Cu 0.803281 0.196183 0.5 334 63.546 0.000149282 -3.53933 63.546000 Cu 0.783706 0.231148 0.5 335 63.546 0.000101359 -3.53953 63.546000 Cu 0.0637217 0.241174 0.5 268 63.546 0.000241791 -3.5401 63.546000 Cu 0.0445676 0.276175 0.5 291 63.546 0.000107731 -3.54014 63.546000 Cu 0.124228 0.261111 1 293 63.546 0.00016902 -3.53949 63.546000 Cu 0.203941 0.246117 0.5 295 63.546 0.000177877 -3.539 63.546000 Cu 0.184847 0.281055 0.5 296 63.546 0.000543864 -3.53919 63.546000 Cu 0.423753 0.236188 1 298 63.546 6.37521e-05 -3.54052 63.546000 Cu 0.264438 0.266111 0 294 63.546 0.000285759 -3.53947 63.546000 Cu 0.344007 0.251181 0.5 300 63.546 0.000220684 -3.54009 63.546000 Cu 0.325034 0.28621 0.5 323 63.546 0.000172627 -3.54011 63.546000 Cu 0.404465 0.271249 1.20714e-16 325 63.546 0.000334053 -3.54053 63.546000 Cu 0.483969 0.256222 0.5 327 63.546 0.000461218 -3.5405 63.546000 Cu 0.464966 0.291285 0.5 328 63.546 0.000749791 -3.54094 63.546000 Cu 0.544568 0.276175 9.98764e-17 326 63.546 0.000107731 -3.54014 63.546000 Cu 0.563722 0.241174 1.21432e-16 329 63.546 0.000241791 -3.5401 63.546000 Cu 0.703941 0.246117 8.33501e-17 330 63.546 0.000177877 -3.539 63.546000 Cu 0.624228 0.261111 0.5 332 63.546 0.00016902 -3.53949 63.546000 Cu 0.684847 0.281055 1.21073e-16 357 63.546 0.000543864 -3.53919 63.546000 Cu 0.923753 0.236188 0.5 263 63.546 6.37521e-05 -3.54052 63.546000 Cu 0.764438 0.266111 0.5 359 63.546 0.000285759 -3.53947 63.546000 Cu 0.844007 0.251181 2.75439e-18 261 63.546 0.000220684 -3.54009 63.546000 Cu 0.983969 0.256222 6.25126e-17 262 63.546 0.000461218 -3.5405 63.546000 Cu 0.904465 0.271249 0.5 264 63.546 0.000334053 -3.54053 63.546000 Cu 0.964966 0.291285 0 289 63.546 0.000749791 -3.54094 63.546000 Cu 0.825034 0.28621 7.67635e-17 358 63.546 0.000172627 -3.54011 63.546000 Cu 0.105226 0.296057 1.49336e-16 290 63.546 0.000527768 -3.5393 63.546000 Cu 0.0255502 0.311191 0.5 292 63.546 0.00032744 -3.54052 63.546000 Cu 0.0862007 0.330978 0 317 63.546 0.00165663 -3.53898 63.546000 Cu 0.226724 0.335972 1 318 63.546 0.00328477 -3.5376 63.546000 Cu 0.165956 0.315952 0.5 319 63.546 0.0020372 -3.53826 63.546000 Cu 0.146964 0.350732 0.5 320 63.546 0.00853469 -3.5363 63.546000 Cu 0.245581 0.301083 1.21672e-16 321 63.546 0.000650803 -3.53901 63.546000 Cu 0.00632778 0.346239 0.5 315 63.546 0.00126863 -3.54038 63.546000 Cu 0.385476 0.30635 1 322 63.546 0.00133837 -3.54101 63.546000 Cu 0.306154 0.321252 0.5 324 63.546 0.000684663 -3.53994 63.546000 Cu 0.366443 0.341522 1.14966e-16 349 63.546 0.00507677 -3.54181 63.546000 Cu 0.445925 0.326416 0.5 351 63.546 0.00281251 -3.54154 63.546000 Cu 0.506328 0.346239 1.17361e-17 350 63.546 0.00126863 -3.54038 63.546000 Cu 0.52555 0.311191 8.89786e-17 353 63.546 0.00032744 -3.54052 63.546000 Cu 0.665956 0.315952 9.10145e-17 354 63.546 0.0020372 -3.53826 63.546000 Cu 0.605226 0.296057 0.5 355 63.546 0.000527768 -3.5393 63.546000 Cu 0.586201 0.330978 0.5 356 63.546 0.00165663 -3.53898 63.546000 Cu 0.745581 0.301083 0.5 360 63.546 0.000650803 -3.53901 63.546000 Cu 0.646964 0.350732 0 379 63.546 0.00853469 -3.5363 63.546000 Cu 0.726724 0.335972 0.5 381 63.546 0.00328477 -3.5376 63.546000 Cu 0.945925 0.326416 3.15557e-16 286 63.546 0.00281251 -3.54154 63.546000 Cu 0.885476 0.30635 0.5 287 63.546 0.00133837 -3.54101 63.546000 Cu 0.866443 0.341522 0.5 288 63.546 0.00507677 -3.54181 63.546000 Cu 0.806154 0.321252 0 383 63.546 0.000684663 -3.53994 63.546000 Cu 0.0669031 0.36582 3.54956e-16 314 63.546 0.00472721 -3.53804 63.546000 Cu 0.0473554 0.400581 1.97118e-16 341 63.546 0.0118319 -3.53631 63.546000 Cu 0.188951 0.405195 1.81909e-16 342 63.546 0.0802184 -3.51996 63.546000 Cu 0.12781 0.385308 0.5 343 63.546 0.0324725 -3.53197 63.546000 Cu 0.207755 0.37074 6.11953e-17 345 63.546 0.0143558 -3.53346 63.546000 Cu 0.268093 0.391469 0.5 348 63.546 0.013405 -3.5383 63.546000 Cu 0.347032 0.376815 0 346 63.546 0.0177498 -3.54286 63.546000 Cu 0.287104 0.356329 0.5 347 63.546 0.0026102 -3.53995 63.546000 Cu 0.426587 0.361614 0.5 352 63.546 0.00850002 -3.54225 63.546000 Cu 0.406831 0.397007 0.5 373 63.546 0.0281945 -3.54299 63.546000 Cu 0.486748 0.381316 1 375 63.546 0.0046085 -3.5407 63.546000 Cu 0.62781 0.385308 1.36761e-16 376 63.546 0.0324725 -3.53197 63.546000 Cu 0.566903 0.36582 0.5 377 63.546 0.00472721 -3.53804 63.546000 Cu 0.547355 0.400581 0.5 378 63.546 0.0118319 -3.53631 63.546000 Cu 0.707755 0.37074 0.5 382 63.546 0.0143558 -3.53346 63.546000 Cu 0.688951 0.405195 0.5 395 63.546 0.0802184 -3.51996 63.546000 Cu 0.768093 0.391469 1.20714e-16 397 63.546 0.013405 -3.5383 63.546000 Cu 0.906831 0.397007 2.93402e-17 311 63.546 0.0281945 -3.54299 63.546000 Cu 0.847032 0.376815 0.5 312 63.546 0.0177498 -3.54286 63.546000 Cu 0.926587 0.361614 2.33284e-16 313 63.546 0.00850002 -3.54225 63.546000 Cu 0.986748 0.381316 0.5 316 63.546 0.0046085 -3.5407 63.546000 Cu 0.787104 0.356329 0 380 63.546 0.0026102 -3.53995 63.546000 Cu 0.027416 0.435236 0 338 63.546 0.024697 -3.53106 63.546000 Cu 0.108642 0.419541 0.5 344 63.546 0.121496 -3.5235 63.546000 Cu 0.0886664 0.453326 0.5 365 63.546 0.463434 -3.49572 63.546000 Cu 0.17048 0.438986 3.02982e-17 367 63.546 0.51357 -3.47037 63.546000 Cu 0.249448 0.4269 0.5 369 63.546 0.0871692 -3.52518 63.546000 Cu 0.23182 0.463303 0.5 370 63.546 5.449 -3.43272 63.546000 Cu 0.00877198 0.469963 8.87391e-17 363 63.546 0.189026 -3.53107 63.546000 Cu 0.327411 0.412395 1 371 63.546 0.0651608 -3.54321 63.546000 Cu 0.307279 0.448637 0 368 63.546 0.293363 -3.52181 63.546000 Cu 0.466812 0.416504 1.24067e-16 372 63.546 0.0159133 -3.53898 63.546000 Cu 0.386745 0.432781 0.5 374 63.546 0.0883752 -3.53654 63.546000 Cu 0.367296 0.469275 0.5 387 63.546 0.399997 -3.50521 63.546000 Cu 0.44658 0.451849 1 389 63.546 0.060076 -3.52702 63.546000 Cu 0.508772 0.469963 0.5 392 63.546 0.189026 -3.53107 63.546000 Cu 0.73182 0.463303 3.88009e-17 16 63.546 5.449 -3.43272 63.546000 Cu 0.588666 0.453326 0 390 63.546 0.463434 -3.49572 63.546000 Cu 0.527416 0.435236 0.5 391 63.546 0.024697 -3.53106 63.546000 Cu 0.608642 0.419541 1 393 63.546 0.121496 -3.5235 63.546000 Cu 0.749448 0.4269 0 394 63.546 0.0871692 -3.52518 63.546000 Cu 0.67048 0.438986 0.5 396 63.546 0.51357 -3.47037 63.546000 Cu 0.827411 0.412395 0.5 398 63.546 0.0651608 -3.54321 63.546000 Cu 0.807279 0.448637 0.5 5 63.546 0.293363 -3.52181 63.546000 Cu 0.867296 0.469275 0 336 63.546 0.399997 -3.50521 63.546000 Cu 0.886745 0.432781 1.04786e-16 337 63.546 0.0883752 -3.53654 63.546000 Cu 0.966812 0.416504 0.5 339 63.546 0.0159133 -3.53898 63.546000 Cu 0.94658 0.451849 0.5 340 63.546 0.060076 -3.52702 63.546000 Cu 0.00975508 0.504776 1 1 63.546 0.181628 -3.52944 63.546000 Cu 0.0904131 0.521353 0.5 2 63.546 0.435098 -3.49478 63.546000 Cu 0.150992 0.503245 4.83814e-17 32 63.546 7.31792 -3.26701 63.546000 Cu 0.149775 0.471374 1 364 63.546 7.31818 -3.25958 63.546000 Cu 0.0778513 0.487364 0.5 366 63.546 3.30063 -3.4751 63.546000 Cu 0.233044 0.51158 0.5 384 63.546 5.4758 -3.43617 63.546000 Cu 0.448409 0.522898 5.79619e-17 14 63.546 0.0588026 -3.52513 63.546000 Cu 0.285802 0.48739 1 385 63.546 4.58768 -3.53555 63.546000 Cu 0.434194 0.48738 0 386 63.546 0.345905 -3.53092 63.546000 Cu 0.368293 0.505522 0.5 388 63.546 0.397261 -3.50372 63.546000 Cu 0.3093 0.526149 5.26926e-18 35 63.546 0.284674 -3.5221 63.546000 Cu 0.650992 0.503245 0.5 4 63.546 7.31792 -3.26701 63.546000 Cu 0.509755 0.504776 0.5 15 63.546 0.181628 -3.52944 63.546000 Cu 0.590413 0.521353 1 17 63.546 0.435098 -3.49478 63.546000 Cu 0.649775 0.471374 0.5 34 63.546 7.31818 -3.25958 63.546000 Cu 0.733044 0.51158 1 195 63.546 5.4758 -3.43617 63.546000 Cu 0.577851 0.487364 1 202 63.546 3.30063 -3.4751 63.546000 Cu 0.785802 0.48739 0.5 3 63.546 4.58768 -3.53555 63.546000 Cu 0.948409 0.522898 0.5 7 63.546 0.0588026 -3.52513 63.546000 Cu 0.868293 0.505522 3.59268e-19 361 63.546 0.397261 -3.50372 63.546000 Cu 0.934194 0.48738 0.5 362 63.546 0.345905 -3.53092 63.546000 Cu 0.8093 0.526149 0.5 8 63.546 0.284674 -3.5221 63.546000 Cu 0.029908 0.53946 1 9 63.546 0.0247828 -3.52957 63.546000 Cu 0.0516824 0.574094 8.79008e-17 10 63.546 0.0115291 -3.53514 63.546000 Cu 0.111852 0.555112 0.5 11 63.546 0.1138 -3.52335 63.546000 Cu 0.172814 0.535677 1.27301e-16 33 63.546 0.478337 -3.47572 63.546000 Cu 0.192992 0.569439 1 58 63.546 0.0729095 -3.52235 63.546000 Cu 0.331115 0.562319 0 36 63.546 0.0627054 -3.54379 63.546000 Cu 0.389408 0.541983 0.5 37 63.546 0.0835603 -3.53572 63.546000 Cu 0.252199 0.547839 0.5 38 63.546 0.0777511 -3.528 63.546000 Cu 0.470305 0.558215 6.0357e-17 39 63.546 0.0144502 -3.53725 63.546000 Cu 0.411361 0.577693 0.5 42 63.546 0.0274176 -3.5421 63.546000 Cu 0.272874 0.583218 0.5 60 63.546 0.0121428 -3.53988 63.546000 Cu 0.611852 0.555112 1 18 63.546 0.1138 -3.52335 63.546000 Cu 0.672814 0.535677 0.5 19 63.546 0.478337 -3.47572 63.546000 Cu 0.529908 0.53946 0.5 20 63.546 0.0247828 -3.52957 63.546000 Cu 0.692992 0.569439 0.5 24 63.546 0.0729095 -3.52235 63.546000 Cu 0.551682 0.574094 0.5 41 63.546 0.0115291 -3.53514 63.546000 Cu 0.889408 0.541983 7.36499e-17 6 63.546 0.0835603 -3.53572 63.546000 Cu 0.970305 0.558215 0.5 12 63.546 0.0144502 -3.53725 63.546000 Cu 0.752199 0.547839 1 21 63.546 0.0777511 -3.528 63.546000 Cu 0.772874 0.583218 1.22391e-16 22 63.546 0.0121428 -3.53988 63.546000 Cu 0.831115 0.562319 0.5 23 63.546 0.0627054 -3.54379 63.546000 Cu 0.911361 0.577693 0 25 63.546 0.0274176 -3.5421 63.546000 Cu 0.132918 0.589329 0.5 13 63.546 0.0305648 -3.53222 63.546000 Cu 0.0731631 0.608811 1.90172e-16 29 63.546 0.00446374 -3.53739 63.546000 Cu 0.0943321 0.643615 1 30 63.546 0.00141052 -3.53851 63.546000 Cu 0.0136491 0.628387 0.5 31 63.546 0.00149541 -3.54014 63.546000 Cu 0.213722 0.60389 2.53882e-17 59 63.546 0.0128818 -3.53456 63.546000 Cu 0.154069 0.623882 0.5 82 63.546 0.00822868 -3.53644 63.546000 Cu 0.234603 0.638615 0 83 63.546 0.00265392 -3.53799 63.546000 Cu 0.352718 0.597877 3.59268e-19 61 63.546 0.0154544 -3.54289 63.546000 Cu 0.374036 0.633135 5.92792e-17 62 63.546 0.00392717 -3.54188 63.546000 Cu 0.433063 0.613038 0.5 63 63.546 0.0083546 -3.54183 63.546000 Cu 0.293923 0.618315 0.5 64 63.546 0.00265576 -3.54024 63.546000 Cu 0.492133 0.593341 1 40 63.546 0.00475763 -3.5394 63.546000 Cu 0.632918 0.589329 1.19756e-18 43 63.546 0.0305648 -3.53222 63.546000 Cu 0.654069 0.623882 1 44 63.546 0.00822868 -3.53644 63.546000 Cu 0.713722 0.60389 0.5 45 63.546 0.0128818 -3.53456 63.546000 Cu 0.573163 0.608811 0.5 46 63.546 0.00446374 -3.53739 63.546000 Cu 0.513649 0.628387 6.38299e-17 65 63.546 0.00149541 -3.54014 63.546000 Cu 0.594332 0.643615 0.5 67 63.546 0.00141052 -3.53851 63.546000 Cu 0.734603 0.638615 0.5 50 63.546 0.00265392 -3.53799 63.546000 Cu 0.992133 0.593341 0.5 27 63.546 0.00475763 -3.5394 63.546000 Cu 0.933063 0.613038 0 26 63.546 0.0083546 -3.54183 63.546000 Cu 0.852718 0.597877 0.5 28 63.546 0.0154544 -3.54289 63.546000 Cu 0.793923 0.618315 1 47 63.546 0.00265576 -3.54024 63.546000 Cu 0.874036 0.633135 0.5 49 63.546 0.00392717 -3.54188 63.546000 Cu 0.0347332 0.663374 0.5 53 63.546 0.000533644 -3.53995 63.546000 Cu 0.11513 0.678484 8.89786e-17 55 63.546 0.000341156 -3.53897 63.546000 Cu 0.0554966 0.698362 0.5 57 63.546 0.000219377 -3.54009 63.546000 Cu 0.174845 0.658627 0.5 86 63.546 0.00202135 -3.5382 63.546000 Cu 0.195565 0.693474 0.5 108 63.546 0.000393053 -3.53898 63.546000 Cu 0.45429 0.648225 0.5 68 63.546 0.00206402 -3.54144 63.546000 Cu 0.255258 0.673486 2.08615e-16 84 63.546 0.000588183 -3.53915 63.546000 Cu 0.314755 0.653353 0.5 85 63.546 0.000597781 -3.54031 63.546000 Cu 0.394941 0.668268 3.18551e-17 87 63.546 0.000784766 -3.54117 63.546000 Cu 0.41569 0.70335 5.5926e-17 88 63.546 4.52441e-05 -3.54063 63.546000 Cu 0.475214 0.683312 0.5 89 63.546 0.000402326 -3.54087 63.546000 Cu 0.335525 0.688358 0.5 90 63.546 0.000274835 -3.54028 63.546000 Cu 0.534733 0.663374 1 66 63.546 0.000533644 -3.53995 63.546000 Cu 0.674845 0.658627 2.39512e-19 69 63.546 0.00202135 -3.5382 63.546000 Cu 0.695565 0.693474 1 70 63.546 0.000393053 -3.53898 63.546000 Cu 0.61513 0.678484 0.5 72 63.546 0.000341156 -3.53897 63.546000 Cu 0.555497 0.698362 0 91 63.546 0.000219377 -3.54009 63.546000 Cu 0.814755 0.653353 9.58047e-19 48 63.546 0.000597781 -3.54031 63.546000 Cu 0.95429 0.648225 4.52677e-17 51 63.546 0.00206402 -3.54144 63.546000 Cu 0.975214 0.683312 1 52 63.546 0.000402326 -3.54087 63.546000 Cu 0.894941 0.668268 0.5 54 63.546 0.000784766 -3.54117 63.546000 Cu 0.755258 0.673486 0.5 71 63.546 0.000588183 -3.53915 63.546000 Cu 0.835525 0.688358 1 73 63.546 0.000274835 -3.54028 63.546000 Cu 0.91569 0.70335 0.5 75 63.546 4.52441e-05 -3.54063 63.546000 Cu 0.135802 0.713398 1.76041e-17 56 63.546 9.70736e-05 -3.53948 63.546000 Cu 0.0163885 0.753401 1 78 63.546 0.000109404 -3.54082 63.546000 Cu 0.0760776 0.733359 0.5 79 63.546 0.000133487 -3.5402 63.546000 Cu 0.216099 0.728365 0.5 112 63.546 3.45313e-05 -3.53907 63.546000 Cu 0.156253 0.748335 4.6106e-17 132 63.546 0.000143263 -3.53935 63.546000 Cu 0.236385 0.763272 0.5 134 63.546 0.000321993 -3.53877 63.546000 Cu 0.275864 0.708406 1 109 63.546 0.000154521 -3.53949 63.546000 Cu 0.296293 0.743341 3.71004e-16 110 63.546 6.8014e-05 -3.53948 63.546000 Cu 0.356129 0.723374 0.5 111 63.546 0.000162594 -3.54018 63.546000 Cu 0.43631 0.738387 2.42745e-16 113 63.546 0.00015844 -3.54063 63.546000 Cu 0.37646 0.758375 0.5 116 63.546 0.000144754 -3.54036 63.546000 Cu 0.495884 0.718353 0.5 94 63.546 6.17911e-05 -3.54038 63.546000 Cu 0.576078 0.733359 0 92 63.546 0.000133487 -3.5402 63.546000 Cu 0.635802 0.713398 0.5 93 63.546 9.70736e-05 -3.53948 63.546000 Cu 0.716099 0.728365 1 95 63.546 3.45313e-05 -3.53907 63.546000 Cu 0.656253 0.748335 0.5 98 63.546 0.000143263 -3.53935 63.546000 Cu 0.516388 0.753401 0.5 115 63.546 0.000109404 -3.54082 63.546000 Cu 0.736385 0.763272 1.06223e-16 96 63.546 0.000321993 -3.53877 63.546000 Cu 0.995884 0.718353 2.43224e-16 77 63.546 6.17911e-05 -3.54038 63.546000 Cu 0.856129 0.723374 2.7496e-16 74 63.546 0.000162594 -3.54018 63.546000 Cu 0.775864 0.708406 0.5 76 63.546 0.000154521 -3.53949 63.546000 Cu 0.93631 0.738387 0.5 80 63.546 0.00015844 -3.54063 63.546000 Cu 0.796293 0.743341 0.5 97 63.546 6.8014e-05 -3.53948 63.546000 Cu 0.87646 0.758375 7.35301e-17 99 63.546 0.000144754 -3.54036 63.546000 Cu 0.0963884 0.768374 0.5 81 63.546 0.00021972 -3.54011 63.546000 Cu 0.0365918 0.788493 0 103 63.546 0.000902014 -3.54102 63.546000 Cu 0.116375 0.803398 0.5 105 63.546 0.0007405 -3.54021 63.546000 Cu 0.176378 0.783253 1.20834e-16 133 63.546 0.000717667 -3.53901 63.546000 Cu 0.196341 0.818132 1.05385e-17 158 63.546 0.00344286 -3.53776 63.546000 Cu 0.456642 0.773451 2.16878e-16 114 63.546 0.00059575 -3.54095 63.546000 Cu 0.316581 0.778273 2.07776e-16 135 63.546 0.000341192 -3.53939 63.546000 Cu 0.33667 0.813177 0 136 63.546 0.00123448 -3.53879 63.546000 Cu 0.39673 0.793385 0.5 137 63.546 0.000432269 -3.54034 63.546000 Cu 0.256433 0.798146 0.5 138 63.546 0.00169874 -3.5383 63.546000 Cu 0.47676 0.808556 6.11953e-17 139 63.546 0.00219436 -3.54136 63.546000 Cu 0.596388 0.768374 1.20714e-16 117 63.546 0.00021972 -3.54011 63.546000 Cu 0.616375 0.803398 2.44302e-17 118 63.546 0.0007405 -3.54021 63.546000 Cu 0.676378 0.783253 0.5 119 63.546 0.000717667 -3.53901 63.546000 Cu 0.536592 0.788493 0.5 120 63.546 0.000902014 -3.54102 63.546000 Cu 0.696341 0.818132 0.5 124 63.546 0.00344286 -3.53776 63.546000 Cu 0.89673 0.793385 0 100 63.546 0.000432269 -3.54034 63.546000 Cu 0.956642 0.773451 0.5 101 63.546 0.00059575 -3.54095 63.546000 Cu 0.816581 0.778273 0.5 102 63.546 0.000341192 -3.53939 63.546000 Cu 0.97676 0.808556 0.5 106 63.546 0.00219436 -3.54136 63.546000 Cu 0.756433 0.798146 1 121 63.546 0.00169874 -3.5383 63.546000 Cu 0.83667 0.813177 0.5 123 63.546 0.00123448 -3.53879 63.546000 Cu 0.0568083 0.823655 1 104 63.546 0.00424228 -3.54183 63.546000 Cu 0.136693 0.838464 0.5 107 63.546 0.00217473 -3.54039 63.546000 Cu 0.0774732 0.858966 0 129 63.546 0.0158579 -3.54299 63.546000 Cu 0.0184965 0.879179 0.5 131 63.546 0.0267683 -3.54205 63.546000 Cu 0.216624 0.852922 6.10755e-18 159 63.546 0.0138987 -3.53475 63.546000 Cu 0.157091 0.873632 0.5 180 63.546 0.0118946 -3.53931 63.546000 Cu 0.417083 0.828427 0.5 142 63.546 0.0015256 -3.54043 63.546000 Cu 0.276622 0.832915 0.5 160 63.546 0.0081855 -3.53642 63.546000 Cu 0.357239 0.84804 0 161 63.546 0.00380134 -3.53771 63.546000 Cu 0.437912 0.863527 0.5 163 63.546 0.00494578 -3.53984 63.546000 Cu 0.29711 0.867525 0.5 164 63.546 0.0308713 -3.53241 63.546000 Cu 0.4974 0.843782 0 140 63.546 0.00819709 -3.54217 63.546000 Cu 0.556808 0.823655 0.5 141 63.546 0.00424228 -3.54183 63.546000 Cu 0.636693 0.838464 0 143 63.546 0.00217473 -3.54039 63.546000 Cu 0.657091 0.873632 2.82025e-16 144 63.546 0.0118946 -3.53931 63.546000 Cu 0.716624 0.852922 0.5 145 63.546 0.0138987 -3.53475 63.546000 Cu 0.577473 0.858966 0.5 146 63.546 0.0158579 -3.54299 63.546000 Cu 0.518496 0.879179 1 165 63.546 0.0267683 -3.54205 63.546000 Cu 0.9974 0.843782 0.5 127 63.546 0.00819709 -3.54217 63.546000 Cu 0.776622 0.832915 1 122 63.546 0.0081855 -3.53642 63.546000 Cu 0.917083 0.828427 7.04165e-17 125 63.546 0.0015256 -3.54043 63.546000 Cu 0.937912 0.863527 0 126 63.546 0.00494578 -3.53984 63.546000 Cu 0.857239 0.84804 0.5 128 63.546 0.00380134 -3.53771 63.546000 Cu 0.79711 0.867525 2.62265e-17 147 63.546 0.0308713 -3.53241 63.546000 Cu 0.098673 0.894546 0 130 63.546 0.0601344 -3.54278 63.546000 Cu 0.0402521 0.914931 0.5 153 63.546 0.0829179 -3.53514 63.546000 Cu 0.120256 0.930794 2.42745e-16 155 63.546 0.281666 -3.52099 63.546000 Cu 0.177422 0.909065 0.5 184 63.546 0.0784824 -3.5275 63.546000 Cu 0.236836 0.887425 1.05026e-16 181 63.546 0.0752338 -3.52299 63.546000 Cu 0.378181 0.882808 2.27177e-16 162 63.546 0.0106708 -3.53528 63.546000 Cu 0.459453 0.898712 0.5 168 63.546 0.015377 -3.53732 63.546000 Cu 0.25681 0.921283 4.37109e-17 182 63.546 0.480614 -3.47486 63.546000 Cu 0.317891 0.901811 0.5 183 63.546 0.112551 -3.52397 63.546000 Cu 0.399733 0.917488 1 185 63.546 0.0249863 -3.5298 63.546000 Cu 0.481114 0.934075 0.5 187 63.546 0.065173 -3.52589 63.546000 Cu 0.339071 0.935603 0.5 188 63.546 0.453075 -3.49532 63.546000 Cu 0.540252 0.914931 1 166 63.546 0.0829179 -3.53514 63.546000 Cu 0.598673 0.894546 0.5 167 63.546 0.0601344 -3.54278 63.546000 Cu 0.677422 0.909065 0 169 63.546 0.0784824 -3.5275 63.546000 Cu 0.620256 0.930794 0.5 172 63.546 0.281666 -3.52099 63.546000 Cu 0.736836 0.887425 0.5 150 63.546 0.0752338 -3.52299 63.546000 Cu 0.817891 0.901811 0 148 63.546 0.112551 -3.52397 63.546000 Cu 0.878181 0.882808 0.5 149 63.546 0.0106708 -3.53528 63.546000 Cu 0.959453 0.898712 0 151 63.546 0.015377 -3.53732 63.546000 Cu 0.981114 0.934075 1.21313e-16 152 63.546 0.065173 -3.52589 63.546000 Cu 0.899733 0.917488 0.5 154 63.546 0.0249863 -3.5298 63.546000 Cu 0.75681 0.921283 0.5 171 63.546 0.480614 -3.47486 63.546000 Cu 0.839071 0.935603 0 173 63.546 0.453075 -3.49532 63.546000 Cu 0.142793 0.969678 0 156 63.546 4.62477 -3.53163 63.546000 Cu 0.0608155 0.951492 0.5 157 63.546 0.404646 -3.50319 63.546000 Cu 0.0607055 0.987804 0.5 178 63.546 0.408135 -3.50344 63.546000 Cu 0.196187 0.945475 0.5 196 63.546 5.48338 -3.43337 63.546000 Cu 0.195986 0.993951 0.5 200 63.546 5.52164 -3.4328 63.546000 Cu 0.41942 0.952243 1 186 63.546 0.194285 -3.53054 63.546000 Cu 0.278284 0.95369 2.71966e-16 197 63.546 7.35403 -3.26448 63.546000 Cu 0.277989 0.985625 1 198 63.546 7.31634 -3.26715 63.546000 Cu 0.350698 0.969671 0.5 199 63.546 3.34728 -3.47596 63.546000 Cu 0.419207 0.987087 0 201 63.546 0.181259 -3.53006 63.546000 Cu 0.494386 0.969653 0.5 192 63.546 0.348876 -3.5302 63.546000 Cu 0.696187 0.945475 1.76041e-16 170 63.546 5.48338 -3.43337 63.546000 Cu 0.560816 0.951492 1 189 63.546 0.404646 -3.50319 63.546000 Cu 0.560706 0.987804 1.19756e-19 190 63.546 0.408135 -3.50344 63.546000 Cu 0.642793 0.969678 0.5 191 63.546 4.62477 -3.53163 63.546000 Cu 0.695986 0.993951 1.50294e-16 193 63.546 5.52164 -3.4328 63.546000 Cu 0.994386 0.969653 2.98192e-17 177 63.546 0.348876 -3.5302 63.546000 Cu 0.850698 0.969671 2.04783e-16 174 63.546 3.34728 -3.47596 63.546000 Cu 0.91942 0.952243 0.5 175 63.546 0.194285 -3.53054 63.546000 Cu 0.778284 0.95369 0.5 176 63.546 7.35403 -3.26448 63.546000 Cu 0.919207 0.987087 0.5 179 63.546 0.181259 -3.53006 63.546000 Cu 0.777989 0.985625 0.5 194 63.546 7.31634 -3.26715