Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.3851 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) = 3.61261 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 0.151828 0.00459245 3.60139e-19 214 63.546 2.12276 -3.52242 63.546000 Cu 0.0511604 0.00467412 0.5 215 63.546 8.14414 -3.47082 63.546000 Cu 0.0805598 0.0357783 4.20162e-19 222 63.546 0.745782 -3.4265 63.546000 Cu 0.167077 0.0307013 0.5 224 63.546 0.503815 -3.47374 63.546000 Cu 0.348855 0.00457132 1 216 63.546 6.80225 -3.23621 63.546000 Cu 0.252834 0.00456709 0.5 217 63.546 1.09118 -3.51132 63.546000 Cu 0.26178 0.0288939 7.20278e-19 226 63.546 0.595822 -3.50398 63.546000 Cu 0.383113 0.0479585 7.80302e-19 227 63.546 0.0688069 -3.52616 63.546000 Cu 0.36779 0.0253567 0.5 228 63.546 3.74001 -3.44754 63.546000 Cu 0.284183 0.0522693 0.5 229 63.546 0.11981 -3.54238 63.546000 Cu 0.465946 0.0205097 1.91654e-16 230 63.546 9.22787 -3.29327 63.546000 Cu 0.485756 0.0425416 0.5 233 63.546 0.685794 -3.46189 63.546000 Cu 0.58056 0.0357783 7.40086e-17 231 63.546 0.745782 -3.4265 63.546000 Cu 0.55116 0.00467412 0.5 232 63.546 8.14414 -3.47082 63.546000 Cu 0.651828 0.00459245 3.00116e-19 234 63.546 2.12276 -3.52242 63.546000 Cu 0.667077 0.0307013 0.5 237 63.546 0.503815 -3.47374 63.546000 Cu 0.848855 0.00457132 1 211 63.546 6.80225 -3.23621 63.546000 Cu 0.965946 0.0205097 1 212 63.546 9.22787 -3.29327 63.546000 Cu 0.86779 0.0253567 0.5 213 63.546 3.74001 -3.44754 63.546000 Cu 0.883113 0.0479585 1 218 63.546 0.0688069 -3.52616 63.546000 Cu 0.985756 0.0425416 0.5 220 63.546 0.685794 -3.46189 63.546000 Cu 0.76178 0.0288939 1 235 63.546 0.595822 -3.50398 63.546000 Cu 0.752834 0.00456709 0.5 236 63.546 1.09118 -3.51132 63.546000 Cu 0.784183 0.0522693 0.5 257 63.546 0.11981 -3.54238 63.546000 Cu 0.00172457 0.066023 3.60139e-19 219 63.546 0.0488649 -3.54419 63.546000 Cu 0.189516 0.0569919 1 223 63.546 0.0973775 -3.50745 63.546000 Cu 0.097604 0.0613069 0.5 225 63.546 0.0699896 -3.51701 63.546000 Cu 0.0193796 0.0903088 0.5 241 63.546 0.00548996 -3.54273 63.546000 Cu 0.114964 0.0859164 7.29882e-17 243 63.546 0.0109791 -3.53425 63.546000 Cu 0.23064 0.105251 4.85588e-17 244 63.546 0.00167337 -3.53817 63.546000 Cu 0.210607 0.0812869 0.5 245 63.546 0.0167625 -3.53184 63.546000 Cu 0.134257 0.110044 0.5 246 63.546 0.00295365 -3.53835 63.546000 Cu 0.306244 0.0762879 9.98786e-17 247 63.546 0.00784628 -3.53832 63.546000 Cu 0.423393 0.0950935 1 248 63.546 0.00840114 -3.54391 63.546000 Cu 0.403728 0.0710914 0.5 249 63.546 0.0268899 -3.54714 63.546000 Cu 0.327143 0.100204 0.5 250 63.546 0.0022416 -3.54036 63.546000 Cu 0.501725 0.066023 4.80186e-19 251 63.546 0.0488649 -3.54419 63.546000 Cu 0.614964 0.0859164 1 252 63.546 0.0109791 -3.53425 63.546000 Cu 0.597604 0.0613069 0.5 253 63.546 0.0699896 -3.51701 63.546000 Cu 0.51938 0.0903088 0.5 254 63.546 0.00548996 -3.54273 63.546000 Cu 0.689516 0.0569919 1 255 63.546 0.0973775 -3.50745 63.546000 Cu 0.710607 0.0812869 0.5 258 63.546 0.0167625 -3.53184 63.546000 Cu 0.634257 0.110044 0.5 275 63.546 0.00295365 -3.53835 63.546000 Cu 0.73064 0.105251 5.10197e-18 277 63.546 0.00167337 -3.53817 63.546000 Cu 0.903728 0.0710914 0.5 221 63.546 0.0268899 -3.54714 63.546000 Cu 0.923393 0.0950935 0 239 63.546 0.00840114 -3.54391 63.546000 Cu 0.806244 0.0762879 9.00348e-19 256 63.546 0.00784628 -3.53832 63.546000 Cu 0.827143 0.100204 0.5 278 63.546 0.0022416 -3.54036 63.546000 Cu 0.0383183 0.114691 1.5642e-16 240 63.546 0.00148338 -3.53888 63.546000 Cu 0.0776917 0.163043 1 262 63.546 8.93045e-05 -3.53962 63.546000 Cu 0.0579754 0.138905 0.5 263 63.546 0.00052131 -3.53886 63.546000 Cu 0.154087 0.134095 1.62063e-18 265 63.546 0.00035438 -3.53976 63.546000 Cu 0.17379 0.158201 0.5 268 63.546 4.88695e-05 -3.54029 63.546000 Cu 0.269974 0.153332 6.77062e-17 266 63.546 0.000118737 -3.5408 63.546000 Cu 0.250461 0.129224 0.5 267 63.546 0.00044635 -3.5408 63.546000 Cu 0.346783 0.124289 4.24964e-17 269 63.546 0.00132055 -3.54108 63.546000 Cu 0.46209 0.143672 1.40994e-16 270 63.546 0.000209185 -3.53923 63.546000 Cu 0.442691 0.11939 0.5 271 63.546 0.00110907 -3.54041 63.546000 Cu 0.366114 0.148472 0.5 272 63.546 0.000194383 -3.54037 63.546000 Cu 0.538318 0.114691 7.15477e-17 273 63.546 0.00148338 -3.53888 63.546000 Cu 0.654087 0.134095 8.0131e-17 274 63.546 0.00035438 -3.53976 63.546000 Cu 0.557975 0.138905 0.5 276 63.546 0.00052131 -3.53886 63.546000 Cu 0.577692 0.163043 1 294 63.546 8.93045e-05 -3.53962 63.546000 Cu 0.67379 0.158201 0.5 296 63.546 4.88695e-05 -3.54029 63.546000 Cu 0.846783 0.124289 1 238 63.546 0.00132055 -3.54108 63.546000 Cu 0.942691 0.11939 0.5 242 63.546 0.00110907 -3.54041 63.546000 Cu 0.866114 0.148472 0.5 260 63.546 0.000194383 -3.54037 63.546000 Cu 0.96209 0.143672 9.72376e-18 261 63.546 0.000209185 -3.53923 63.546000 Cu 0.750461 0.129224 0.5 279 63.546 0.00044635 -3.5408 63.546000 Cu 0.769974 0.153332 1 298 63.546 0.000118737 -3.5408 63.546000 Cu 0.00107506 0.192006 4.49574e-17 282 63.546 2.22829e-05 -3.53998 63.546000 Cu 0.116644 0.211321 7.46689e-17 283 63.546 5.21016e-05 -3.53997 63.546000 Cu 0.0972067 0.187185 0.5 284 63.546 2.68503e-05 -3.54011 63.546000 Cu 0.0204863 0.216154 0.5 285 63.546 3.9626e-05 -3.53998 63.546000 Cu 0.193354 0.182339 8.17516e-17 286 63.546 2.6741e-05 -3.54019 63.546000 Cu 0.212795 0.206482 0.5 289 63.546 8.01515e-05 -3.53995 63.546000 Cu 0.30888 0.201648 1.33912e-16 287 63.546 4.34363e-05 -3.53993 63.546000 Cu 0.289449 0.177484 0.5 288 63.546 3.09758e-05 -3.54017 63.546000 Cu 0.385511 0.172648 1.0312e-16 290 63.546 3.14596e-05 -3.53984 63.546000 Cu 0.481574 0.167851 0.5 292 63.546 4.84959e-05 -3.5395 63.546000 Cu 0.404962 0.19682 0.5 293 63.546 2.08601e-05 -3.53994 63.546000 Cu 0.424337 0.220974 1 312 63.546 3.28369e-05 -3.53999 63.546000 Cu 0.501075 0.192006 1.09302e-16 291 63.546 2.22829e-05 -3.53998 63.546000 Cu 0.693354 0.182339 8.58332e-17 295 63.546 2.6741e-05 -3.54019 63.546000 Cu 0.597207 0.187185 0.5 297 63.546 2.68503e-05 -3.54011 63.546000 Cu 0.520486 0.216154 0.5 314 63.546 3.9626e-05 -3.53998 63.546000 Cu 0.616644 0.211321 4.24964e-17 316 63.546 5.21016e-05 -3.53997 63.546000 Cu 0.712795 0.206482 0.5 318 63.546 8.01515e-05 -3.53995 63.546000 Cu 0.885511 0.172648 1.27009e-16 259 63.546 3.14596e-05 -3.53984 63.546000 Cu 0.981574 0.167851 0.5 264 63.546 4.84959e-05 -3.5395 63.546000 Cu 0.924337 0.220974 1 280 63.546 3.28369e-05 -3.53999 63.546000 Cu 0.904962 0.19682 0.5 281 63.546 2.08601e-05 -3.53994 63.546000 Cu 0.789449 0.177484 0.5 299 63.546 3.09758e-05 -3.54017 63.546000 Cu 0.80888 0.201648 1 320 63.546 4.34363e-05 -3.53993 63.546000 Cu 0.0397656 0.240291 4.24964e-17 304 63.546 2.84108e-05 -3.53981 63.546000 Cu 0.155074 0.259588 1 305 63.546 8.06828e-06 -3.53975 63.546000 Cu 0.135888 0.235451 0.5 306 63.546 6.761e-06 -3.53969 63.546000 Cu 0.0589606 0.26441 0.5 307 63.546 1.16045e-05 -3.53965 63.546000 Cu 0.232009 0.23062 1 308 63.546 4.24086e-06 -3.53972 63.546000 Cu 0.34737 0.249929 1 309 63.546 6.94255e-06 -3.54002 63.546000 Cu 0.328173 0.225794 0.5 310 63.546 2.14258e-05 -3.53984 63.546000 Cu 0.251201 0.254752 0.5 311 63.546 1.50724e-05 -3.53998 63.546000 Cu 0.443577 0.245118 0.5 315 63.546 2.06942e-05 -3.53996 63.546000 Cu 0.366596 0.274071 0.5 332 63.546 1.34578e-05 -3.54002 63.546000 Cu 0.462765 0.269234 3.00116e-19 334 63.546 1.12938e-05 -3.53974 63.546000 Cu 0.539766 0.240291 1 313 63.546 2.84108e-05 -3.53981 63.546000 Cu 0.732009 0.23062 4.10559e-17 317 63.546 4.24086e-06 -3.53972 63.546000 Cu 0.635888 0.235451 0.5 319 63.546 6.761e-06 -3.53969 63.546000 Cu 0.558961 0.26441 0.5 336 63.546 1.16045e-05 -3.53965 63.546000 Cu 0.655074 0.259588 1 338 63.546 8.06828e-06 -3.53975 63.546000 Cu 0.84737 0.249929 3.90751e-17 300 63.546 6.94255e-06 -3.54002 63.546000 Cu 0.962765 0.269234 4.24964e-17 301 63.546 1.12938e-05 -3.53974 63.546000 Cu 0.943577 0.245118 0.5 302 63.546 2.06942e-05 -3.53996 63.546000 Cu 0.866596 0.274071 0.5 303 63.546 1.34578e-05 -3.54002 63.546000 Cu 0.828173 0.225794 0.5 321 63.546 2.14258e-05 -3.53984 63.546000 Cu 0.751201 0.254752 0.5 340 63.546 1.50724e-05 -3.53998 63.546000 Cu 0.00122772 0.317505 1 323 63.546 2.60244e-05 -3.53978 63.546000 Cu 0.0781062 0.288539 2.68904e-17 326 63.546 2.80095e-05 -3.53982 63.546000 Cu 0.193397 0.307877 2.40093e-19 327 63.546 5.4939e-05 -3.54003 63.546000 Cu 0.174288 0.283723 0.5 328 63.546 1.32827e-05 -3.53997 63.546000 Cu 0.0973234 0.312695 0.5 329 63.546 6.0521e-06 -3.53982 63.546000 Cu 0.212625 0.332031 0.5 349 63.546 6.50154e-05 -3.54013 63.546000 Cu 0.270437 0.278907 1 330 63.546 2.40956e-05 -3.5401 63.546000 Cu 0.385865 0.298192 1 331 63.546 2.63883e-05 -3.53999 63.546000 Cu 0.289609 0.30304 0.5 333 63.546 2.14868e-05 -3.54008 63.546000 Cu 0.482025 0.293356 0.5 337 63.546 4.17955e-05 -3.53981 63.546000 Cu 0.308817 0.327162 5.9423e-18 351 63.546 1.55395e-05 -3.54027 63.546000 Cu 0.405045 0.322316 0.5 353 63.546 3.53844e-05 -3.54003 63.546000 Cu 0.578106 0.288539 1 335 63.546 2.80095e-05 -3.53982 63.546000 Cu 0.674288 0.283723 0.5 341 63.546 1.32827e-05 -3.53997 63.546000 Cu 0.501228 0.317505 4.24964e-17 355 63.546 2.60244e-05 -3.53978 63.546000 Cu 0.597323 0.312695 0.5 357 63.546 6.0521e-06 -3.53982 63.546000 Cu 0.693397 0.307877 1 359 63.546 5.4939e-05 -3.54003 63.546000 Cu 0.712625 0.332031 0.5 362 63.546 6.50154e-05 -3.54013 63.546000 Cu 0.885865 0.298192 0 322 63.546 2.63883e-05 -3.53999 63.546000 Cu 0.982025 0.293356 0.5 324 63.546 4.17955e-05 -3.53981 63.546000 Cu 0.905045 0.322316 0.5 325 63.546 3.53844e-05 -3.54003 63.546000 Cu 0.770437 0.278907 2.16084e-17 339 63.546 2.40956e-05 -3.5401 63.546000 Cu 0.808817 0.327162 9.0635e-18 360 63.546 1.55395e-05 -3.54027 63.546000 Cu 0.789609 0.30304 0.5 361 63.546 2.14868e-05 -3.54008 63.546000 Cu 0.0395697 0.365825 1 344 63.546 0.000182393 -3.5393 63.546000 Cu 0.0203948 0.341646 0.5 345 63.546 4.48208e-05 -3.53938 63.546000 Cu 0.116503 0.33686 1.32051e-18 347 63.546 4.24195e-05 -3.53969 63.546000 Cu 0.231832 0.356164 1 348 63.546 0.000123556 -3.54066 63.546000 Cu 0.135607 0.361025 0.5 350 63.546 0.000229502 -3.54028 63.546000 Cu 0.154583 0.385202 1.47057e-17 369 63.546 0.0012834 -3.54094 63.546000 Cu 0.424262 0.346443 4.24964e-17 352 63.546 0.000109052 -3.53959 63.546000 Cu 0.328075 0.35129 0.5 354 63.546 5.03591e-05 -3.54025 63.546000 Cu 0.25097 0.38026 0.5 371 63.546 0.000419301 -3.54066 63.546000 Cu 0.347432 0.375374 1 373 63.546 0.000486059 -3.53963 63.546000 Cu 0.443593 0.370581 0.5 375 63.546 0.000547734 -3.5388 63.546000 Cu 0.616503 0.33686 4.24964e-17 356 63.546 4.24195e-05 -3.53969 63.546000 Cu 0.520395 0.341646 0.5 358 63.546 4.48208e-05 -3.53938 63.546000 Cu 0.53957 0.365825 1 377 63.546 0.000182393 -3.5393 63.546000 Cu 0.654583 0.385202 4.24964e-17 378 63.546 0.0012834 -3.54094 63.546000 Cu 0.635607 0.361025 0.5 379 63.546 0.000229502 -3.54028 63.546000 Cu 0.731832 0.356164 1 381 63.546 0.000123556 -3.54066 63.546000 Cu 0.847432 0.375374 1 342 63.546 0.000486059 -3.53963 63.546000 Cu 0.924262 0.346443 1 343 63.546 0.000109052 -3.53959 63.546000 Cu 0.943593 0.370581 0.5 346 63.546 0.000547734 -3.5388 63.546000 Cu 0.828075 0.35129 0.5 382 63.546 5.03591e-05 -3.54025 63.546000 Cu 0.75097 0.38026 0.5 383 63.546 0.000419301 -3.54066 63.546000 Cu 0.0774599 0.414397 1.0384e-17 366 63.546 0.00838096 -3.544 63.546000 Cu 0.0585329 0.390094 0.5 367 63.546 0.00106198 -3.5405 63.546000 Cu 0.173837 0.409288 0.5 372 63.546 0.00240544 -3.54037 63.546000 Cu 0.0968664 0.4384 0.5 388 63.546 0.0263202 -3.54682 63.546000 Cu 0.194432 0.433208 1 390 63.546 0.00801946 -3.53855 63.546000 Cu 0.270417 0.404229 6.24241e-18 370 63.546 0.00192566 -3.53824 63.546000 Cu 0.462817 0.394802 3.41532e-17 374 63.546 0.00127281 -3.53894 63.546000 Cu 0.366871 0.399429 0.5 376 63.546 0.0034474 -3.53841 63.546000 Cu 0.290143 0.428195 0.5 392 63.546 0.01794 -3.53191 63.546000 Cu 0.385762 0.423591 1 394 63.546 0.00997584 -3.53426 63.546000 Cu 0.481385 0.419193 0.5 396 63.546 0.00561168 -3.54274 63.546000 Cu 0.498755 0.443475 4.24964e-17 395 63.546 0.0492121 -3.54323 63.546000 Cu 0.558533 0.390094 0.5 380 63.546 0.00106198 -3.5405 63.546000 Cu 0.57746 0.414397 4.24964e-17 398 63.546 0.00838096 -3.544 63.546000 Cu 0.694432 0.433208 1 399 63.546 0.00801946 -3.53855 63.546000 Cu 0.673837 0.409288 0.5 400 63.546 0.00240544 -3.54037 63.546000 Cu 0.596866 0.4384 0.5 401 63.546 0.0263202 -3.54682 63.546000 Cu 0.998755 0.443475 1 386 63.546 0.0492121 -3.54323 63.546000 Cu 0.885762 0.423591 6.00232e-20 363 63.546 0.00997584 -3.53426 63.546000 Cu 0.866871 0.399429 0.5 364 63.546 0.0034474 -3.53841 63.546000 Cu 0.962817 0.394802 1.20046e-19 365 63.546 0.00127281 -3.53894 63.546000 Cu 0.981385 0.419193 0.5 368 63.546 0.00561168 -3.54274 63.546000 Cu 0.770417 0.404229 1 402 63.546 0.00192566 -3.53824 63.546000 Cu 0.790143 0.428195 0.5 403 63.546 0.01794 -3.53191 63.546000 Cu 0.117205 0.461534 9.87982e-17 387 63.546 0.06585 -3.52658 63.546000 Cu 0.0145793 0.466953 0.5 389 63.546 0.71713 -3.45986 63.546000 Cu 0.21623 0.457218 0.5 393 63.546 0.120589 -3.54264 63.546000 Cu 0.0341313 0.489056 1 406 63.546 9.27766 -3.29262 63.546000 Cu 0.132444 0.484134 0.5 407 63.546 3.72603 -3.44703 63.546000 Cu 0.238344 0.480614 1 408 63.546 0.590466 -3.50457 63.546000 Cu 0.310868 0.452513 1 391 63.546 0.09711 -3.50776 63.546000 Cu 0.402874 0.448216 0.5 397 63.546 0.069844 -3.51621 63.546000 Cu 0.333042 0.47883 0.5 410 63.546 0.517121 -3.47223 63.546000 Cu 0.419619 0.473747 1 411 63.546 0.789497 -3.42319 63.546000 Cu 0.632444 0.484134 0.5 10 63.546 3.72603 -3.44703 63.546000 Cu 0.71623 0.457218 0.5 12 63.546 0.120589 -3.54264 63.546000 Cu 0.738344 0.480614 1.0234e-16 203 63.546 0.590466 -3.50457 63.546000 Cu 0.617205 0.461534 1 205 63.546 0.06585 -3.52658 63.546000 Cu 0.514579 0.466953 0.5 210 63.546 0.71713 -3.45986 63.546000 Cu 0.534131 0.489056 3.52336e-17 412 63.546 9.27766 -3.29262 63.546000 Cu 0.833042 0.47883 0.5 2 63.546 0.517121 -3.47223 63.546000 Cu 0.810868 0.452513 7.20278e-18 5 63.546 0.09711 -3.50776 63.546000 Cu 0.919619 0.473747 1 384 63.546 0.789497 -3.42319 63.546000 Cu 0.902874 0.448216 0.5 385 63.546 0.069844 -3.51621 63.546000 Cu 0.0343719 0.520889 1 4 63.546 9.17409 -3.29211 63.546000 Cu 0.132475 0.525745 0.5 6 63.546 3.72175 -3.44775 63.546000 Cu 0.15107 0.504937 4.24964e-17 7 63.546 6.78975 -3.23606 63.546000 Cu 0.238337 0.529251 1 8 63.546 0.588381 -3.50473 63.546000 Cu 0.247164 0.504924 0.5 9 63.546 1.09403 -3.51164 63.546000 Cu 0.0144514 0.542919 0.5 24 63.546 0.677285 -3.46229 63.546000 Cu 0.117157 0.548343 1 26 63.546 0.0673855 -3.52581 63.546000 Cu 0.216151 0.552635 0.5 29 63.546 0.120837 -3.54229 63.546000 Cu 0.44885 0.505174 0.5 209 63.546 8.14547 -3.47059 63.546000 Cu 0.419577 0.536117 9.00348e-19 11 63.546 0.734099 -3.42885 63.546000 Cu 0.333053 0.531041 0.5 13 63.546 0.49529 -3.47478 63.546000 Cu 0.348179 0.504945 1 409 63.546 2.1301 -3.52211 63.546000 Cu 0.65107 0.504937 1.01619e-16 1 63.546 6.78975 -3.23606 63.546000 Cu 0.747164 0.504924 0.5 3 63.546 1.09403 -3.51164 63.546000 Cu 0.534372 0.520889 1 14 63.546 9.17409 -3.29211 63.546000 Cu 0.617157 0.548343 1 15 63.546 0.0673855 -3.52581 63.546000 Cu 0.632475 0.525745 0.5 16 63.546 3.72175 -3.44775 63.546000 Cu 0.514451 0.542919 0.5 17 63.546 0.677285 -3.46229 63.546000 Cu 0.738337 0.529251 4.62179e-18 18 63.546 0.588381 -3.50473 63.546000 Cu 0.716151 0.552635 0.5 21 63.546 0.120837 -3.54229 63.546000 Cu 0.94885 0.505174 0.5 405 63.546 8.14547 -3.47059 63.546000 Cu 0.833053 0.531041 0.5 20 63.546 0.49529 -3.47478 63.546000 Cu 0.919577 0.536117 1 22 63.546 0.734099 -3.42885 63.546000 Cu 0.848179 0.504945 4.24964e-17 404 63.546 2.1301 -3.52211 63.546000 Cu 0.0966519 0.571431 0.5 27 63.546 0.0272807 -3.54689 63.546000 Cu 0.194203 0.576616 7.65296e-17 28 63.546 0.00834805 -3.5383 63.546000 Cu 0.0771166 0.595404 1 46 63.546 0.008421 -3.54415 63.546000 Cu 0.173423 0.600508 0.5 49 63.546 0.00237646 -3.54048 63.546000 Cu 0.310767 0.55731 5.40209e-19 30 63.546 0.0947232 -3.50736 63.546000 Cu 0.385445 0.586227 2.13743e-16 31 63.546 0.0105587 -3.53442 63.546000 Cu 0.402677 0.561624 0.5 32 63.546 0.0707443 -3.51687 63.546000 Cu 0.289851 0.581621 0.5 33 63.546 0.0182023 -3.5318 63.546000 Cu 0.498553 0.566358 1.8007e-19 34 63.546 0.0503286 -3.54382 63.546000 Cu 0.481088 0.590621 0.5 37 63.546 0.00548983 -3.54307 63.546000 Cu 0.269984 0.605559 6.34445e-17 50 63.546 0.00212977 -3.53815 63.546000 Cu 0.366408 0.610343 0.5 52 63.546 0.00312452 -3.53828 63.546000 Cu 0.577117 0.595404 7.91706e-17 35 63.546 0.008421 -3.54415 63.546000 Cu 0.596652 0.571431 0.5 36 63.546 0.0272807 -3.54689 63.546000 Cu 0.694203 0.576616 1 38 63.546 0.00834805 -3.5383 63.546000 Cu 0.673423 0.600508 0.5 41 63.546 0.00237646 -3.54048 63.546000 Cu 0.810767 0.55731 1 19 63.546 0.0947232 -3.50736 63.546000 Cu 0.998553 0.566358 5.88227e-18 23 63.546 0.0503286 -3.54382 63.546000 Cu 0.902677 0.561624 0.5 25 63.546 0.0707443 -3.51687 63.546000 Cu 0.769984 0.605559 4.68781e-17 39 63.546 0.00212977 -3.53815 63.546000 Cu 0.789851 0.581621 0.5 40 63.546 0.0182023 -3.5318 63.546000 Cu 0.885445 0.586227 7.14276e-18 42 63.546 0.0105587 -3.53442 63.546000 Cu 0.981088 0.590621 0.5 44 63.546 0.00548983 -3.54307 63.546000 Cu 0.866408 0.610343 0.5 45 63.546 0.00312452 -3.53828 63.546000 Cu 0.058017 0.619674 0.5 47 63.546 0.00101548 -3.54038 63.546000 Cu 0.15398 0.624549 1.5396e-16 48 63.546 0.00166673 -3.54086 63.546000 Cu 0.0389617 0.643909 1.17766e-16 66 63.546 0.000167824 -3.53919 63.546000 Cu 0.134973 0.648689 0.5 68 63.546 0.000246471 -3.5402 63.546000 Cu 0.231121 0.65353 8.67335e-17 70 63.546 0.000306294 -3.5407 63.546000 Cu 0.250419 0.629483 0.5 53 63.546 0.000376698 -3.54072 63.546000 Cu 0.346901 0.634366 4.20162e-19 51 63.546 0.000554774 -3.53976 63.546000 Cu 0.462354 0.614971 1 54 63.546 0.00120366 -3.53898 63.546000 Cu 0.443025 0.639158 0.5 57 63.546 0.000598696 -3.53883 63.546000 Cu 0.327395 0.658409 0.5 72 63.546 3.86099e-05 -3.54032 63.546000 Cu 0.423644 0.663256 1.20046e-19 74 63.546 0.000179987 -3.53965 63.546000 Cu 0.538962 0.643909 1 55 63.546 0.000167824 -3.53919 63.546000 Cu 0.558017 0.619674 0.5 56 63.546 0.00101548 -3.54038 63.546000 Cu 0.65398 0.624549 4.24964e-17 58 63.546 0.00166673 -3.54086 63.546000 Cu 0.731121 0.65353 4.24964e-17 59 63.546 0.000306294 -3.5407 63.546000 Cu 0.634973 0.648689 0.5 61 63.546 0.000246471 -3.5402 63.546000 Cu 0.750419 0.629483 0.5 60 63.546 0.000376698 -3.54072 63.546000 Cu 0.962354 0.614971 4.20162e-17 43 63.546 0.00120366 -3.53898 63.546000 Cu 0.846901 0.634366 1 62 63.546 0.000554774 -3.53976 63.546000 Cu 0.923644 0.663256 4.24964e-17 63 63.546 0.000179987 -3.53965 63.546000 Cu 0.943025 0.639158 0.5 64 63.546 0.000598696 -3.53883 63.546000 Cu 0.827395 0.658409 0.5 65 63.546 3.86099e-05 -3.54032 63.546000 Cu 0.115821 0.67284 1 67 63.546 5.41049e-05 -3.53994 63.546000 Cu 0.0197826 0.668052 0.5 69 63.546 0.000157189 -3.53957 63.546000 Cu 0.211864 0.677645 0.5 73 63.546 9.76027e-05 -3.54015 63.546000 Cu 0.0769536 0.721082 2.76107e-17 87 63.546 6.2685e-05 -3.53991 63.546000 Cu 0.0964592 0.696981 0.5 88 63.546 9.60602e-05 -3.53995 63.546000 Cu 0.192509 0.701774 3.60139e-19 90 63.546 3.09563e-05 -3.53985 63.546000 Cu 0.000364204 0.692168 1.51138e-16 86 63.546 0.000127904 -3.53997 63.546000 Cu 0.307981 0.682475 1 71 63.546 8.53285e-05 -3.54015 63.546000 Cu 0.404194 0.687328 0.5 77 63.546 3.33842e-05 -3.54004 63.546000 Cu 0.288549 0.706568 0.5 92 63.546 6.49691e-05 -3.53994 63.546000 Cu 0.384642 0.711397 6.00232e-20 94 63.546 3.21572e-05 -3.54007 63.546000 Cu 0.480781 0.716247 0.5 96 63.546 8.39361e-06 -3.54009 63.546000 Cu 0.500364 0.692168 6.00232e-20 75 63.546 0.000127904 -3.53997 63.546000 Cu 0.519783 0.668052 0.5 76 63.546 0.000157189 -3.53957 63.546000 Cu 0.615821 0.67284 7.66496e-17 78 63.546 5.41049e-05 -3.53994 63.546000 Cu 0.692509 0.701774 0 79 63.546 3.09563e-05 -3.53985 63.546000 Cu 0.711864 0.677645 0.5 80 63.546 9.76027e-05 -3.54015 63.546000 Cu 0.596459 0.696981 0.5 81 63.546 9.60602e-05 -3.53995 63.546000 Cu 0.576954 0.721082 9.89182e-17 98 63.546 6.2685e-05 -3.53991 63.546000 Cu 0.807981 0.682475 2.26828e-16 82 63.546 8.53285e-05 -3.54015 63.546000 Cu 0.884642 0.711397 1.91354e-16 83 63.546 3.21572e-05 -3.54007 63.546000 Cu 0.904194 0.687328 0.5 84 63.546 3.33842e-05 -3.54004 63.546000 Cu 0.788549 0.706568 0.5 85 63.546 6.49691e-05 -3.53994 63.546000 Cu 0.980781 0.716247 0.5 89 63.546 8.39361e-06 -3.54009 63.546000 Cu 0.173026 0.725883 0.5 93 63.546 2.30006e-05 -3.5397 63.546000 Cu 0.0377428 0.769236 8.40325e-18 107 63.546 5.30463e-06 -3.53995 63.546000 Cu 0.0573741 0.745163 0.5 108 63.546 2.34145e-05 -3.54007 63.546000 Cu 0.133893 0.774078 0.5 110 63.546 5.17379e-05 -3.5401 63.546000 Cu 0.153463 0.749987 1.26349e-16 111 63.546 3.95578e-05 -3.53996 63.546000 Cu 0.24949 0.754784 0.5 113 63.546 1.14736e-05 -3.53991 63.546000 Cu 0.269044 0.730677 1 91 63.546 9.22971e-06 -3.53974 63.546000 Cu 0.461228 0.740324 4.68781e-17 95 63.546 6.45863e-06 -3.54015 63.546000 Cu 0.365077 0.735487 0.5 97 63.546 4.23897e-05 -3.54 63.546000 Cu 0.345552 0.75958 1 114 63.546 3.83977e-05 -3.53989 63.546000 Cu 0.441626 0.764397 0.5 116 63.546 4.22388e-05 -3.53987 63.546000 Cu 0.653463 0.749987 3.54137e-17 99 63.546 3.95578e-05 -3.53996 63.546000 Cu 0.673026 0.725883 0.5 100 63.546 2.30006e-05 -3.5397 63.546000 Cu 0.557374 0.745163 0.5 101 63.546 2.34145e-05 -3.54007 63.546000 Cu 0.74949 0.754784 0.5 105 63.546 1.14736e-05 -3.53991 63.546000 Cu 0.537743 0.769236 1.83731e-16 118 63.546 5.30463e-06 -3.53995 63.546000 Cu 0.633893 0.774078 0.5 120 63.546 5.17379e-05 -3.5401 63.546000 Cu 0.769044 0.730677 1.27969e-16 102 63.546 9.22971e-06 -3.53974 63.546000 Cu 0.845552 0.75958 1 103 63.546 3.83977e-05 -3.53989 63.546000 Cu 0.865077 0.735487 0.5 104 63.546 4.23897e-05 -3.54 63.546000 Cu 0.961228 0.740324 1.20046e-19 106 63.546 6.45863e-06 -3.54015 63.546000 Cu 0.941626 0.764397 0.5 109 63.546 4.22388e-05 -3.53987 63.546000 Cu 0.230025 0.7789 3.50535e-17 112 63.546 7.00919e-05 -3.5401 63.546000 Cu 0.0181484 0.7933 0.5 128 63.546 0.000140517 -3.53995 63.546000 Cu 0.114325 0.798143 3.00116e-19 130 63.546 3.30556e-05 -3.54012 63.546000 Cu 0.0948984 0.822215 0.5 131 63.546 7.5392e-05 -3.54005 63.546000 Cu 0.191087 0.827059 9.24357e-18 132 63.546 5.82675e-05 -3.5402 63.546000 Cu 0.210519 0.80299 0.5 133 63.546 5.62465e-05 -3.54008 63.546000 Cu 0.422073 0.788485 1.69626e-16 115 63.546 0.000104654 -3.53983 63.546000 Cu 0.32606 0.783693 0.5 117 63.546 8.29477e-06 -3.53995 63.546000 Cu 0.306654 0.807809 2.23887e-17 134 63.546 6.4001e-05 -3.53991 63.546000 Cu 0.402716 0.8126 0.5 136 63.546 9.16568e-06 -3.53981 63.546000 Cu 0.287296 0.8319 0.5 137 63.546 8.35449e-05 -3.54004 63.546000 Cu 0.498771 0.817392 1.01259e-16 138 63.546 7.28907e-05 -3.53988 63.546000 Cu 0.614325 0.798143 1.21067e-16 119 63.546 3.30556e-05 -3.54012 63.546000 Cu 0.518148 0.7933 0.5 121 63.546 0.000140517 -3.53995 63.546000 Cu 0.730025 0.7789 1.44056e-18 122 63.546 7.00919e-05 -3.5401 63.546000 Cu 0.710519 0.80299 0.5 125 63.546 5.62465e-05 -3.54008 63.546000 Cu 0.594898 0.822215 0.5 140 63.546 7.5392e-05 -3.54005 63.546000 Cu 0.691087 0.827059 5.03595e-17 142 63.546 5.82675e-05 -3.5402 63.546000 Cu 0.806654 0.807809 2.50297e-17 123 63.546 6.4001e-05 -3.53991 63.546000 Cu 0.82606 0.783693 0.5 124 63.546 8.29477e-06 -3.53995 63.546000 Cu 0.922073 0.788485 1 126 63.546 0.000104654 -3.53983 63.546000 Cu 0.998771 0.817392 1.039e-16 127 63.546 7.28907e-05 -3.53988 63.546000 Cu 0.902716 0.8126 0.5 129 63.546 9.16568e-06 -3.53981 63.546000 Cu 0.787296 0.8319 0.5 144 63.546 8.35449e-05 -3.54004 63.546000 Cu 0.0756309 0.846286 1 150 63.546 0.000118371 -3.53953 63.546000 Cu 0.0563013 0.870374 0.5 151 63.546 0.000546168 -3.53884 63.546000 Cu 0.152472 0.875154 1.66624e-16 152 63.546 0.000479532 -3.53972 63.546000 Cu 0.17186 0.851126 0.5 153 63.546 5.08988e-05 -3.54013 63.546000 Cu 0.248938 0.880033 0.5 157 63.546 0.000425264 -3.54077 63.546000 Cu 0.383412 0.836712 3.99154e-17 135 63.546 5.44313e-05 -3.53964 63.546000 Cu 0.479507 0.841497 0.5 141 63.546 3.92497e-05 -3.53936 63.546000 Cu 0.268102 0.855986 4.24964e-17 154 63.546 0.000151722 -3.54063 63.546000 Cu 0.345341 0.884972 4.80186e-19 155 63.546 0.0014884 -3.54102 63.546000 Cu 0.364304 0.860831 0.5 156 63.546 0.000218354 -3.54027 63.546000 Cu 0.460314 0.865624 1 158 63.546 0.000208248 -3.53919 63.546000 Cu 0.575631 0.846286 1.06001e-16 139 63.546 0.000118371 -3.53953 63.546000 Cu 0.67186 0.851126 0.5 145 63.546 5.08988e-05 -3.54013 63.546000 Cu 0.556301 0.870374 0.5 160 63.546 0.000546168 -3.53884 63.546000 Cu 0.652472 0.875154 4.24964e-17 162 63.546 0.000479532 -3.53972 63.546000 Cu 0.748938 0.880033 0.5 164 63.546 0.000425264 -3.54077 63.546000 Cu 0.768102 0.855986 1 143 63.546 0.000151722 -3.54063 63.546000 Cu 0.883412 0.836712 3.57138e-17 146 63.546 5.44313e-05 -3.53964 63.546000 Cu 0.960314 0.865624 1 147 63.546 0.000208248 -3.53919 63.546000 Cu 0.979507 0.841497 0.5 148 63.546 3.92497e-05 -3.53936 63.546000 Cu 0.864304 0.860831 0.5 149 63.546 0.000218354 -3.54027 63.546000 Cu 0.845341 0.884972 3.60139e-19 166 63.546 0.0014884 -3.54102 63.546000 Cu 0.0370101 0.894548 0 170 63.546 0.00125325 -3.53908 63.546000 Cu 0.114061 0.923302 1.8007e-17 171 63.546 0.00978857 -3.53444 63.546000 Cu 0.132963 0.899181 0.5 172 63.546 0.00317824 -3.53868 63.546000 Cu 0.0183569 0.918893 0.5 173 63.546 0.00533058 -3.54299 63.546000 Cu 0.229434 0.90397 1.67345e-16 174 63.546 0.00193468 -3.53833 63.546000 Cu 0.20968 0.927917 0.5 177 63.546 0.0170834 -3.53159 63.546000 Cu 0.000993347 0.943141 6.00232e-20 190 63.546 0.048426 -3.54362 63.546000 Cu 0.441339 0.889847 0.5 161 63.546 0.000985646 -3.54046 63.546000 Cu 0.305332 0.932903 1 175 63.546 0.00834821 -3.53827 63.546000 Cu 0.325988 0.909016 0.5 176 63.546 0.00223458 -3.54034 63.546000 Cu 0.422304 0.914115 3.72144e-17 178 63.546 0.00836468 -3.54405 63.546000 Cu 0.402868 0.938086 0.5 181 63.546 0.0269169 -3.54691 63.546000 Cu 0.500993 0.943141 1.0252e-16 179 63.546 0.048426 -3.54362 63.546000 Cu 0.53701 0.894548 4.24964e-17 159 63.546 0.00125325 -3.53908 63.546000 Cu 0.729434 0.90397 1.78389e-16 163 63.546 0.00193468 -3.53833 63.546000 Cu 0.632963 0.899181 0.5 165 63.546 0.00317824 -3.53868 63.546000 Cu 0.518357 0.918893 0.5 180 63.546 0.00533058 -3.54299 63.546000 Cu 0.614061 0.923302 8.74538e-17 182 63.546 0.00978857 -3.53444 63.546000 Cu 0.70968 0.927917 0.5 184 63.546 0.0170834 -3.53159 63.546000 Cu 0.922304 0.914115 5.40209e-19 167 63.546 0.00836468 -3.54405 63.546000 Cu 0.941339 0.889847 0.5 168 63.546 0.000985646 -3.54046 63.546000 Cu 0.825988 0.909016 0.5 169 63.546 0.00223458 -3.54034 63.546000 Cu 0.805332 0.932903 2.36491e-17 186 63.546 0.00834821 -3.53827 63.546000 Cu 0.902868 0.938086 0.5 188 63.546 0.0269169 -3.54691 63.546000 Cu 0.0801343 0.973384 5.40209e-19 191 63.546 0.768551 -3.42414 63.546000 Cu 0.0969053 0.947883 0.5 192 63.546 0.0709299 -3.51664 63.546000 Cu 0.188902 0.952207 1 194 63.546 0.0954711 -3.50772 63.546000 Cu 0.166686 0.978503 0.5 197 63.546 0.520834 -3.47425 63.546000 Cu 0.261476 0.980293 1 195 63.546 0.585528 -3.50462 63.546000 Cu 0.283473 0.9569 0.5 196 63.546 0.122443 -3.54255 63.546000 Cu 0.382507 0.961184 1 198 63.546 0.0679732 -3.52602 63.546000 Cu 0.465676 0.988641 1.8007e-19 199 63.546 9.25645 -3.29239 63.546000 Cu 0.485177 0.966595 0.5 200 63.546 0.705333 -3.4595 63.546000 Cu 0.367318 0.983764 0.5 201 63.546 3.70557 -3.44655 63.546000 Cu 0.688902 0.952207 1 183 63.546 0.0954711 -3.50772 63.546000 Cu 0.596905 0.947883 0.5 185 63.546 0.0709299 -3.51664 63.546000 Cu 0.580134 0.973384 1 202 63.546 0.768551 -3.42414 63.546000 Cu 0.666686 0.978503 0.5 204 63.546 0.520834 -3.47425 63.546000 Cu 0.882507 0.961184 3.39731e-17 187 63.546 0.0679732 -3.52602 63.546000 Cu 0.783473 0.9569 0.5 189 63.546 0.122443 -3.54255 63.546000 Cu 0.985177 0.966595 0.5 193 63.546 0.705333 -3.4595 63.546000 Cu 0.761476 0.980293 7.20278e-19 206 63.546 0.585528 -3.50462 63.546000 Cu 0.867318 0.983764 0.5 207 63.546 3.70557 -3.44655 63.546000 Cu 0.965676 0.988641 3.38531e-17 208 63.546 9.25645 -3.29239