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) = 73.739 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 0.00459246 1.96276e-17 214 63.546 2.12275 -3.52239 63.546000 Cu 0.0511605 0.00467417 0.5 215 63.546 8.14413 -3.47079 63.546000 Cu 0.0805598 0.0357783 1.37453e-17 222 63.546 0.745775 -3.42647 63.546000 Cu 0.189516 0.056992 4.63979e-17 223 63.546 0.0973745 -3.50742 63.546000 Cu 0.167077 0.0307013 0.5 224 63.546 0.503804 -3.47372 63.546000 Cu 0.348855 0.00457134 1.03e-16 216 63.546 6.80223 -3.23618 63.546000 Cu 0.252834 0.00456709 0.5 217 63.546 1.09117 -3.5113 63.546000 Cu 0.26178 0.028894 1.68965e-16 226 63.546 0.595819 -3.50395 63.546000 Cu 0.383113 0.0479585 1 227 63.546 0.0688088 -3.52614 63.546000 Cu 0.36779 0.0253567 0.5 228 63.546 3.74002 -3.44751 63.546000 Cu 0.284183 0.0522694 0.5 229 63.546 0.119812 -3.54236 63.546000 Cu 0.465946 0.0205097 3.00116e-19 230 63.546 9.22786 -3.29324 63.546000 Cu 0.485756 0.0425417 0.5 233 63.546 0.685786 -3.46187 63.546000 Cu 0.58056 0.0357783 3.43333e-17 231 63.546 0.745775 -3.42647 63.546000 Cu 0.551161 0.00467417 0.5 232 63.546 8.14413 -3.47079 63.546000 Cu 0.651828 0.00459246 2.40093e-19 234 63.546 2.12275 -3.52239 63.546000 Cu 0.667077 0.0307013 0.5 237 63.546 0.503804 -3.47372 63.546000 Cu 0.689516 0.056992 3.56538e-17 255 63.546 0.0973745 -3.50742 63.546000 Cu 0.848855 0.00457134 1 211 63.546 6.80223 -3.23618 63.546000 Cu 0.965946 0.0205097 2.75507e-17 212 63.546 9.22786 -3.29324 63.546000 Cu 0.86779 0.0253567 0.5 213 63.546 3.74002 -3.44751 63.546000 Cu 0.883113 0.0479585 5.24603e-17 218 63.546 0.0688088 -3.52614 63.546000 Cu 0.985756 0.0425417 0.5 220 63.546 0.685786 -3.46187 63.546000 Cu 0.76178 0.028894 8.7874e-17 235 63.546 0.595819 -3.50395 63.546000 Cu 0.752834 0.00456709 0.5 236 63.546 1.09117 -3.5113 63.546000 Cu 0.784183 0.0522694 0.5 257 63.546 0.119812 -3.54236 63.546000 Cu 0.00172466 0.0660231 8.81741e-17 219 63.546 0.0488656 -3.54416 63.546000 Cu 0.097604 0.0613069 0.5 225 63.546 0.0699881 -3.51698 63.546000 Cu 0.0383185 0.114691 1.72867e-17 240 63.546 0.00148325 -3.53886 63.546000 Cu 0.0193798 0.0903089 0.5 241 63.546 0.00548946 -3.5427 63.546000 Cu 0.114964 0.0859165 1 243 63.546 0.0109789 -3.53422 63.546000 Cu 0.23064 0.105251 3.39131e-17 244 63.546 0.00167356 -3.53814 63.546000 Cu 0.210607 0.081287 0.5 245 63.546 0.0167631 -3.53181 63.546000 Cu 0.134257 0.110044 0.5 246 63.546 0.00295398 -3.53832 63.546000 Cu 0.306244 0.076288 1.01679e-16 247 63.546 0.00784685 -3.53829 63.546000 Cu 0.423393 0.0950936 1.8007e-19 248 63.546 0.00840088 -3.54388 63.546000 Cu 0.403728 0.0710915 0.5 249 63.546 0.0268886 -3.54712 63.546000 Cu 0.327143 0.100204 0.5 250 63.546 0.00224145 -3.54033 63.546000 Cu 0.501725 0.0660231 1 251 63.546 0.0488656 -3.54416 63.546000 Cu 0.614964 0.0859165 1 252 63.546 0.0109789 -3.53422 63.546000 Cu 0.597604 0.0613069 0.5 253 63.546 0.0699881 -3.51698 63.546000 Cu 0.51938 0.0903089 0.5 254 63.546 0.00548946 -3.5427 63.546000 Cu 0.710607 0.081287 0.5 258 63.546 0.0167631 -3.53181 63.546000 Cu 0.538318 0.114691 1 273 63.546 0.00148325 -3.53886 63.546000 Cu 0.634257 0.110044 0.5 275 63.546 0.00295398 -3.53832 63.546000 Cu 0.73064 0.105251 7.53892e-17 277 63.546 0.00167356 -3.53814 63.546000 Cu 0.903728 0.0710915 0.5 221 63.546 0.0268886 -3.54712 63.546000 Cu 0.923393 0.0950936 9.87382e-17 239 63.546 0.00840088 -3.54388 63.546000 Cu 0.806244 0.076288 1.37993e-16 256 63.546 0.00784685 -3.53829 63.546000 Cu 0.827143 0.100204 0.5 278 63.546 0.00224145 -3.54033 63.546000 Cu 0.0776917 0.163043 1 262 63.546 8.93191e-05 -3.53959 63.546000 Cu 0.0579755 0.138905 0.5 263 63.546 0.000521308 -3.53884 63.546000 Cu 0.154087 0.134095 9.3036e-17 265 63.546 0.000354444 -3.53973 63.546000 Cu 0.17379 0.158201 0.5 268 63.546 4.88783e-05 -3.54026 63.546000 Cu 0.269974 0.153332 1 266 63.546 0.000118761 -3.54077 63.546000 Cu 0.250461 0.129224 0.5 267 63.546 0.000446389 -3.54077 63.546000 Cu 0.346783 0.124289 9.19556e-17 269 63.546 0.00132056 -3.54105 63.546000 Cu 0.46209 0.143672 3.00116e-19 270 63.546 0.000209133 -3.5392 63.546000 Cu 0.442691 0.11939 0.5 271 63.546 0.00110902 -3.54038 63.546000 Cu 0.366114 0.148473 0.5 272 63.546 0.000194357 -3.54034 63.546000 Cu 0.385512 0.172649 0 290 63.546 3.14316e-05 -3.53981 63.546000 Cu 0.481574 0.167851 0.5 292 63.546 4.85018e-05 -3.53947 63.546000 Cu 0.654087 0.134095 0 274 63.546 0.000354444 -3.53973 63.546000 Cu 0.557975 0.138905 0.5 276 63.546 0.000521308 -3.53884 63.546000 Cu 0.577692 0.163043 3.73945e-17 294 63.546 8.93191e-05 -3.53959 63.546000 Cu 0.67379 0.158201 0.5 296 63.546 4.88783e-05 -3.54026 63.546000 Cu 0.846783 0.124289 5.90028e-17 238 63.546 0.00132056 -3.54105 63.546000 Cu 0.942691 0.11939 0.5 242 63.546 0.00110902 -3.54038 63.546000 Cu 0.885512 0.172649 1.02039e-18 259 63.546 3.14316e-05 -3.53981 63.546000 Cu 0.866114 0.148473 0.5 260 63.546 0.000194357 -3.54034 63.546000 Cu 0.96209 0.143672 8.41525e-17 261 63.546 0.000209133 -3.5392 63.546000 Cu 0.981574 0.167851 0.5 264 63.546 4.85018e-05 -3.53947 63.546000 Cu 0.750461 0.129224 0.5 279 63.546 0.000446389 -3.54077 63.546000 Cu 0.769974 0.153332 3.60139e-19 298 63.546 0.000118761 -3.54077 63.546000 Cu 0.00107506 0.192006 1.67105e-16 282 63.546 2.22959e-05 -3.53995 63.546000 Cu 0.116644 0.211321 1.86432e-16 283 63.546 5.2082e-05 -3.53995 63.546000 Cu 0.0972067 0.187185 0.5 284 63.546 2.68702e-05 -3.54009 63.546000 Cu 0.0204862 0.216154 0.5 285 63.546 3.96385e-05 -3.53996 63.546000 Cu 0.193354 0.182339 4.68181e-17 286 63.546 2.67399e-05 -3.54016 63.546000 Cu 0.212795 0.206482 0.5 289 63.546 8.01416e-05 -3.53992 63.546000 Cu 0.232009 0.23062 1.05821e-16 308 63.546 4.24204e-06 -3.5397 63.546000 Cu 0.30888 0.201648 1 287 63.546 4.34579e-05 -3.53991 63.546000 Cu 0.289449 0.177484 0.5 288 63.546 3.09578e-05 -3.54015 63.546000 Cu 0.404962 0.19682 0.5 293 63.546 2.08645e-05 -3.53992 63.546000 Cu 0.328173 0.225794 0.5 310 63.546 2.14252e-05 -3.53981 63.546000 Cu 0.424337 0.220974 1 312 63.546 3.28561e-05 -3.53996 63.546000 Cu 0.501075 0.192006 4.60378e-17 291 63.546 2.22959e-05 -3.53995 63.546000 Cu 0.693354 0.182339 1 295 63.546 2.67399e-05 -3.54016 63.546000 Cu 0.597207 0.187185 0.5 297 63.546 2.68702e-05 -3.54009 63.546000 Cu 0.520486 0.216154 0.5 314 63.546 3.96385e-05 -3.53996 63.546000 Cu 0.616644 0.211321 1 316 63.546 5.2082e-05 -3.53995 63.546000 Cu 0.732009 0.23062 1.2947e-16 317 63.546 4.24204e-06 -3.5397 63.546000 Cu 0.712795 0.206482 0.5 318 63.546 8.01416e-05 -3.53992 63.546000 Cu 0.924337 0.220974 1.77609e-16 280 63.546 3.28561e-05 -3.53996 63.546000 Cu 0.904962 0.19682 0.5 281 63.546 2.08645e-05 -3.53992 63.546000 Cu 0.789449 0.177484 0.5 299 63.546 3.09578e-05 -3.54015 63.546000 Cu 0.80888 0.201648 3.00116e-19 320 63.546 4.34579e-05 -3.53991 63.546000 Cu 0.828173 0.225794 0.5 321 63.546 2.14252e-05 -3.53981 63.546000 Cu 0.0397655 0.240291 1.09242e-17 304 63.546 2.84136e-05 -3.53979 63.546000 Cu 0.155073 0.259588 2.36491e-17 305 63.546 8.06909e-06 -3.53972 63.546000 Cu 0.135888 0.235451 0.5 306 63.546 6.75872e-06 -3.53966 63.546000 Cu 0.0589605 0.26441 0.5 307 63.546 1.16111e-05 -3.53963 63.546000 Cu 0.078106 0.288539 6.30844e-17 326 63.546 2.79973e-05 -3.5398 63.546000 Cu 0.174288 0.283723 0.5 328 63.546 1.32636e-05 -3.53994 63.546000 Cu 0.34737 0.249929 1.20046e-19 309 63.546 6.93306e-06 -3.53999 63.546000 Cu 0.251201 0.254752 0.5 311 63.546 1.50569e-05 -3.53995 63.546000 Cu 0.443577 0.245118 0.5 315 63.546 2.07099e-05 -3.53994 63.546000 Cu 0.270437 0.278907 7.62295e-18 330 63.546 2.41141e-05 -3.54008 63.546000 Cu 0.366595 0.274071 0.5 332 63.546 1.34719e-05 -3.53999 63.546000 Cu 0.462765 0.269234 1.32111e-16 334 63.546 1.12944e-05 -3.53971 63.546000 Cu 0.482025 0.293356 0.5 337 63.546 4.18075e-05 -3.53978 63.546000 Cu 0.539765 0.240291 2.87511e-17 313 63.546 2.84136e-05 -3.53979 63.546000 Cu 0.635888 0.235451 0.5 319 63.546 6.75872e-06 -3.53966 63.546000 Cu 0.578106 0.288539 0 335 63.546 2.79973e-05 -3.5398 63.546000 Cu 0.55896 0.26441 0.5 336 63.546 1.16111e-05 -3.53963 63.546000 Cu 0.655073 0.259588 9.89783e-17 338 63.546 8.06909e-06 -3.53972 63.546000 Cu 0.674288 0.283723 0.5 341 63.546 1.32636e-05 -3.53994 63.546000 Cu 0.84737 0.249929 6.00232e-20 300 63.546 6.93306e-06 -3.53999 63.546000 Cu 0.962765 0.269234 1 301 63.546 1.12944e-05 -3.53971 63.546000 Cu 0.943577 0.245118 0.5 302 63.546 2.07099e-05 -3.53994 63.546000 Cu 0.866595 0.274071 0.5 303 63.546 1.34719e-05 -3.53999 63.546000 Cu 0.982025 0.293356 0.5 324 63.546 4.18075e-05 -3.53978 63.546000 Cu 0.770437 0.278907 3.19324e-17 339 63.546 2.41141e-05 -3.54008 63.546000 Cu 0.751201 0.254752 0.5 340 63.546 1.50569e-05 -3.53995 63.546000 Cu 0.00122749 0.317505 5.02394e-17 323 63.546 2.59993e-05 -3.53975 63.546000 Cu 0.193396 0.307877 2.40093e-19 327 63.546 5.49096e-05 -3.54 63.546000 Cu 0.0973232 0.312695 0.5 329 63.546 6.04485e-06 -3.53979 63.546000 Cu 0.0203946 0.341645 0.5 345 63.546 4.48238e-05 -3.53935 63.546000 Cu 0.116503 0.33686 1.23468e-16 347 63.546 4.24021e-05 -3.53966 63.546000 Cu 0.212625 0.332031 0.5 349 63.546 6.49608e-05 -3.5401 63.546000 Cu 0.385865 0.298192 1 331 63.546 2.63955e-05 -3.53996 63.546000 Cu 0.289609 0.30304 0.5 333 63.546 2.147e-05 -3.54005 63.546000 Cu 0.308817 0.327162 3.56538e-17 351 63.546 1.55605e-05 -3.54025 63.546000 Cu 0.424262 0.346443 2.12002e-16 352 63.546 0.000109022 -3.53957 63.546000 Cu 0.405044 0.322316 0.5 353 63.546 3.53832e-05 -3.54 63.546000 Cu 0.328075 0.35129 0.5 354 63.546 5.03639e-05 -3.54023 63.546000 Cu 0.501227 0.317505 5.73822e-17 355 63.546 2.59993e-05 -3.53975 63.546000 Cu 0.616503 0.33686 1 356 63.546 4.24021e-05 -3.53966 63.546000 Cu 0.597323 0.312695 0.5 357 63.546 6.04485e-06 -3.53979 63.546000 Cu 0.520395 0.341645 0.5 358 63.546 4.48238e-05 -3.53935 63.546000 Cu 0.693396 0.307877 1.11283e-16 359 63.546 5.49096e-05 -3.54 63.546000 Cu 0.712625 0.332031 0.5 362 63.546 6.49608e-05 -3.5401 63.546000 Cu 0.885865 0.298192 4.1416e-17 322 63.546 2.63955e-05 -3.53996 63.546000 Cu 0.905044 0.322316 0.5 325 63.546 3.53832e-05 -3.54 63.546000 Cu 0.924262 0.346443 1.47657e-17 343 63.546 0.000109022 -3.53957 63.546000 Cu 0.808817 0.327162 4.29766e-17 360 63.546 1.55605e-05 -3.54025 63.546000 Cu 0.789609 0.30304 0.5 361 63.546 2.147e-05 -3.54005 63.546000 Cu 0.828075 0.35129 0.5 382 63.546 5.03639e-05 -3.54023 63.546000 Cu 0.0395694 0.365825 6.87266e-17 344 63.546 0.000182373 -3.53927 63.546000 Cu 0.231831 0.356164 3.56538e-17 348 63.546 0.000123558 -3.54063 63.546000 Cu 0.135606 0.361025 0.5 350 63.546 0.00022943 -3.54026 63.546000 Cu 0.0585327 0.390094 0.5 367 63.546 0.00106189 -3.54047 63.546000 Cu 0.154583 0.385202 3.69743e-17 369 63.546 0.00128354 -3.54091 63.546000 Cu 0.173837 0.409288 0.5 372 63.546 0.0024053 -3.54034 63.546000 Cu 0.270417 0.404229 7.80302e-19 370 63.546 0.00192575 -3.53821 63.546000 Cu 0.25097 0.38026 0.5 371 63.546 0.00041941 -3.54063 63.546000 Cu 0.347432 0.375374 1 373 63.546 0.00048604 -3.53961 63.546000 Cu 0.462817 0.394802 7.30483e-17 374 63.546 0.00127313 -3.53892 63.546000 Cu 0.443593 0.370581 0.5 375 63.546 0.000547674 -3.53878 63.546000 Cu 0.366871 0.399428 0.5 376 63.546 0.00344783 -3.53839 63.546000 Cu 0.539569 0.365825 0 377 63.546 0.000182373 -3.53927 63.546000 Cu 0.654583 0.385202 3.3553e-17 378 63.546 0.00128354 -3.54091 63.546000 Cu 0.635606 0.361025 0.5 379 63.546 0.00022943 -3.54026 63.546000 Cu 0.558533 0.390094 0.5 380 63.546 0.00106189 -3.54047 63.546000 Cu 0.731831 0.356164 1 381 63.546 0.000123558 -3.54063 63.546000 Cu 0.673837 0.409288 0.5 400 63.546 0.0024053 -3.54034 63.546000 Cu 0.847432 0.375374 1 342 63.546 0.00048604 -3.53961 63.546000 Cu 0.943593 0.370581 0.5 346 63.546 0.000547674 -3.53878 63.546000 Cu 0.866871 0.399428 0.5 364 63.546 0.00344783 -3.53839 63.546000 Cu 0.962817 0.394802 1 365 63.546 0.00127313 -3.53892 63.546000 Cu 0.75097 0.38026 0.5 383 63.546 0.00041941 -3.54063 63.546000 Cu 0.770417 0.404229 8.40325e-19 402 63.546 0.00192575 -3.53821 63.546000 Cu 0.0774597 0.414397 6.93868e-17 366 63.546 0.00838048 -3.54398 63.546000 Cu 0.117205 0.461534 3.60139e-19 387 63.546 0.0658492 -3.52655 63.546000 Cu 0.0968661 0.4384 0.5 388 63.546 0.026318 -3.5468 63.546000 Cu 0.0145792 0.466953 0.5 389 63.546 0.717109 -3.45984 63.546000 Cu 0.194432 0.433208 1 390 63.546 0.00801954 -3.53853 63.546000 Cu 0.21623 0.457218 0.5 393 63.546 0.120585 -3.54261 63.546000 Cu 0.310867 0.452513 8.03711e-17 391 63.546 0.0971082 -3.50774 63.546000 Cu 0.290143 0.428195 0.5 392 63.546 0.0179415 -3.53188 63.546000 Cu 0.385762 0.42359 1.8007e-19 394 63.546 0.0099777 -3.53424 63.546000 Cu 0.481384 0.419192 0.5 396 63.546 0.00561103 -3.54271 63.546000 Cu 0.402873 0.448216 0.5 397 63.546 0.0698419 -3.51618 63.546000 Cu 0.498754 0.443474 8.73338e-17 395 63.546 0.0492124 -3.5432 63.546000 Cu 0.71623 0.457218 0.5 12 63.546 0.120585 -3.54261 63.546000 Cu 0.617205 0.461534 1 205 63.546 0.0658492 -3.52655 63.546000 Cu 0.514579 0.466953 0.5 210 63.546 0.717109 -3.45984 63.546000 Cu 0.57746 0.414397 8.61933e-17 398 63.546 0.00838048 -3.54398 63.546000 Cu 0.694432 0.433208 3.60139e-19 399 63.546 0.00801954 -3.53853 63.546000 Cu 0.596866 0.4384 0.5 401 63.546 0.026318 -3.5468 63.546000 Cu 0.998754 0.443474 1.17646e-17 386 63.546 0.0492124 -3.5432 63.546000 Cu 0.810867 0.452513 1 5 63.546 0.0971082 -3.50774 63.546000 Cu 0.885762 0.42359 1 363 63.546 0.0099777 -3.53424 63.546000 Cu 0.981384 0.419192 0.5 368 63.546 0.00561103 -3.54271 63.546000 Cu 0.902873 0.448216 0.5 385 63.546 0.0698419 -3.51618 63.546000 Cu 0.790143 0.428195 0.5 403 63.546 0.0179415 -3.53188 63.546000 Cu 0.0343719 0.520889 1 4 63.546 9.17412 -3.29209 63.546000 Cu 0.132476 0.525745 0.5 6 63.546 3.7217 -3.44773 63.546000 Cu 0.15107 0.504937 0 7 63.546 6.78973 -3.23603 63.546000 Cu 0.238337 0.529251 0 8 63.546 0.588381 -3.5047 63.546000 Cu 0.247164 0.504924 0.5 9 63.546 1.09403 -3.51161 63.546000 Cu 0.0341313 0.489056 1 406 63.546 9.27763 -3.29259 63.546000 Cu 0.132444 0.484134 0.5 407 63.546 3.72604 -3.44701 63.546000 Cu 0.238344 0.480613 2.0558e-16 408 63.546 0.590455 -3.50454 63.546000 Cu 0.44885 0.505174 0.5 209 63.546 8.14548 -3.47056 63.546000 Cu 0.348179 0.504944 5.4201e-17 409 63.546 2.13011 -3.52208 63.546000 Cu 0.333041 0.47883 0.5 410 63.546 0.517095 -3.4722 63.546000 Cu 0.419619 0.473747 1 411 63.546 0.78948 -3.42316 63.546000 Cu 0.65107 0.504937 1.86072e-18 1 63.546 6.78973 -3.23603 63.546000 Cu 0.747164 0.504924 0.5 3 63.546 1.09403 -3.51161 63.546000 Cu 0.632444 0.484134 0.5 10 63.546 3.72604 -3.44701 63.546000 Cu 0.534372 0.520889 1 14 63.546 9.17412 -3.29209 63.546000 Cu 0.632476 0.525745 0.5 16 63.546 3.7217 -3.44773 63.546000 Cu 0.738337 0.529251 3.00116e-19 18 63.546 0.588381 -3.5047 63.546000 Cu 0.738344 0.480613 1 203 63.546 0.590455 -3.50454 63.546000 Cu 0.534131 0.489056 1 412 63.546 9.27763 -3.29259 63.546000 Cu 0.833041 0.47883 0.5 2 63.546 0.517095 -3.4722 63.546000 Cu 0.919619 0.473747 4.49574e-17 384 63.546 0.78948 -3.42316 63.546000 Cu 0.848179 0.504944 4.80186e-19 404 63.546 2.13011 -3.52208 63.546000 Cu 0.94885 0.505174 0.5 405 63.546 8.14548 -3.47056 63.546000 Cu 0.0144518 0.542919 0.5 24 63.546 0.677289 -3.46226 63.546000 Cu 0.117158 0.548343 9.20756e-17 26 63.546 0.0673823 -3.52578 63.546000 Cu 0.096652 0.571431 0.5 27 63.546 0.0272794 -3.54686 63.546000 Cu 0.194203 0.576616 1.12063e-16 28 63.546 0.00834857 -3.53828 63.546000 Cu 0.216151 0.552635 0.5 29 63.546 0.120836 -3.54226 63.546000 Cu 0.419577 0.536117 4.20163e-19 11 63.546 0.734117 -3.42883 63.546000 Cu 0.333053 0.531041 0.5 13 63.546 0.495302 -3.47475 63.546000 Cu 0.310767 0.55731 1 30 63.546 0.094718 -3.50734 63.546000 Cu 0.385445 0.586227 1.21727e-16 31 63.546 0.0105574 -3.5344 63.546000 Cu 0.402677 0.561624 0.5 32 63.546 0.0707429 -3.51685 63.546000 Cu 0.289851 0.581621 0.5 33 63.546 0.0182016 -3.53178 63.546000 Cu 0.498553 0.566358 1 34 63.546 0.0503259 -3.54379 63.546000 Cu 0.617158 0.548343 1.24188e-16 15 63.546 0.0673823 -3.52578 63.546000 Cu 0.514452 0.542919 0.5 17 63.546 0.677289 -3.46226 63.546000 Cu 0.716151 0.552635 0.5 21 63.546 0.120836 -3.54226 63.546000 Cu 0.596652 0.571431 0.5 36 63.546 0.0272794 -3.54686 63.546000 Cu 0.694203 0.576616 0 38 63.546 0.00834857 -3.53828 63.546000 Cu 0.810767 0.55731 1.34332e-16 19 63.546 0.094718 -3.50734 63.546000 Cu 0.833053 0.531041 0.5 20 63.546 0.495302 -3.47475 63.546000 Cu 0.919577 0.536117 1 22 63.546 0.734117 -3.42883 63.546000 Cu 0.998553 0.566358 1 23 63.546 0.0503259 -3.54379 63.546000 Cu 0.902677 0.561624 0.5 25 63.546 0.0707429 -3.51685 63.546000 Cu 0.789851 0.581621 0.5 40 63.546 0.0182016 -3.53178 63.546000 Cu 0.885445 0.586227 1 42 63.546 0.0105574 -3.5344 63.546000 Cu 0.0771167 0.595404 5.73822e-17 46 63.546 0.00842141 -3.54413 63.546000 Cu 0.0580168 0.619674 0.5 47 63.546 0.00101571 -3.54035 63.546000 Cu 0.15398 0.624549 5.66619e-17 48 63.546 0.00166695 -3.54083 63.546000 Cu 0.173423 0.600508 0.5 49 63.546 0.00237621 -3.54045 63.546000 Cu 0.0389617 0.643909 9.98186e-17 66 63.546 0.000167881 -3.53916 63.546000 Cu 0.250419 0.629483 0.5 53 63.546 0.000376623 -3.54069 63.546000 Cu 0.481088 0.590621 0.5 37 63.546 0.00548988 -3.54304 63.546000 Cu 0.269984 0.605559 2.40093e-19 50 63.546 0.00213065 -3.53812 63.546000 Cu 0.346901 0.634366 4.54376e-17 51 63.546 0.000554915 -3.53973 63.546000 Cu 0.366408 0.610343 0.5 52 63.546 0.0031247 -3.53826 63.546000 Cu 0.462354 0.614971 1 54 63.546 0.00120344 -3.53895 63.546000 Cu 0.443025 0.639158 0.5 57 63.546 0.000598825 -3.5388 63.546000 Cu 0.577117 0.595404 8.37324e-17 35 63.546 0.00842141 -3.54413 63.546000 Cu 0.673423 0.600508 0.5 41 63.546 0.00237621 -3.54045 63.546000 Cu 0.538962 0.643909 1.85712e-16 55 63.546 0.000167881 -3.53916 63.546000 Cu 0.558017 0.619674 0.5 56 63.546 0.00101571 -3.54035 63.546000 Cu 0.65398 0.624549 9.39964e-17 58 63.546 0.00166695 -3.54083 63.546000 Cu 0.750419 0.629483 0.5 60 63.546 0.000376623 -3.54069 63.546000 Cu 0.769984 0.605559 1.58221e-16 39 63.546 0.00213065 -3.53812 63.546000 Cu 0.962354 0.614971 1.63263e-16 43 63.546 0.00120344 -3.53895 63.546000 Cu 0.981088 0.590621 0.5 44 63.546 0.00548988 -3.54304 63.546000 Cu 0.866408 0.610343 0.5 45 63.546 0.0031247 -3.53826 63.546000 Cu 0.846901 0.634366 1.71066e-17 62 63.546 0.000554915 -3.53973 63.546000 Cu 0.943025 0.639158 0.5 64 63.546 0.000598825 -3.5388 63.546000 Cu 0.115821 0.67284 8.0071e-17 67 63.546 5.41382e-05 -3.53991 63.546000 Cu 0.134973 0.648689 0.5 68 63.546 0.000246537 -3.54017 63.546000 Cu 0.0197826 0.668052 0.5 69 63.546 0.000157192 -3.53954 63.546000 Cu 0.23112 0.65353 1.8007e-19 70 63.546 0.000306306 -3.54067 63.546000 Cu 0.211864 0.677645 0.5 73 63.546 9.76085e-05 -3.54012 63.546000 Cu 0.0964592 0.696981 0.5 88 63.546 9.60329e-05 -3.53992 63.546000 Cu 0.192509 0.701774 9.72376e-18 90 63.546 3.09521e-05 -3.53983 63.546000 Cu 0.000364205 0.692168 1.20647e-16 86 63.546 0.000127897 -3.53994 63.546000 Cu 0.307981 0.682475 6.60255e-18 71 63.546 8.53154e-05 -3.54012 63.546000 Cu 0.327395 0.658409 0.5 72 63.546 3.8623e-05 -3.5403 63.546000 Cu 0.423644 0.663256 0 74 63.546 0.000179964 -3.53963 63.546000 Cu 0.404194 0.687328 0.5 77 63.546 3.33734e-05 -3.54002 63.546000 Cu 0.500364 0.692168 3.6254e-17 75 63.546 0.000127897 -3.53994 63.546000 Cu 0.73112 0.65353 1.8007e-19 59 63.546 0.000306306 -3.54067 63.546000 Cu 0.634973 0.648689 0.5 61 63.546 0.000246537 -3.54017 63.546000 Cu 0.519783 0.668052 0.5 76 63.546 0.000157192 -3.53954 63.546000 Cu 0.615821 0.67284 1 78 63.546 5.41382e-05 -3.53991 63.546000 Cu 0.692509 0.701774 9.60371e-19 79 63.546 3.09521e-05 -3.53983 63.546000 Cu 0.711864 0.677645 0.5 80 63.546 9.76085e-05 -3.54012 63.546000 Cu 0.596459 0.696981 0.5 81 63.546 9.60329e-05 -3.53992 63.546000 Cu 0.923644 0.663256 1.99877e-17 63 63.546 0.000179964 -3.53963 63.546000 Cu 0.827395 0.658409 0.5 65 63.546 3.8623e-05 -3.5403 63.546000 Cu 0.807981 0.682475 1 82 63.546 8.53154e-05 -3.54012 63.546000 Cu 0.904194 0.687328 0.5 84 63.546 3.33734e-05 -3.54002 63.546000 Cu 0.0769536 0.721082 0 87 63.546 6.2684e-05 -3.53989 63.546000 Cu 0.173026 0.725883 0.5 93 63.546 2.3009e-05 -3.53967 63.546000 Cu 0.0573742 0.745163 0.5 108 63.546 2.34142e-05 -3.54004 63.546000 Cu 0.153463 0.749987 1 111 63.546 3.95399e-05 -3.53994 63.546000 Cu 0.249491 0.754784 0.5 113 63.546 1.14696e-05 -3.53988 63.546000 Cu 0.269045 0.730677 6.13437e-17 91 63.546 9.2294e-06 -3.53972 63.546000 Cu 0.28855 0.706568 0.5 92 63.546 6.49669e-05 -3.53992 63.546000 Cu 0.384642 0.711397 1 94 63.546 3.21473e-05 -3.54005 63.546000 Cu 0.461228 0.740324 2.45495e-17 95 63.546 6.45999e-06 -3.54012 63.546000 Cu 0.480781 0.716247 0.5 96 63.546 8.39692e-06 -3.54006 63.546000 Cu 0.365077 0.735487 0.5 97 63.546 4.23719e-05 -3.53997 63.546000 Cu 0.345552 0.75958 1 114 63.546 3.83881e-05 -3.53986 63.546000 Cu 0.441626 0.764397 0.5 116 63.546 4.22346e-05 -3.53984 63.546000 Cu 0.576954 0.721082 0 98 63.546 6.2684e-05 -3.53989 63.546000 Cu 0.653463 0.749987 1 99 63.546 3.95399e-05 -3.53994 63.546000 Cu 0.673026 0.725883 0.5 100 63.546 2.3009e-05 -3.53967 63.546000 Cu 0.557374 0.745163 0.5 101 63.546 2.34142e-05 -3.54004 63.546000 Cu 0.749491 0.754784 0.5 105 63.546 1.14696e-05 -3.53988 63.546000 Cu 0.884642 0.711397 1 83 63.546 3.21473e-05 -3.54005 63.546000 Cu 0.78855 0.706568 0.5 85 63.546 6.49669e-05 -3.53992 63.546000 Cu 0.980781 0.716247 0.5 89 63.546 8.39692e-06 -3.54006 63.546000 Cu 0.769045 0.730677 3.75745e-17 102 63.546 9.2294e-06 -3.53972 63.546000 Cu 0.845552 0.75958 1 103 63.546 3.83881e-05 -3.53986 63.546000 Cu 0.865077 0.735487 0.5 104 63.546 4.23719e-05 -3.53997 63.546000 Cu 0.961228 0.740324 1.36313e-16 106 63.546 6.45999e-06 -3.54012 63.546000 Cu 0.941626 0.764397 0.5 109 63.546 4.22346e-05 -3.53984 63.546000 Cu 0.0377429 0.769236 0 107 63.546 5.30077e-06 -3.53992 63.546000 Cu 0.133893 0.774078 0.5 110 63.546 5.17051e-05 -3.54008 63.546000 Cu 0.230025 0.7789 1 112 63.546 7.0038e-05 -3.54008 63.546000 Cu 0.0181486 0.7933 0.5 128 63.546 0.000140493 -3.53992 63.546000 Cu 0.114325 0.798143 1 130 63.546 3.30485e-05 -3.54009 63.546000 Cu 0.0948986 0.822215 0.5 131 63.546 7.5356e-05 -3.54002 63.546000 Cu 0.210519 0.80299 0.5 133 63.546 5.62354e-05 -3.54006 63.546000 Cu 0.422074 0.788485 1 115 63.546 0.000104624 -3.5398 63.546000 Cu 0.32606 0.783693 0.5 117 63.546 8.29097e-06 -3.53992 63.546000 Cu 0.306654 0.807809 3.00116e-18 134 63.546 6.39707e-05 -3.53988 63.546000 Cu 0.402716 0.8126 0.5 136 63.546 9.16427e-06 -3.53978 63.546000 Cu 0.498771 0.817392 4.34568e-17 138 63.546 7.28461e-05 -3.53986 63.546000 Cu 0.537743 0.769236 6.00232e-20 118 63.546 5.30077e-06 -3.53992 63.546000 Cu 0.614325 0.798143 3.54737e-17 119 63.546 3.30485e-05 -3.54009 63.546000 Cu 0.633893 0.774078 0.5 120 63.546 5.17051e-05 -3.54008 63.546000 Cu 0.518149 0.7933 0.5 121 63.546 0.000140493 -3.53992 63.546000 Cu 0.730025 0.7789 1 122 63.546 7.0038e-05 -3.54008 63.546000 Cu 0.710519 0.80299 0.5 125 63.546 5.62354e-05 -3.54006 63.546000 Cu 0.594899 0.822215 0.5 140 63.546 7.5356e-05 -3.54002 63.546000 Cu 0.806654 0.807809 1.16805e-16 123 63.546 6.39707e-05 -3.53988 63.546000 Cu 0.82606 0.783693 0.5 124 63.546 8.29097e-06 -3.53992 63.546000 Cu 0.922074 0.788485 1.69746e-16 126 63.546 0.000104624 -3.5398 63.546000 Cu 0.998771 0.817392 1.27669e-16 127 63.546 7.28461e-05 -3.53986 63.546000 Cu 0.902716 0.8126 0.5 129 63.546 9.16427e-06 -3.53978 63.546000 Cu 0.191087 0.827059 4.80186e-19 132 63.546 5.82638e-05 -3.54017 63.546000 Cu 0.0756311 0.846286 3.00116e-19 150 63.546 0.000118349 -3.53951 63.546000 Cu 0.0563015 0.870374 0.5 151 63.546 0.000546252 -3.53881 63.546000 Cu 0.152472 0.875154 4.71182e-17 152 63.546 0.000479621 -3.53969 63.546000 Cu 0.17186 0.851126 0.5 153 63.546 5.09224e-05 -3.5401 63.546000 Cu 0.248938 0.880033 0.5 157 63.546 0.000425215 -3.54074 63.546000 Cu 0.383412 0.836712 2.66683e-16 135 63.546 5.44307e-05 -3.53962 63.546000 Cu 0.287297 0.8319 0.5 137 63.546 8.35356e-05 -3.54002 63.546000 Cu 0.479507 0.841497 0.5 141 63.546 3.92419e-05 -3.53933 63.546000 Cu 0.268102 0.855986 1.78629e-16 154 63.546 0.000151743 -3.5406 63.546000 Cu 0.364304 0.860831 0.5 156 63.546 0.000218353 -3.54024 63.546000 Cu 0.460314 0.865624 0 158 63.546 0.000208282 -3.53916 63.546000 Cu 0.575631 0.846286 4.37569e-17 139 63.546 0.000118349 -3.53951 63.546000 Cu 0.691087 0.827059 1.20046e-19 142 63.546 5.82638e-05 -3.54017 63.546000 Cu 0.67186 0.851126 0.5 145 63.546 5.09224e-05 -3.5401 63.546000 Cu 0.556302 0.870374 0.5 160 63.546 0.000546252 -3.53881 63.546000 Cu 0.652472 0.875154 2.94114e-17 162 63.546 0.000479621 -3.53969 63.546000 Cu 0.748938 0.880033 0.5 164 63.546 0.000425215 -3.54074 63.546000 Cu 0.768102 0.855986 7.08874e-17 143 63.546 0.000151743 -3.5406 63.546000 Cu 0.787297 0.8319 0.5 144 63.546 8.35356e-05 -3.54002 63.546000 Cu 0.883412 0.836712 1 146 63.546 5.44307e-05 -3.53962 63.546000 Cu 0.960314 0.865624 1.51859e-17 147 63.546 0.000208282 -3.53916 63.546000 Cu 0.979507 0.841497 0.5 148 63.546 3.92419e-05 -3.53933 63.546000 Cu 0.864304 0.860831 0.5 149 63.546 0.000218353 -3.54024 63.546000 Cu 0.0370103 0.894548 2.21005e-16 170 63.546 0.00125341 -3.53905 63.546000 Cu 0.114061 0.923302 5.39008e-17 171 63.546 0.00978939 -3.53442 63.546000 Cu 0.132963 0.899181 0.5 172 63.546 0.00317836 -3.53865 63.546000 Cu 0.018357 0.918893 0.5 173 63.546 0.0053306 -3.54297 63.546000 Cu 0.229435 0.90397 0 174 63.546 0.00193515 -3.53831 63.546000 Cu 0.20968 0.927917 0.5 177 63.546 0.0170835 -3.53157 63.546000 Cu 0.345341 0.884972 1 155 63.546 0.00148853 -3.541 63.546000 Cu 0.441339 0.889847 0.5 161 63.546 0.000985658 -3.54043 63.546000 Cu 0.305332 0.932902 1 175 63.546 0.00834828 -3.53824 63.546000 Cu 0.325988 0.909016 0.5 176 63.546 0.0022346 -3.54032 63.546000 Cu 0.422304 0.914115 3.51736e-17 178 63.546 0.00836509 -3.54403 63.546000 Cu 0.402868 0.938086 0.5 181 63.546 0.0269176 -3.54688 63.546000 Cu 0.53701 0.894548 2.50297e-17 159 63.546 0.00125341 -3.53905 63.546000 Cu 0.729435 0.90397 1 163 63.546 0.00193515 -3.53831 63.546000 Cu 0.632963 0.899181 0.5 165 63.546 0.00317836 -3.53865 63.546000 Cu 0.518357 0.918893 0.5 180 63.546 0.0053306 -3.54297 63.546000 Cu 0.614061 0.923302 1.19446e-17 182 63.546 0.00978939 -3.53442 63.546000 Cu 0.70968 0.927917 0.5 184 63.546 0.0170835 -3.53157 63.546000 Cu 0.845341 0.884972 7.80302e-19 166 63.546 0.00148853 -3.541 63.546000 Cu 0.922304 0.914115 2.22086e-18 167 63.546 0.00836509 -3.54403 63.546000 Cu 0.941339 0.889847 0.5 168 63.546 0.000985658 -3.54043 63.546000 Cu 0.825988 0.909016 0.5 169 63.546 0.0022346 -3.54032 63.546000 Cu 0.805332 0.932902 6.00232e-19 186 63.546 0.00834828 -3.53824 63.546000 Cu 0.902868 0.938086 0.5 188 63.546 0.0269176 -3.54688 63.546000 Cu 0.0801344 0.973384 1.32291e-16 191 63.546 0.768562 -3.42412 63.546000 Cu 0.0969053 0.947883 0.5 192 63.546 0.0709284 -3.51661 63.546000 Cu 0.188902 0.952207 4.84387e-17 194 63.546 0.0954733 -3.5077 63.546000 Cu 0.166686 0.978503 0.5 197 63.546 0.520834 -3.47422 63.546000 Cu 0.000993478 0.943141 1 190 63.546 0.0484263 -3.54359 63.546000 Cu 0.261476 0.980293 0 195 63.546 0.58553 -3.5046 63.546000 Cu 0.283473 0.9569 0.5 196 63.546 0.122443 -3.54252 63.546000 Cu 0.382507 0.961184 1 198 63.546 0.0679698 -3.52599 63.546000 Cu 0.465676 0.988641 1.09842e-17 199 63.546 9.25646 -3.29237 63.546000 Cu 0.485177 0.966595 0.5 200 63.546 0.705333 -3.45948 63.546000 Cu 0.367318 0.983764 0.5 201 63.546 3.70554 -3.44652 63.546000 Cu 0.500993 0.943141 1.32051e-17 179 63.546 0.0484263 -3.54359 63.546000 Cu 0.688902 0.952207 6.05034e-17 183 63.546 0.0954733 -3.5077 63.546000 Cu 0.596905 0.947883 0.5 185 63.546 0.0709284 -3.51661 63.546000 Cu 0.580134 0.973384 1.14044e-18 202 63.546 0.768562 -3.42412 63.546000 Cu 0.666686 0.978503 0.5 204 63.546 0.520834 -3.47422 63.546000 Cu 0.882507 0.961184 9.41164e-17 187 63.546 0.0679698 -3.52599 63.546000 Cu 0.783473 0.9569 0.5 189 63.546 0.122443 -3.54252 63.546000 Cu 0.985177 0.966595 0.5 193 63.546 0.705333 -3.45948 63.546000 Cu 0.761476 0.980293 5.40209e-19 206 63.546 0.58553 -3.5046 63.546000 Cu 0.867318 0.983764 0.5 207 63.546 3.70554 -3.44652 63.546000 Cu 0.965676 0.988641 6.4705e-17 208 63.546 9.25646 -3.29237