Number of particles = 407 A = 1 Angstrom (basic length-scale) H0(1,1) = 16.1866 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 96.9183 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.92019 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 0.00801418 0.00470836 1.24456e-16 210 63.546 2.58692 -5.70771 63.546000 Cu 0.12517 0.00471608 0.5 212 63.546 8.93603 -5.58614 63.546000 Cu 0.0246574 0.0255592 0.5 219 63.546 0.842167 -5.64629 63.546000 Cu 0.149905 0.0224093 0 221 63.546 4.07675 -5.59228 63.546000 Cu 0.267795 0.0177946 0.5 223 63.546 10.5544 -5.44214 63.546000 Cu 0.381785 0.00473378 7.68862e-17 225 63.546 9.00487 -5.4308 63.546000 Cu 0.416269 0.0285506 0.5 228 63.546 0.732414 -5.61895 63.546000 Cu 0.625126 0.00471474 2.5555e-17 207 63.546 8.94238 -5.58644 63.546000 Cu 0.64989 0.0224091 0.5 209 63.546 4.07845 -5.59235 63.546000 Cu 0.524644 0.0255655 3.0583e-16 226 63.546 0.843419 -5.6464 63.546000 Cu 0.507985 0.00471163 0.5 227 63.546 2.58859 -5.70766 63.546000 Cu 0.767786 0.0177887 1 208 63.546 10.5524 -5.4421 63.546000 Cu 0.881776 0.00472939 0.5 211 63.546 9.00788 -5.43175 63.546000 Cu 0.916286 0.0285394 1 217 63.546 0.734323 -5.61909 63.546000 Cu 0.0589584 0.045201 5.53138e-19 218 63.546 0.112047 -5.75441 63.546000 Cu 0.177268 0.0410239 0.5 224 63.546 0.174431 -5.73237 63.546000 Cu 0.0901703 0.0648193 0.5 237 63.546 0.0223542 -5.76392 63.546000 Cu 0.210129 0.0595151 1.10628e-19 239 63.546 0.0440914 -5.76083 63.546000 Cu 0.302589 0.0347371 2.34752e-16 222 63.546 0.669535 -5.63574 63.546000 Cu 0.327734 0.0543834 0.5 241 63.546 0.0660468 -5.7608 63.546000 Cu 0.443282 0.0498341 1.65167e-16 243 63.546 0.0698585 -5.75166 63.546000 Cu 0.677303 0.0410196 1 213 63.546 0.17383 -5.73223 63.546000 Cu 0.710193 0.0595061 0.5 216 63.546 0.0450149 -5.76079 63.546000 Cu 0.590218 0.0648118 5.53138e-20 244 63.546 0.0219012 -5.76385 63.546000 Cu 0.558975 0.0452032 0.5 245 63.546 0.111796 -5.75439 63.546000 Cu 0.802619 0.0347267 0.5 215 63.546 0.670866 -5.63592 63.546000 Cu 0.827782 0.0543736 1 214 63.546 0.0669376 -5.76076 63.546000 Cu 0.943301 0.0498278 0.5 220 63.546 0.0692558 -5.75159 63.546000 Cu 0.121395 0.0840153 2.21255e-19 236 63.546 0.0047303 -5.7692 63.546000 Cu 0.00306925 0.0890883 0.5 238 63.546 0.00417708 -5.76878 63.546000 Cu 0.239117 0.0790238 0.5 242 63.546 0.00736126 -5.76951 63.546000 Cu 0.47289 0.0695425 0.5 246 63.546 0.00890826 -5.76868 63.546000 Cu 0.356054 0.0742612 0 240 63.546 0.00270174 -5.76935 63.546000 Cu 0.26834 0.098679 6.86444e-17 257 63.546 0.000322322 -5.7698 63.546000 Cu 0.385596 0.0938635 0.5 259 63.546 0.00131344 -5.76949 63.546000 Cu 0.621454 0.0840041 0.5 230 63.546 0.00513692 -5.76919 63.546000 Cu 0.503126 0.0890768 5.53138e-20 261 63.546 0.00388458 -5.76877 63.546000 Cu 0.739159 0.079017 1.88897e-16 231 63.546 0.00769692 -5.76949 63.546000 Cu 0.97287 0.0695468 0 235 63.546 0.00909822 -5.7687 63.546000 Cu 0.885551 0.0938724 0 232 63.546 0.00146909 -5.76951 63.546000 Cu 0.856071 0.0742596 0.5 233 63.546 0.00263943 -5.76935 63.546000 Cu 0.76833 0.0986821 0.5 234 63.546 0.000322554 -5.76982 63.546000 Cu 0.150999 0.103529 0.5 255 63.546 0.00127836 -5.76989 63.546000 Cu 0.0332781 0.10846 3.7724e-17 253 63.546 0.000605979 -5.76969 63.546000 Cu 0.180506 0.123098 7.50608e-17 254 63.546 0.000102636 -5.76984 63.546000 Cu 0.0631405 0.12798 0.5 256 63.546 0.000292291 -5.76987 63.546000 Cu 0.415592 0.113407 0 258 63.546 0.000641546 -5.7695 63.546000 Cu 0.298002 0.118252 0.5 260 63.546 0.000199949 -5.76975 63.546000 Cu 0.32781 0.137789 0 275 63.546 0.000157074 -5.7697 63.546000 Cu 0.445495 0.132876 0.5 277 63.546 0.000119997 -5.76978 63.546000 Cu 0.651033 0.103526 2.42385e-16 229 63.546 0.00136099 -5.7699 63.546000 Cu 0.680494 0.123107 0.5 248 63.546 8.92353e-05 -5.76986 63.546000 Cu 0.533347 0.108451 0.5 262 63.546 0.000717971 -5.76971 63.546000 Cu 0.56316 0.127981 0 279 63.546 0.000311634 -5.76988 63.546000 Cu 0.797954 0.118264 5.53138e-20 249 63.546 0.00029288 -5.76975 63.546000 Cu 0.945462 0.132882 0 250 63.546 8.98054e-05 -5.76975 63.546000 Cu 0.91552 0.113418 0.5 251 63.546 0.000755015 -5.7695 63.546000 Cu 0.827761 0.1378 0.5 252 63.546 0.000212766 -5.76969 63.546000 Cu 0.00508772 0.171935 0 268 63.546 1.25448e-05 -5.76978 63.546000 Cu 0.0927441 0.147521 2.61634e-17 271 63.546 6.34132e-05 -5.7698 63.546000 Cu 0.240168 0.162186 7.03039e-17 272 63.546 1.52408e-05 -5.76972 63.546000 Cu 0.210284 0.142655 0.5 273 63.546 6.45946e-05 -5.76979 63.546000 Cu 0.122631 0.167067 0.5 274 63.546 1.22651e-05 -5.76976 63.546000 Cu 0.475244 0.152403 1 276 63.546 7.12276e-05 -5.76982 63.546000 Cu 0.357752 0.157288 0.5 278 63.546 5.37016e-05 -5.76979 63.546000 Cu 0.710221 0.142666 0 247 63.546 0.000112362 -5.76979 63.546000 Cu 0.622565 0.167077 0 263 63.546 2.8925e-05 -5.76976 63.546000 Cu 0.592675 0.147529 0.5 280 63.546 0.000108508 -5.76982 63.546000 Cu 0.505069 0.171948 0.5 295 63.546 1.08092e-05 -5.76978 63.546000 Cu 0.740078 0.162193 0.5 265 63.546 4.44889e-05 -5.76971 63.546000 Cu 0.857708 0.15729 2.26234e-17 267 63.546 5.06447e-05 -5.76978 63.546000 Cu 0.975264 0.1524 0.5 269 63.546 6.67976e-05 -5.76981 63.546000 Cu 0.0349959 0.191476 0.5 287 63.546 6.60832e-06 -5.76977 63.546000 Cu 0.152527 0.186596 0 289 63.546 1.34552e-05 -5.76977 63.546000 Cu 0.182344 0.206142 0.5 292 63.546 3.31399e-05 -5.7698 63.546000 Cu 0.299891 0.201246 1.11015e-16 290 63.546 9.11568e-06 -5.76979 63.546000 Cu 0.270064 0.181715 0.5 291 63.546 5.88746e-06 -5.76981 63.546000 Cu 0.3876 0.176825 7.29589e-17 293 63.546 1.44357e-05 -5.76979 63.546000 Cu 0.417428 0.196367 0.5 296 63.546 3.6719e-06 -5.76978 63.546000 Cu 0.652513 0.186608 0.5 266 63.546 1.97254e-05 -5.76977 63.546000 Cu 0.682342 0.206148 0 281 63.546 3.52586e-05 -5.7698 63.546000 Cu 0.534991 0.191489 0 294 63.546 1.03009e-05 -5.76976 63.546000 Cu 0.770034 0.181718 5.52585e-17 264 63.546 6.62069e-06 -5.76981 63.546000 Cu 0.887573 0.176817 0.5 270 63.546 2.34299e-05 -5.76979 63.546000 Cu 0.799912 0.201245 0.5 283 63.546 1.10352e-05 -5.76979 63.546000 Cu 0.917442 0.196359 1.67546e-16 285 63.546 4.64487e-06 -5.7698 63.546000 Cu 0.0648434 0.211019 0 286 63.546 3.65964e-06 -5.76981 63.546000 Cu 0.0946629 0.230561 0.5 305 63.546 4.54894e-05 -5.76975 63.546000 Cu 0.212242 0.225663 2.32318e-17 307 63.546 7.41256e-06 -5.76977 63.546000 Cu 0.35965 0.240312 0 308 63.546 2.67247e-05 -5.76978 63.546000 Cu 0.329769 0.22078 0.5 309 63.546 1.1138e-05 -5.76977 63.546000 Cu 0.447301 0.215901 0 311 63.546 8.23207e-06 -5.76977 63.546000 Cu 0.477101 0.235447 0.5 314 63.546 3.98154e-05 -5.7698 63.546000 Cu 0.712231 0.225665 0.5 284 63.546 1.07083e-05 -5.76979 63.546000 Cu 0.594631 0.230564 7.04698e-17 312 63.546 3.7021e-05 -5.76976 63.546000 Cu 0.564823 0.211025 0.5 313 63.546 3.87127e-06 -5.7698 63.546000 Cu 0.829774 0.220782 3.76134e-18 282 63.546 1.17311e-05 -5.76979 63.546000 Cu 0.94733 0.215899 0.5 288 63.546 1.10694e-05 -5.76979 63.546000 Cu 0.859634 0.240312 0.5 301 63.546 1.56561e-05 -5.7698 63.546000 Cu 0.977119 0.235446 1.30707e-16 303 63.546 5.2738e-05 -5.76979 63.546000 Cu 0.124623 0.250079 0 304 63.546 1.68422e-05 -5.76975 63.546000 Cu 0.00705425 0.254964 0.5 306 63.546 2.43778e-05 -5.76971 63.546000 Cu 0.242168 0.245193 0.5 310 63.546 4.00031e-05 -5.76975 63.546000 Cu 0.0370849 0.2745 1.10628e-19 321 63.546 2.16644e-05 -5.76971 63.546000 Cu 0.154613 0.269612 0.5 323 63.546 5.29813e-05 -5.76972 63.546000 Cu 0.272073 0.264743 0 325 63.546 5.48255e-06 -5.76977 63.546000 Cu 0.389526 0.259872 0.5 327 63.546 5.15677e-05 -5.76975 63.546000 Cu 0.654541 0.26963 2.87079e-17 297 63.546 1.68636e-05 -5.76978 63.546000 Cu 0.624565 0.250088 0.5 298 63.546 2.0713e-05 -5.7698 63.546000 Cu 0.507043 0.254978 3.87197e-18 329 63.546 2.59008e-05 -5.76975 63.546000 Cu 0.537062 0.274531 0.5 330 63.546 1.39202e-05 -5.76978 63.546000 Cu 0.742112 0.245197 1.86684e-16 299 63.546 2.19089e-05 -5.76978 63.546000 Cu 0.889474 0.25986 3.69496e-17 300 63.546 8.11398e-05 -5.76974 63.546000 Cu 0.771982 0.264743 0.5 302 63.546 3.58927e-05 -5.7698 63.546000 Cu 0.184544 0.289177 7.41205e-17 322 63.546 2.86255e-05 -5.76975 63.546000 Cu 0.0671051 0.294036 0.5 324 63.546 4.24625e-05 -5.76973 63.546000 Cu 0.214504 0.308714 0.5 341 63.546 4.63616e-05 -5.76976 63.546000 Cu 0.419579 0.279412 5.26034e-17 326 63.546 1.63323e-05 -5.76975 63.546000 Cu 0.302046 0.284302 0.5 328 63.546 2.66332e-05 -5.76971 63.546000 Cu 0.332015 0.303838 0 343 63.546 5.43815e-05 -5.7698 63.546000 Cu 0.44953 0.298966 0.5 345 63.546 6.13483e-05 -5.76979 63.546000 Cu 0.714572 0.308702 0 315 63.546 7.80602e-05 -5.7697 63.546000 Cu 0.684502 0.289192 0.5 316 63.546 0.000115147 -5.76977 63.546000 Cu 0.567041 0.294075 8.34132e-17 347 63.546 4.64006e-05 -5.7698 63.546000 Cu 0.802017 0.28429 4.03238e-17 317 63.546 4.51572e-05 -5.76969 63.546000 Cu 0.949645 0.298921 1 318 63.546 6.40616e-05 -5.7697 63.546000 Cu 0.919557 0.279382 0.5 319 63.546 2.05991e-05 -5.7697 63.546000 Cu 0.832145 0.303802 0.5 320 63.546 9.04503e-05 -5.76971 63.546000 Cu 0.00922193 0.337995 1.14666e-16 336 63.546 6.85928e-05 -5.76983 63.546000 Cu 0.0970036 0.313592 0 339 63.546 5.07383e-05 -5.76978 63.546000 Cu 0.244242 0.328255 1.39391e-17 340 63.546 7.07795e-05 -5.76988 63.546000 Cu 0.126749 0.333125 0.5 342 63.546 8.94253e-05 -5.76985 63.546000 Cu 0.479289 0.318499 0 344 63.546 8.36244e-05 -5.76985 63.546000 Cu 0.361743 0.323381 0.5 346 63.546 5.25314e-05 -5.76987 63.546000 Cu 0.391257 0.342925 0 361 63.546 0.000207713 -5.7699 63.546000 Cu 0.626731 0.333094 1.10628e-19 331 63.546 6.09987e-05 -5.76974 63.546000 Cu 0.596902 0.313611 0.5 348 63.546 0.000137388 -5.76977 63.546000 Cu 0.508947 0.338014 0.5 363 63.546 0.000125723 -5.76981 63.546000 Cu 0.74444 0.328197 0.5 333 63.546 0.00013892 -5.76973 63.546000 Cu 0.862061 0.323317 5.53138e-20 335 63.546 0.000174291 -5.76974 63.546000 Cu 0.979555 0.318451 0.5 337 63.546 8.61529e-05 -5.76979 63.546000 Cu 0.89167 0.342849 0.5 338 63.546 6.53007e-05 -5.76981 63.546000 Cu 0.067923 0.37708 0 354 63.546 5.26086e-05 -5.76991 63.546000 Cu 0.0386862 0.357533 0.5 355 63.546 6.81489e-05 -5.76989 63.546000 Cu 0.156208 0.352676 0 357 63.546 4.36687e-05 -5.76992 63.546000 Cu 0.185507 0.372232 0.5 360 63.546 0.000123301 -5.76993 63.546000 Cu 0.303019 0.36736 1.16491e-16 358 63.546 0.000451218 -5.76991 63.546000 Cu 0.273718 0.347809 0.5 359 63.546 7.05402e-05 -5.76993 63.546000 Cu 0.420752 0.362428 0.5 364 63.546 0.000221059 -5.76981 63.546000 Cu 0.656369 0.352573 0.5 334 63.546 0.000133158 -5.76972 63.546000 Cu 0.685928 0.372047 0 349 63.546 0.000425628 -5.76965 63.546000 Cu 0.538572 0.357485 1.88067e-18 362 63.546 3.90897e-05 -5.76975 63.546000 Cu 0.568124 0.376934 0.5 381 63.546 0.000230225 -5.76962 63.546000 Cu 0.774096 0.347697 0 332 63.546 0.000183748 -5.76974 63.546000 Cu 0.803514 0.36722 0.5 351 63.546 8.59367e-05 -5.76978 63.546000 Cu 0.921104 0.362381 0 353 63.546 5.07625e-05 -5.76984 63.546000 Cu 0.0970686 0.396622 0.5 373 63.546 0.000362912 -5.7699 63.546000 Cu 0.214548 0.391797 1.84195e-16 375 63.546 0.00095968 -5.7699 63.546000 Cu 0.243591 0.411309 0.5 378 63.546 0.00266108 -5.7695 63.546000 Cu 0.361768 0.406291 0 376 63.546 0.000701069 -5.76951 63.546000 Cu 0.332339 0.386858 0.5 377 63.546 0.000613144 -5.76977 63.546000 Cu 0.450228 0.38188 5.53138e-20 379 63.546 9.62535e-05 -5.76968 63.546000 Cu 0.479817 0.401289 0.5 382 63.546 0.000584444 -5.76942 63.546000 Cu 0.715201 0.391558 0.5 352 63.546 0.000256445 -5.76973 63.546000 Cu 0.597693 0.396363 6.13983e-18 380 63.546 0.0015307 -5.76939 63.546000 Cu 0.744181 0.411107 0 367 63.546 0.000271638 -5.76985 63.546000 Cu 0.832749 0.386744 0 350 63.546 8.3331e-05 -5.76984 63.546000 Cu 0.950354 0.381918 0.5 356 63.546 8.38114e-05 -5.76988 63.546000 Cu 0.861665 0.406276 0.5 369 63.546 0.000105449 -5.76986 63.546000 Cu 0.979348 0.401449 7.24058e-17 371 63.546 0.000132399 -5.76985 63.546000 Cu 0.125638 0.416235 5.53138e-18 372 63.546 0.00265324 -5.76967 63.546000 Cu 0.00828556 0.420963 0.5 374 63.546 0.00310985 -5.76937 63.546000 Cu 0.0360269 0.440758 1 389 63.546 0.0136491 -5.76788 63.546000 Cu 0.153828 0.435755 0.5 391 63.546 0.0117063 -5.76696 63.546000 Cu 0.27282 0.430679 0 393 63.546 0.00505693 -5.76803 63.546000 Cu 0.422799 0.444821 0 394 63.546 0.0405421 -5.76091 63.546000 Cu 0.391659 0.425642 0.5 395 63.546 0.00311935 -5.76856 63.546000 Cu 0.655952 0.435524 2.06099e-16 365 63.546 0.00133273 -5.76964 63.546000 Cu 0.626984 0.415892 0.5 366 63.546 0.00130519 -5.76958 63.546000 Cu 0.50985 0.420645 0 397 63.546 0.00697944 -5.76837 63.546000 Cu 0.539642 0.44027 0.5 398 63.546 0.00570387 -5.76864 63.546000 Cu 0.890438 0.425786 7.11336e-17 368 63.546 0.00183572 -5.76959 63.546000 Cu 0.772922 0.430706 0.5 370 63.546 0.00208353 -5.76981 63.546000 Cu 0.919885 0.445183 0.5 387 63.546 0.0429729 -5.76488 63.546000 Cu 0.182048 0.454997 0 390 63.546 0.036189 -5.75744 63.546000 Cu 0.0627647 0.460581 0.5 392 63.546 0.0742376 -5.76118 63.546000 Cu 0.089155 0.480289 5.29353e-17 403 63.546 0.355272 -5.72465 63.546000 Cu 0.209526 0.473776 0.5 405 63.546 0.196799 -5.70513 63.546000 Cu 0.452917 0.464601 0.5 203 63.546 0.0865081 -5.7522 63.546000 Cu 0.302384 0.449802 0.5 396 63.546 0.0213538 -5.76053 63.546000 Cu 0.334167 0.468278 1.82093e-16 407 63.546 0.217014 -5.73139 63.546000 Cu 0.59649 0.480674 0.5 2 63.546 0.35335 -5.72976 63.546000 Cu 0.568624 0.460139 1.88067e-18 4 63.546 0.0225075 -5.76439 63.546000 Cu 0.713347 0.474528 1.84195e-17 383 63.546 0.169966 -5.73081 63.546000 Cu 0.684802 0.45525 0.5 384 63.546 0.0259427 -5.76479 63.546000 Cu 0.802067 0.45024 0 385 63.546 0.0148708 -5.7692 63.546000 Cu 0.946867 0.465455 0 386 63.546 0.03737 -5.75429 63.546000 Cu 0.835424 0.469424 0.5 388 63.546 0.300289 -5.72327 63.546000 Cu 0.216702 0.517139 7.22952e-17 3 63.546 11.4189 -5.42704 63.546000 Cu 0.239086 0.490852 0 404 63.546 10.2569 -5.52214 63.546000 Cu 0.129596 0.500339 0.5 406 63.546 9.06574 -5.24683 63.546000 Cu 0.00317538 0.505529 9.34804e-18 1 63.546 12.7335 -5.49846 63.546000 Cu 0.374511 0.505124 1.54768e-16 6 63.546 9.04104 -5.56782 63.546000 Cu 0.360243 0.487151 0.5 9 63.546 3.35583 -5.59798 63.546000 Cu 0.48374 0.484766 1.50011e-16 206 63.546 0.568738 -5.72062 63.546000 Cu 0.50096 0.505993 0.5 8 63.546 5.58336 -5.56244 63.546000 Cu 0.629932 0.500469 1.65941e-19 399 63.546 9.19113 -5.26265 63.546000 Cu 0.74651 0.491972 0.5 400 63.546 9.05006 -5.33862 63.546000 Cu 0.860148 0.490607 1.10628e-19 401 63.546 6.34709 -5.45344 63.546000 Cu 0.97684 0.485866 0.5 402 63.546 2.88111 -5.60226 63.546000 Cu 0.0734525 0.530518 1.65941e-19 17 63.546 2.9545 -5.50184 63.546000 Cu 0.192414 0.535724 0.5 19 63.546 1.36867 -5.61721 63.546000 Cu 0.0439073 0.549277 0.5 20 63.546 0.0546806 -5.76291 63.546000 Cu 0.341516 0.522304 0.5 5 63.546 4.44787 -5.53812 63.546000 Cu 0.465322 0.526939 6.91423e-17 7 63.546 1.71314 -5.53396 63.546000 Cu 0.31274 0.540963 0 21 63.546 0.0326372 -5.76025 63.546000 Cu 0.430142 0.54585 0.5 24 63.546 0.0326976 -5.76375 63.546000 Cu 0.714483 0.517357 0.5 11 63.546 16.7503 -5.31808 63.546000 Cu 0.69496 0.535762 1.53219e-17 10 63.546 1.50167 -5.61628 63.546000 Cu 0.576007 0.531229 0.5 12 63.546 2.89043 -5.493 63.546000 Cu 0.550264 0.550833 0 25 63.546 0.0441672 -5.76066 63.546000 Cu 0.840954 0.518901 7.13548e-17 13 63.546 11.251 -5.3499 63.546000 Cu 0.926952 0.544212 1.46416e-16 14 63.546 0.0465101 -5.76025 63.546000 Cu 0.95775 0.524203 0.5 15 63.546 5.632 -5.43831 63.546000 Cu 0.814251 0.539424 0.5 16 63.546 0.19549 -5.75168 63.546000 Cu 0.16305 0.554913 3.30777e-17 18 63.546 0.00948735 -5.76764 63.546000 Cu 0.015771 0.569034 0 33 63.546 0.0119538 -5.76827 63.546000 Cu 0.133276 0.574136 0.5 35 63.546 0.00818907 -5.76755 63.546000 Cu 0.25218 0.579263 1.05096e-18 37 63.546 0.00125717 -5.76889 63.546000 Cu 0.281124 0.559942 0.5 22 63.546 0.00832644 -5.76761 63.546000 Cu 0.400813 0.56508 2.54997e-17 23 63.546 0.00232874 -5.76696 63.546000 Cu 0.370673 0.584292 0.5 40 63.546 0.000946159 -5.76889 63.546000 Cu 0.637522 0.574872 3.70603e-17 26 63.546 0.0149497 -5.76676 63.546000 Cu 0.666858 0.555246 0.5 27 63.546 0.0153496 -5.76487 63.546000 Cu 0.519324 0.570006 0.5 28 63.546 0.00377515 -5.76824 63.546000 Cu 0.754381 0.579389 0.5 32 63.546 0.00415738 -5.7683 63.546000 Cu 0.783225 0.559496 2.76569e-19 29 63.546 0.0155884 -5.76535 63.546000 Cu 0.870762 0.584054 1.65941e-19 30 63.546 0.00087935 -5.76956 63.546000 Cu 0.89937 0.564255 0.5 31 63.546 0.00521457 -5.76882 63.546000 Cu 0.104848 0.593652 8.00391e-17 34 63.546 0.00313447 -5.76955 63.546000 Cu 0.222783 0.598616 0.5 39 63.546 0.0023972 -5.76941 63.546000 Cu 0.0762876 0.613269 0.5 51 63.546 0.000501452 -5.76994 63.546000 Cu 0.193897 0.618128 1.55819e-16 53 63.546 0.00117019 -5.76983 63.546000 Cu 0.341136 0.603648 0 38 63.546 0.000586353 -5.76942 63.546000 Cu 0.489281 0.589323 0 41 63.546 0.000680805 -5.76883 63.546000 Cu 0.459361 0.608643 0.5 44 63.546 0.000301399 -5.76937 63.546000 Cu 0.577519 0.613624 1.65941e-19 42 63.546 0.00047893 -5.76936 63.546000 Cu 0.607314 0.594227 0.5 43 63.546 0.00225454 -5.76888 63.546000 Cu 0.72499 0.599045 1.57202e-16 45 63.546 0.00372314 -5.76882 63.546000 Cu 0.695323 0.618514 0.5 48 63.546 0.000948867 -5.76947 63.546000 Cu 0.987539 0.588798 0.5 36 63.546 0.00153642 -5.76967 63.546000 Cu 0.841981 0.603754 0.5 47 63.546 0.00108607 -5.7696 63.546000 Cu 0.959013 0.60847 4.85655e-17 49 63.546 0.000316657 -5.76989 63.546000 Cu 0.0476677 0.632872 3.4018e-17 50 63.546 0.000101875 -5.76995 63.546000 Cu 0.165223 0.637695 0.5 56 63.546 0.000246278 -5.76992 63.546000 Cu 0.0189355 0.652447 0.5 67 63.546 7.24528e-05 -5.76988 63.546000 Cu 0.282902 0.64258 0 54 63.546 0.000357704 -5.76984 63.546000 Cu 0.311792 0.623068 0.5 55 63.546 0.000965601 -5.76968 63.546000 Cu 0.429879 0.628051 1.88067e-17 57 63.546 0.000308386 -5.76963 63.546000 Cu 0.400717 0.647502 0.5 60 63.546 0.000372193 -5.76974 63.546000 Cu 0.518651 0.652451 8.62342e-17 58 63.546 0.00018501 -5.76968 63.546000 Cu 0.547906 0.633018 0.5 59 63.546 0.000138743 -5.76958 63.546000 Cu 0.6659 0.637956 8.19751e-17 61 63.546 0.00026725 -5.76957 63.546000 Cu 0.812929 0.623342 0 46 63.546 0.0012569 -5.76957 63.546000 Cu 0.930264 0.628095 0.5 52 63.546 0.000279653 -5.76983 63.546000 Cu 0.783703 0.642835 0.5 63 63.546 0.000567936 -5.76965 63.546000 Cu 0.901383 0.647658 9.98968e-17 65 63.546 0.000442089 -5.76975 63.546000 Cu 0.136501 0.657258 0 69 63.546 6.94096e-05 -5.7699 63.546000 Cu 0.22546 0.681647 1.9028e-16 70 63.546 0.000109961 -5.76982 63.546000 Cu 0.1078 0.676803 0.5 72 63.546 6.55378e-05 -5.76985 63.546000 Cu 0.254138 0.662111 0.5 71 63.546 0.000123352 -5.76986 63.546000 Cu 0.34323 0.686513 0.5 73 63.546 0.000111579 -5.76974 63.546000 Cu 0.371867 0.667003 0 74 63.546 0.000184792 -5.76979 63.546000 Cu 0.489707 0.671916 0.5 76 63.546 0.000216437 -5.76969 63.546000 Cu 0.636611 0.657383 0.5 64 63.546 0.000139503 -5.76962 63.546000 Cu 0.607684 0.676828 0 77 63.546 0.000132987 -5.76963 63.546000 Cu 0.725698 0.681734 0.5 79 63.546 5.56261e-05 -5.76962 63.546000 Cu 0.754585 0.662287 2.92057e-17 62 63.546 0.000178351 -5.76962 63.546000 Cu 0.99018 0.671984 0 66 63.546 0.000155067 -5.7698 63.546000 Cu 0.872461 0.667154 0.5 68 63.546 0.000265122 -5.7697 63.546000 Cu 0.843662 0.686619 2.93716e-17 81 63.546 7.19093e-05 -5.76966 63.546000 Cu 0.0792914 0.696339 0 85 63.546 6.16923e-05 -5.76979 63.546000 Cu 0.168551 0.720708 0 86 63.546 5.55959e-05 -5.7698 63.546000 Cu 0.196994 0.701174 0.5 87 63.546 1.70476e-05 -5.7698 63.546000 Cu 0.0507424 0.715853 0.5 88 63.546 9.20943e-05 -5.76977 63.546000 Cu 0.461113 0.691402 1.65941e-19 75 63.546 5.85857e-05 -5.76968 63.546000 Cu 0.314765 0.706027 1 89 63.546 5.04002e-05 -5.76977 63.546000 Cu 0.432625 0.7109 0.5 92 63.546 3.9782e-05 -5.76972 63.546000 Cu 0.69703 0.701192 2.99801e-17 78 63.546 3.09768e-05 -5.76965 63.546000 Cu 0.57907 0.696298 0.5 80 63.546 3.01079e-05 -5.76965 63.546000 Cu 0.550528 0.715785 0 93 63.546 2.98755e-05 -5.76971 63.546000 Cu 0.668432 0.720679 0.5 95 63.546 1.67093e-05 -5.76972 63.546000 Cu 0.932896 0.71098 1.67214e-16 82 63.546 4.60813e-05 -5.76972 63.546000 Cu 0.961531 0.691488 0.5 83 63.546 0.0001183 -5.76973 63.546000 Cu 0.814985 0.706089 0.5 84 63.546 1.21144e-05 -5.76968 63.546000 Cu 0.0220814 0.735349 1.72966e-16 101 63.546 2.75352e-05 -5.76974 63.546000 Cu 0.139961 0.740219 0.5 103 63.546 5.21532e-05 -5.76977 63.546000 Cu 0.257793 0.745083 1.2335e-17 105 63.546 3.90214e-05 -5.76981 63.546000 Cu 0.286315 0.725555 0.5 90 63.546 7.37848e-06 -5.76981 63.546000 Cu 0.404108 0.73041 0 91 63.546 5.05275e-05 -5.76979 63.546000 Cu 0.375555 0.749939 0.5 108 63.546 2.47931e-06 -5.76982 63.546000 Cu 0.493288 0.754798 6.4164e-17 109 63.546 5.29495e-05 -5.76979 63.546000 Cu 0.639768 0.740176 1.10628e-19 94 63.546 6.52647e-06 -5.76975 63.546000 Cu 0.52194 0.735291 0.5 96 63.546 2.20037e-05 -5.76977 63.546000 Cu 0.757639 0.745068 0.5 100 63.546 4.0303e-06 -5.76974 63.546000 Cu 0.786298 0.725573 3.87197e-19 97 63.546 6.62202e-06 -5.76973 63.546000 Cu 0.875504 0.749952 1.63452e-16 98 63.546 1.21607e-05 -5.76975 63.546000 Cu 0.904179 0.730462 0.5 99 63.546 2.79053e-06 -5.76973 63.546000 Cu 0.993384 0.754831 0.5 104 63.546 2.00958e-05 -5.76974 63.546000 Cu 0.111311 0.75971 0 102 63.546 7.42913e-06 -5.76975 63.546000 Cu 0.22918 0.764596 0.5 107 63.546 5.14619e-05 -5.76977 63.546000 Cu 0.0826162 0.779209 0.5 119 63.546 1.70214e-05 -5.76977 63.546000 Cu 0.20051 0.784084 0 121 63.546 8.57954e-06 -5.76974 63.546000 Cu 0.346984 0.769464 2.76569e-19 106 63.546 3.21189e-05 -5.76979 63.546000 Cu 0.464749 0.774323 0.5 112 63.546 3.58872e-06 -5.76981 63.546000 Cu 0.318384 0.788975 0.5 123 63.546 6.38835e-05 -5.76975 63.546000 Cu 0.582514 0.779181 0 110 63.546 5.69292e-05 -5.76977 63.546000 Cu 0.611142 0.759675 0.5 111 63.546 2.72304e-05 -5.76976 63.546000 Cu 0.729015 0.764568 1.55045e-16 113 63.546 7.05738e-06 -5.76973 63.546000 Cu 0.700414 0.784054 0.5 116 63.546 3.80361e-05 -5.76972 63.546000 Cu 0.818325 0.788955 0 114 63.546 2.95362e-05 -5.76972 63.546000 Cu 0.846916 0.769454 0.5 115 63.546 6.68734e-06 -5.76974 63.546000 Cu 0.964786 0.774334 7.31249e-17 117 63.546 5.12001e-06 -5.76978 63.546000 Cu 0.054016 0.798711 1 118 63.546 1.42286e-05 -5.76979 63.546000 Cu 0.171794 0.803583 0.5 124 63.546 3.13352e-05 -5.76978 63.546000 Cu 0.0253267 0.818229 0.5 135 63.546 5.9817e-05 -5.76979 63.546000 Cu 0.143188 0.823085 5.53138e-20 137 63.546 3.3654e-05 -5.76981 63.546000 Cu 0.289691 0.808453 2.44487e-17 122 63.546 3.91553e-05 -5.76974 63.546000 Cu 0.436193 0.793848 1 125 63.546 7.29046e-05 -5.76978 63.546000 Cu 0.407595 0.813347 0.5 128 63.546 6.97069e-05 -5.76976 63.546000 Cu 0.525361 0.818221 2.21255e-19 126 63.546 5.86641e-05 -5.76981 63.546000 Cu 0.554001 0.798693 0.5 127 63.546 2.66517e-05 -5.76981 63.546000 Cu 0.671755 0.803556 2.4056e-16 129 63.546 6.87352e-05 -5.76978 63.546000 Cu 0.643177 0.823068 0.5 132 63.546 5.08447e-05 -5.76983 63.546000 Cu 0.936172 0.793846 0.5 120 63.546 5.08611e-05 -5.76975 63.546000 Cu 0.789638 0.808431 0.5 131 63.546 7.94174e-05 -5.76973 63.546000 Cu 0.907543 0.81334 1 133 63.546 4.68372e-05 -5.76975 63.546000 Cu 0.232241 0.847471 1.02441e-16 138 63.546 8.90753e-06 -5.7698 63.546000 Cu 0.11445 0.842602 0.5 140 63.546 1.94777e-05 -5.7698 63.546000 Cu 0.260967 0.827963 0.5 139 63.546 1.52767e-05 -5.76981 63.546000 Cu 0.350036 0.852341 0.5 141 63.546 2.20544e-05 -5.7698 63.546000 Cu 0.378821 0.832834 3.74475e-17 142 63.546 2.58856e-05 -5.76978 63.546000 Cu 0.467885 0.85723 1.65941e-19 143 63.546 2.49311e-05 -5.76981 63.546000 Cu 0.496676 0.837729 0.5 144 63.546 6.17578e-05 -5.76981 63.546000 Cu 0.614429 0.842592 0 145 63.546 1.00538e-05 -5.76982 63.546000 Cu 0.732202 0.847456 0.5 147 63.546 1.32993e-05 -5.7698 63.546000 Cu 0.760907 0.827943 7.24611e-18 130 63.546 3.78644e-05 -5.76982 63.546000 Cu 0.996648 0.837728 9.22634e-17 134 63.546 5.98664e-05 -5.76978 63.546000 Cu 0.87876 0.832823 0.5 136 63.546 3.19692e-05 -5.76975 63.546000 Cu 0.84998 0.852321 2.55329e-16 149 63.546 4.95518e-05 -5.76979 63.546000 Cu 0.967849 0.857219 0.5 151 63.546 1.44216e-05 -5.76978 63.546000 Cu 0.0856952 0.862098 1 153 63.546 9.81465e-06 -5.7698 63.546000 Cu 0.174683 0.886478 1.10628e-19 154 63.546 8.43293e-05 -5.76982 63.546000 Cu 0.20347 0.866971 0.5 155 63.546 2.83113e-06 -5.7698 63.546000 Cu 0.0569137 0.881602 0.5 156 63.546 6.56894e-05 -5.76979 63.546000 Cu 0.321241 0.871837 3.67837e-17 157 63.546 4.83021e-05 -5.76978 63.546000 Cu 0.292448 0.891336 0.5 158 63.546 0.000163447 -5.76979 63.546000 Cu 0.439112 0.876743 0.5 160 63.546 0.000123579 -5.76976 63.546000 Cu 0.410226 0.896202 5.53138e-20 159 63.546 0.000275058 -5.76962 63.546000 Cu 0.703447 0.866958 0 146 63.546 1.26834e-05 -5.76981 63.546000 Cu 0.585708 0.862099 0.5 148 63.546 1.11857e-05 -5.76982 63.546000 Cu 0.556977 0.881615 0 161 63.546 0.000101303 -5.76981 63.546000 Cu 0.674705 0.886478 0.5 163 63.546 8.22852e-05 -5.76984 63.546000 Cu 0.939043 0.876722 7.22952e-17 150 63.546 6.63273e-05 -5.76976 63.546000 Cu 0.821195 0.871817 0.5 152 63.546 9.00229e-05 -5.76978 63.546000 Cu 0.792416 0.891323 5.53138e-20 165 63.546 0.000225974 -5.76981 63.546000 Cu 0.910151 0.896183 0.5 167 63.546 0.00038675 -5.76964 63.546000 Cu 0.0282339 0.901094 1.21469e-16 169 63.546 0.000422568 -5.76955 63.546000 Cu 0.117666 0.925502 8.96084e-17 170 63.546 0.00412311 -5.76877 63.546000 Cu 0.146172 0.906014 0.5 171 63.546 0.000794429 -5.76969 63.546000 Cu 0.235675 0.930483 0.5 175 63.546 0.00650024 -5.7691 63.546000 Cu 0.263875 0.910873 1.55764e-16 173 63.546 0.000249132 -5.76984 63.546000 Cu 0.381431 0.915689 0.5 176 63.546 0.00103685 -5.76969 63.546000 Cu 0.499168 0.920487 1 177 63.546 0.002794 -5.76904 63.546000 Cu 0.64624 0.906026 2.32318e-18 162 63.546 0.000991517 -5.7697 63.546000 Cu 0.528318 0.901113 0.5 164 63.546 0.000544347 -5.76955 63.546000 Cu 0.617732 0.925513 0.5 179 63.546 0.00446045 -5.76875 63.546000 Cu 0.735734 0.930492 0 181 63.546 0.00698964 -5.76909 63.546000 Cu 0.763894 0.910874 0.5 168 63.546 0.0002281 -5.76984 63.546000 Cu 0.881409 0.915682 1.08249e-16 166 63.546 0.0010534 -5.76972 63.546000 Cu 0.999108 0.920475 0.5 172 63.546 0.00305009 -5.7691 63.546000 Cu 0.0875906 0.944684 0.5 187 63.546 0.0214501 -5.76498 63.546000 Cu 0.207795 0.949957 4.35873e-17 189 63.546 0.0428207 -5.75948 63.546000 Cu 0.0574095 0.964269 0 186 63.546 0.108982 -5.75682 63.546000 Cu 0.35289 0.935258 0 174 63.546 0.00277283 -5.76947 63.546000 Cu 0.470041 0.939981 0.5 180 63.546 0.00810926 -5.76915 63.546000 Cu 0.325627 0.955101 0.5 191 63.546 0.064534 -5.75962 63.546000 Cu 0.441544 0.959646 1.39833e-16 193 63.546 0.0704517 -5.75285 63.546000 Cu 0.587612 0.944686 1.00229e-16 178 63.546 0.0212849 -5.76484 63.546000 Cu 0.707838 0.949963 0.5 184 63.546 0.0436164 -5.75946 63.546000 Cu 0.557371 0.964261 0.5 195 63.546 0.109757 -5.75675 63.546000 Cu 0.82567 0.955111 2.84866e-17 182 63.546 0.0653256 -5.75967 63.546000 Cu 0.852924 0.935263 0.5 183 63.546 0.0026125 -5.76947 63.546000 Cu 0.970049 0.939983 0 185 63.546 0.00789378 -5.7692 63.546000 Cu 0.941581 0.959656 0.5 188 63.546 0.0693795 -5.75288 63.546000 Cu 0.175858 0.968455 0.5 192 63.546 0.172118 -5.73379 63.546000 Cu 0.0240262 0.983902 0.5 202 63.546 0.827817 -5.65309 63.546000 Cu 0.149242 0.987031 3.23586e-16 204 63.546 4.06226 -5.59192 63.546000 Cu 0.26737 0.991649 0.5 205 63.546 10.5273 -5.43553 63.546000 Cu 0.301469 0.974732 7.50055e-16 190 63.546 0.676243 -5.62828 63.546000 Cu 0.415442 0.980902 0.5 196 63.546 0.734878 -5.61818 63.546000 Cu 0.523988 0.983897 1.61461e-16 194 63.546 0.829952 -5.65307 63.546000 Cu 0.675834 0.968453 9.33697e-17 197 63.546 0.172602 -5.73358 63.546000 Cu 0.649184 0.987027 0.5 200 63.546 4.06164 -5.59207 63.546000 Cu 0.767339 0.991646 2.9781e-16 198 63.546 10.5267 -5.43544 63.546000 Cu 0.801465 0.974736 0.5 199 63.546 0.675646 -5.62843 63.546000 Cu 0.915456 0.980908 2.87245e-16 201 63.546 0.735501 -5.61871