Number of particles = 404 A = 1 Angstrom (basic length-scale) H0(1,1) = 14.9195 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 89.5611 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60458 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 63.540000 Cu 0.103098 0.0320666 1 222 63.54 0.579182 -3.44183 63.540000 Cu 0.0663775 0.00752306 0.5 223 63.54 8.09863 -3.27027 63.540000 Cu 0.189188 0.00745596 1.05154e-16 225 63.54 3.47486 -3.45852 63.540000 Cu 0.211609 0.0283375 0.5 228 63.54 0.651123 -3.46238 63.540000 Cu 0.458595 0.0205298 0.5 209 63.54 8.94947 -3.40087 63.540000 Cu 0.48692 0.0384177 0 213 63.54 0.422218 -3.47744 63.540000 Cu 0.337467 0.0250609 1.47986e-16 226 63.54 3.15751 -3.43777 63.540000 Cu 0.313873 0.00746826 0.5 227 63.54 7.74132 -3.50259 63.540000 Cu 0.566378 0.00752306 1.22239e-16 208 63.54 8.09863 -3.27027 63.540000 Cu 0.689188 0.00745596 0.5 211 63.54 3.47486 -3.45852 63.540000 Cu 0.603098 0.0320666 0.5 215 63.54 0.579182 -3.44183 63.540000 Cu 0.711609 0.0283375 1 217 63.54 0.651123 -3.46238 63.540000 Cu 0.813873 0.00746826 1 210 63.54 7.74132 -3.50259 63.540000 Cu 0.837467 0.0250609 0.5 219 63.54 3.15751 -3.43777 63.540000 Cu 0.958595 0.0205298 1 221 63.54 8.94947 -3.40087 63.540000 Cu 0.98692 0.0384177 0.5 224 63.54 0.422218 -3.47744 63.540000 Cu 0.0144572 0.0579718 3.10409e-17 239 63.54 0.029143 -3.53403 63.540000 Cu 0.160093 0.0729229 1.55445e-16 240 63.54 0.00213594 -3.53954 63.540000 Cu 0.130363 0.0530228 0.5 241 63.54 0.0351701 -3.53353 63.540000 Cu 0.0430032 0.0777916 0.5 242 63.54 0.00114028 -3.53973 63.540000 Cu 0.246556 0.0483578 3.30141e-16 243 63.54 0.0582586 -3.53441 63.540000 Cu 0.396199 0.0631313 1 244 63.54 0.0105833 -3.53777 63.540000 Cu 0.364836 0.0441247 0.5 245 63.54 0.0914396 -3.52725 63.540000 Cu 0.277183 0.0681661 0.5 246 63.54 0.00933288 -3.53844 63.540000 Cu 0.514457 0.0579718 0.5 216 63.54 0.029143 -3.53403 63.540000 Cu 0.630363 0.0530228 1.97555e-16 214 63.54 0.0351701 -3.53353 63.540000 Cu 0.746556 0.0483578 0.5 220 63.54 0.0582586 -3.53441 63.540000 Cu 0.543003 0.0777916 8.0129e-17 231 63.54 0.00114028 -3.53973 63.540000 Cu 0.660093 0.0729229 0.5 233 63.54 0.00213594 -3.53954 63.540000 Cu 0.864836 0.0441247 0 218 63.54 0.0914396 -3.52725 63.540000 Cu 0.777183 0.0681661 2.40628e-19 235 63.54 0.00933288 -3.53844 63.540000 Cu 0.896199 0.0631313 0.5 237 63.54 0.0105833 -3.53777 63.540000 Cu 0.072237 0.0975187 1.21276e-16 257 63.54 0.00014661 -3.5399 63.540000 Cu 0.219351 0.112281 1 258 63.54 5.32503e-05 -3.53993 63.540000 Cu 0.189742 0.0926635 0.5 259 63.54 0.00106792 -3.53986 63.540000 Cu 0.101609 0.117213 0.5 260 63.54 0.00013404 -3.53994 63.540000 Cu 0.454765 0.102416 8.44603e-17 229 63.54 9.92827e-05 -3.5399 63.540000 Cu 0.425539 0.0827031 0.5 230 63.54 0.00186642 -3.53962 63.540000 Cu 0.307647 0.0876919 1 261 63.54 0.000748204 -3.53989 63.540000 Cu 0.337125 0.107338 0.5 262 63.54 0.000182789 -3.53989 63.540000 Cu 0.689742 0.0926635 1.20314e-18 232 63.54 0.00106792 -3.53986 63.540000 Cu 0.572237 0.0975187 0.5 234 63.54 0.00014661 -3.5399 63.540000 Cu 0.601609 0.117213 1 249 63.54 0.00013404 -3.53994 63.540000 Cu 0.719351 0.112281 0.5 251 63.54 5.32503e-05 -3.53993 63.540000 Cu 0.925539 0.0827031 8.99947e-17 236 63.54 0.00186642 -3.53962 63.540000 Cu 0.807647 0.0876919 0.5 238 63.54 0.000748204 -3.53989 63.540000 Cu 0.837125 0.107338 2.44478e-16 253 63.54 0.000182789 -3.53989 63.540000 Cu 0.954765 0.102416 0.5 255 63.54 9.92827e-05 -3.5399 63.540000 Cu 0.0133213 0.141789 0.5 273 63.54 6.57123e-05 -3.53993 63.540000 Cu 0.13101 0.136867 1.30901e-16 275 63.54 1.40216e-05 -3.53993 63.540000 Cu 0.248735 0.131933 0.5 277 63.54 3.77165e-05 -3.53993 63.540000 Cu 0.160466 0.156517 0.5 278 63.54 4.7674e-05 -3.53993 63.540000 Cu 0.484011 0.122108 0.5 248 63.54 1.04822e-05 -3.53992 63.540000 Cu 0.278085 0.15161 2.46162e-16 276 63.54 2.58424e-05 -3.53992 63.540000 Cu 0.366422 0.127011 7.21883e-17 279 63.54 3.71831e-05 -3.53991 63.540000 Cu 0.395693 0.146693 0.5 280 63.54 3.01489e-05 -3.53993 63.540000 Cu 0.513321 0.141789 1.27051e-16 247 63.54 6.57123e-05 -3.53993 63.540000 Cu 0.748735 0.131933 2.32927e-16 250 63.54 3.77165e-05 -3.53993 63.540000 Cu 0.63101 0.136867 0.5 252 63.54 1.40216e-05 -3.53993 63.540000 Cu 0.660466 0.156517 1.18389e-16 267 63.54 4.7674e-05 -3.53993 63.540000 Cu 0.984011 0.122108 2.40628e-19 254 63.54 1.04822e-05 -3.53992 63.540000 Cu 0.866422 0.127011 0.5 256 63.54 3.71831e-05 -3.53991 63.540000 Cu 0.778085 0.15161 0.5 269 63.54 2.58424e-05 -3.53992 63.540000 Cu 0.895693 0.146693 1.20314e-17 271 63.54 3.01489e-05 -3.53993 63.540000 Cu 0.0428203 0.161451 1.13095e-17 272 63.54 6.28693e-06 -3.53994 63.540000 Cu 0.0723479 0.181109 0.5 291 63.54 3.66561e-05 -3.53993 63.540000 Cu 0.189972 0.176195 1 293 63.54 1.55072e-05 -3.53993 63.540000 Cu 0.219407 0.195881 0.5 296 63.54 3.78898e-05 -3.53992 63.540000 Cu 0.425133 0.166376 1.06598e-16 263 63.54 3.83646e-05 -3.53993 63.540000 Cu 0.454707 0.18604 0.5 266 63.54 2.33571e-05 -3.53993 63.540000 Cu 0.337037 0.190966 2.79128e-17 294 63.54 3.85327e-05 -3.53993 63.540000 Cu 0.307559 0.171288 0.5 295 63.54 4.22133e-06 -3.53992 63.540000 Cu 0.572348 0.181109 1.67958e-16 264 63.54 3.66561e-05 -3.53993 63.540000 Cu 0.54282 0.161451 0.5 265 63.54 6.28693e-06 -3.53994 63.540000 Cu 0.689972 0.176195 0.5 270 63.54 1.55072e-05 -3.53993 63.540000 Cu 0.719407 0.195881 6.25632e-17 285 63.54 3.78898e-05 -3.53992 63.540000 Cu 0.807559 0.171288 1 268 63.54 4.22133e-06 -3.53992 63.540000 Cu 0.925133 0.166376 0.5 274 63.54 3.83646e-05 -3.53993 63.540000 Cu 0.837037 0.190966 0.5 287 63.54 3.85327e-05 -3.53993 63.540000 Cu 0.954707 0.18604 3.78026e-16 289 63.54 2.33571e-05 -3.53993 63.540000 Cu 0.101757 0.200785 2.40628e-19 290 63.54 2.16363e-05 -3.53992 63.540000 Cu 0.0133674 0.225371 8.90322e-18 307 63.54 2.37222e-06 -3.53992 63.540000 Cu 0.131041 0.220468 0.5 309 63.54 2.94197e-05 -3.53992 63.540000 Cu 0.248697 0.215548 2.44478e-16 311 63.54 1.6949e-05 -3.53993 63.540000 Cu 0.484117 0.205698 9.6251e-19 281 63.54 3.91723e-05 -3.53993 63.540000 Cu 0.395741 0.23028 1.2272e-16 312 63.54 3.13835e-05 -3.53992 63.540000 Cu 0.366421 0.210622 0.5 313 63.54 8.8949e-06 -3.53993 63.540000 Cu 0.277988 0.2352 0.5 314 63.54 9.6488e-06 -3.53993 63.540000 Cu 0.513367 0.225371 0.5 284 63.54 2.37222e-06 -3.53992 63.540000 Cu 0.631041 0.220468 1.52798e-16 282 63.54 2.94197e-05 -3.53992 63.540000 Cu 0.601757 0.200785 0.5 283 63.54 2.16363e-05 -3.53992 63.540000 Cu 0.748697 0.215548 0.5 288 63.54 1.6949e-05 -3.53993 63.540000 Cu 0.866421 0.210622 2.43996e-16 286 63.54 8.8949e-06 -3.53993 63.540000 Cu 0.984117 0.205698 0.5 292 63.54 3.91723e-05 -3.53993 63.540000 Cu 0.777988 0.2352 1.9924e-16 303 63.54 9.6488e-06 -3.53993 63.540000 Cu 0.895741 0.23028 0.5 305 63.54 3.13835e-05 -3.53992 63.540000 Cu 0.160282 0.240125 1.82877e-17 308 63.54 2.33297e-05 -3.53992 63.540000 Cu 0.0426224 0.245044 0.5 310 63.54 3.33636e-05 -3.53992 63.540000 Cu 0.0719666 0.264696 1 325 63.54 4.96576e-05 -3.53993 63.540000 Cu 0.219134 0.279437 2.43996e-16 326 63.54 3.06778e-05 -3.53993 63.540000 Cu 0.189652 0.259769 0.5 327 63.54 4.33884e-05 -3.53993 63.540000 Cu 0.454317 0.269616 1 297 63.54 6.91355e-05 -3.53993 63.540000 Cu 0.424959 0.249951 0.5 298 63.54 1.89151e-05 -3.53992 63.540000 Cu 0.307348 0.254856 0 329 63.54 2.38131e-05 -3.53992 63.540000 Cu 0.33673 0.274527 0.5 330 63.54 3.5038e-05 -3.53993 63.540000 Cu 0.542622 0.245044 0 299 63.54 3.33636e-05 -3.53992 63.540000 Cu 0.689652 0.259769 0 300 63.54 4.33884e-05 -3.53993 63.540000 Cu 0.660282 0.240125 0.5 301 63.54 2.33297e-05 -3.53992 63.540000 Cu 0.571967 0.264696 0.5 302 63.54 4.96576e-05 -3.53993 63.540000 Cu 0.719134 0.279437 0.5 319 63.54 3.06778e-05 -3.53993 63.540000 Cu 0.924959 0.249951 1 304 63.54 1.89151e-05 -3.53992 63.540000 Cu 0.807348 0.254856 0.5 306 63.54 2.38131e-05 -3.53992 63.540000 Cu 0.83673 0.274527 0 321 63.54 3.5038e-05 -3.53993 63.540000 Cu 0.954317 0.269616 0.5 323 63.54 6.91355e-05 -3.53993 63.540000 Cu 0.101554 0.284351 0.5 328 63.54 3.188e-05 -3.53993 63.540000 Cu 0.0136695 0.308943 0.5 341 63.54 2.37656e-05 -3.53992 63.540000 Cu 0.131197 0.304029 1 343 63.54 1.06145e-05 -3.53992 63.540000 Cu 0.248744 0.299115 0.5 345 63.54 2.14435e-05 -3.53993 63.540000 Cu 0.483913 0.289276 0.5 316 63.54 2.59956e-05 -3.53994 63.540000 Cu 0.278484 0.318792 1.44377e-18 344 63.54 7.6146e-06 -3.53993 63.540000 Cu 0.366309 0.294198 1 347 63.54 3.54588e-05 -3.53993 63.540000 Cu 0.396073 0.313864 0.5 348 63.54 1.76425e-05 -3.53993 63.540000 Cu 0.513669 0.308943 1 315 63.54 2.37656e-05 -3.53992 63.540000 Cu 0.601554 0.284351 5.05318e-18 317 63.54 3.188e-05 -3.53993 63.540000 Cu 0.748744 0.299115 1 318 63.54 2.14435e-05 -3.53993 63.540000 Cu 0.631197 0.304029 0.5 320 63.54 1.06145e-05 -3.53992 63.540000 Cu 0.983913 0.289276 8.47009e-17 322 63.54 2.59956e-05 -3.53994 63.540000 Cu 0.866309 0.294198 0.5 324 63.54 3.54588e-05 -3.53993 63.540000 Cu 0.778484 0.318792 0.5 337 63.54 7.6146e-06 -3.53993 63.540000 Cu 0.896073 0.313864 1 339 63.54 1.76425e-05 -3.53993 63.540000 Cu 0.0433958 0.328632 8.22946e-17 340 63.54 6.04158e-06 -3.53992 63.540000 Cu 0.160925 0.323717 0.5 346 63.54 9.53899e-06 -3.53992 63.540000 Cu 0.073131 0.348332 0.5 359 63.54 4.4064e-06 -3.53992 63.540000 Cu 0.190708 0.343405 1 361 63.54 2.11028e-06 -3.53992 63.540000 Cu 0.42585 0.333554 1 331 63.54 7.20217e-06 -3.53992 63.540000 Cu 0.45558 0.353253 0.5 334 63.54 3.03552e-06 -3.53992 63.540000 Cu 0.33802 0.358174 4.23504e-17 362 63.54 3.92264e-06 -3.53992 63.540000 Cu 0.308291 0.338475 0.5 363 63.54 1.45629e-05 -3.53992 63.540000 Cu 0.573131 0.348332 1 332 63.54 4.4064e-06 -3.53992 63.540000 Cu 0.543396 0.328632 0.5 333 63.54 6.04158e-06 -3.53992 63.540000 Cu 0.660925 0.323717 2.40628e-19 335 63.54 9.53899e-06 -3.53992 63.540000 Cu 0.690708 0.343405 0.5 338 63.54 2.11028e-06 -3.53992 63.540000 Cu 0.808291 0.338475 3.5661e-16 336 63.54 1.45629e-05 -3.53992 63.540000 Cu 0.92585 0.333554 0.5 342 63.54 7.20217e-06 -3.53992 63.540000 Cu 0.83802 0.358174 0.5 355 63.54 3.92264e-06 -3.53992 63.540000 Cu 0.95558 0.353253 7.21883e-18 357 63.54 3.03552e-06 -3.53992 63.540000 Cu 0.102885 0.368025 8.5904e-17 358 63.54 5.5945e-06 -3.53992 63.540000 Cu 0.220446 0.363094 0.5 364 63.54 7.72519e-06 -3.53992 63.540000 Cu 0.015077 0.392641 5.24568e-17 375 63.54 2.85089e-05 -3.53992 63.540000 Cu 0.132611 0.387729 0.5 377 63.54 2.74225e-05 -3.53991 63.540000 Cu 0.250116 0.382793 4.81255e-19 379 63.54 2.68838e-05 -3.53991 63.540000 Cu 0.485342 0.372946 1.06598e-16 349 63.54 9.85399e-06 -3.53993 63.540000 Cu 0.397503 0.397536 1 380 63.54 9.04649e-05 -3.53993 63.540000 Cu 0.36772 0.377862 0.5 381 63.54 1.17997e-05 -3.53993 63.540000 Cu 0.515077 0.392641 0.5 352 63.54 2.85089e-05 -3.53992 63.540000 Cu 0.632611 0.387729 2.40628e-19 350 63.54 2.74225e-05 -3.53991 63.540000 Cu 0.602885 0.368025 0.5 351 63.54 5.5945e-06 -3.53992 63.540000 Cu 0.720446 0.363094 1 353 63.54 7.72519e-06 -3.53992 63.540000 Cu 0.750116 0.382793 0.5 356 63.54 2.68838e-05 -3.53991 63.540000 Cu 0.86772 0.377862 1 354 63.54 1.17997e-05 -3.53993 63.540000 Cu 0.985342 0.372946 0.5 360 63.54 9.85399e-06 -3.53993 63.540000 Cu 0.897503 0.397536 0.5 373 63.54 9.04649e-05 -3.53993 63.540000 Cu 0.162233 0.407439 1.6122e-16 376 63.54 0.000258337 -3.53989 63.540000 Cu 0.0447385 0.412351 0.5 378 63.54 9.88664e-05 -3.53989 63.540000 Cu 0.0741095 0.432078 1 393 63.54 0.00190265 -3.53963 63.540000 Cu 0.191956 0.427103 0.5 395 63.54 0.000719441 -3.5399 63.540000 Cu 0.456698 0.436955 0 365 63.54 0.00114705 -3.53975 63.540000 Cu 0.427235 0.417231 0.5 366 63.54 0.000185078 -3.5399 63.540000 Cu 0.279849 0.402475 0.5 382 63.54 6.66917e-05 -3.53993 63.540000 Cu 0.309784 0.422114 1.25848e-16 397 63.54 0.000727314 -3.53988 63.540000 Cu 0.544739 0.412351 0 367 63.54 9.88664e-05 -3.53989 63.540000 Cu 0.691956 0.427103 1.02989e-16 368 63.54 0.000719441 -3.5399 63.540000 Cu 0.662233 0.407439 0.5 369 63.54 0.000258337 -3.53989 63.540000 Cu 0.57411 0.432078 0.5 370 63.54 0.00190265 -3.53963 63.540000 Cu 0.779849 0.402475 1 371 63.54 6.66917e-05 -3.53993 63.540000 Cu 0.927235 0.417231 1.81433e-16 372 63.54 0.000185078 -3.5399 63.540000 Cu 0.809784 0.422114 0.5 374 63.54 0.000727314 -3.53988 63.540000 Cu 0.956698 0.436955 0.5 391 63.54 0.00114705 -3.53975 63.540000 Cu 0.13472 0.470685 7.53164e-17 203 63.54 0.0846723 -3.52785 63.540000 Cu 0.0127051 0.4764 0.5 206 63.54 0.434747 -3.47793 63.540000 Cu 0.222456 0.446637 6.40069e-17 394 63.54 0.00785935 -3.53858 63.540000 Cu 0.103391 0.451664 0.5 396 63.54 0.0106991 -3.5378 63.540000 Cu 0.253007 0.466419 0.5 11 63.54 0.0566497 -3.53484 63.540000 Cu 0.369413 0.461714 4.76442e-17 3 63.54 0.0350201 -3.53355 63.540000 Cu 0.485223 0.4568 0.5 384 63.54 0.0283111 -3.53431 63.540000 Cu 0.339612 0.441837 0.5 398 63.54 0.00208334 -3.53961 63.540000 Cu 0.512705 0.4764 2.19934e-16 383 63.54 0.434747 -3.47793 63.540000 Cu 0.603391 0.451664 0 385 63.54 0.0106991 -3.5378 63.540000 Cu 0.722456 0.446637 0.5 387 63.54 0.00785935 -3.53858 63.540000 Cu 0.63472 0.470685 0.5 388 63.54 0.0846723 -3.52785 63.540000 Cu 0.753007 0.466419 0 386 63.54 0.0566497 -3.53484 63.540000 Cu 0.839612 0.441837 9.96198e-17 389 63.54 0.00208334 -3.53961 63.540000 Cu 0.985223 0.4568 1 390 63.54 0.0283111 -3.53431 63.540000 Cu 0.869413 0.461714 0.5 392 63.54 0.0350201 -3.53355 63.540000 Cu 0.186791 0.507328 7.3632e-17 1 63.54 7.75495 -3.50284 63.540000 Cu 0.162268 0.48976 0.5 6 63.54 3.2189 -3.43607 63.540000 Cu 0.0412507 0.494346 7.60383e-17 404 63.54 8.95637 -3.40292 63.540000 Cu 0.396777 0.482685 0.5 2 63.54 0.584168 -3.44076 63.540000 Cu 0.311497 0.507301 0.5 4 63.54 3.48633 -3.45786 63.540000 Cu 0.288146 0.486385 7.57977e-17 200 63.54 0.647939 -3.45927 63.540000 Cu 0.43431 0.507375 1.89614e-16 399 63.54 8.09875 -3.26885 63.540000 Cu 0.686791 0.507328 0.5 8 63.54 7.75495 -3.50284 63.540000 Cu 0.541251 0.494346 0.5 400 63.54 8.95637 -3.40292 63.540000 Cu 0.662268 0.48976 1 401 63.54 3.2189 -3.43607 63.540000 Cu 0.811497 0.507301 0 9 63.54 3.48633 -3.45786 63.540000 Cu 0.93431 0.507375 0.5 204 63.54 8.09875 -3.26885 63.540000 Cu 0.788146 0.486385 0.5 402 63.54 0.647939 -3.45927 63.540000 Cu 0.896777 0.482685 1 403 63.54 0.584168 -3.44076 63.540000 Cu 0.0422457 0.520394 2.28115e-16 13 63.54 8.95099 -3.39968 63.540000 Cu 0.136124 0.544026 1 14 63.54 0.0916229 -3.52767 63.540000 Cu 0.16346 0.524934 0.5 15 63.54 3.1407 -3.43847 63.540000 Cu 0.0140577 0.538328 0.5 16 63.54 0.421899 -3.47752 63.540000 Cu 0.289203 0.528196 1.34751e-16 17 63.54 0.648879 -3.4629 63.540000 Cu 0.370653 0.552931 0 18 63.54 0.0347805 -3.5336 63.540000 Cu 0.397731 0.531957 0.5 19 63.54 0.580427 -3.44122 63.540000 Cu 0.254368 0.548257 0.5 20 63.54 0.0579189 -3.53452 63.540000 Cu 0.486546 0.557895 0.5 22 63.54 0.0292236 -3.53377 63.540000 Cu 0.542246 0.520394 0.5 5 63.54 8.95099 -3.39968 63.540000 Cu 0.66346 0.524934 0 7 63.54 3.1407 -3.43847 63.540000 Cu 0.514058 0.538328 1 21 63.54 0.421899 -3.47752 63.540000 Cu 0.636124 0.544026 0.5 24 63.54 0.0916229 -3.52767 63.540000 Cu 0.986546 0.557895 0 29 63.54 0.0292236 -3.53377 63.540000 Cu 0.897731 0.531957 1 10 63.54 0.580427 -3.44122 63.540000 Cu 0.789203 0.528196 0.5 12 63.54 0.648879 -3.4629 63.540000 Cu 0.754368 0.548257 1 25 63.54 0.0579189 -3.53452 63.540000 Cu 0.870653 0.552931 0.5 27 63.54 0.0347805 -3.5336 63.540000 Cu 0.0754578 0.582648 1.46302e-16 30 63.54 0.00187142 -3.53957 63.540000 Cu 0.104784 0.56306 0.5 31 63.54 0.0104285 -3.53782 63.540000 Cu 0.223841 0.568077 0 33 63.54 0.00887615 -3.53851 63.540000 Cu 0.193373 0.587633 0.5 36 63.54 0.000722144 -3.53989 63.540000 Cu 0.311212 0.592619 1 34 63.54 0.000909682 -3.53988 63.540000 Cu 0.34094 0.572858 0.5 35 63.54 0.00206867 -3.53954 63.540000 Cu 0.457982 0.577744 1 37 63.54 0.00120101 -3.53967 63.540000 Cu 0.428678 0.597495 0.5 39 63.54 0.000153158 -3.53989 63.540000 Cu 0.604784 0.56306 2.17046e-16 23 63.54 0.0104285 -3.53782 63.540000 Cu 0.723841 0.568077 0.5 28 63.54 0.00887615 -3.53851 63.540000 Cu 0.575458 0.582648 0.5 40 63.54 0.00187142 -3.53957 63.540000 Cu 0.693373 0.587633 1.20314e-18 41 63.54 0.000722144 -3.53989 63.540000 Cu 0.84094 0.572858 1.44377e-18 26 63.54 0.00206867 -3.53954 63.540000 Cu 0.957982 0.577744 0.5 32 63.54 0.00120101 -3.53967 63.540000 Cu 0.811212 0.592619 0.5 43 63.54 0.000909682 -3.53988 63.540000 Cu 0.928678 0.597495 1.16223e-16 45 63.54 0.000153158 -3.53989 63.540000 Cu 0.0167715 0.622109 1 46 63.54 2.43879e-05 -3.53991 63.540000 Cu 0.0462221 0.602386 0.5 47 63.54 9.02934e-05 -3.53987 63.540000 Cu 0.163789 0.607313 0 49 63.54 0.000186205 -3.53987 63.540000 Cu 0.134375 0.627024 0.5 52 63.54 2.54319e-05 -3.5399 63.540000 Cu 0.25194 0.631956 0 50 63.54 1.93361e-05 -3.5399 63.540000 Cu 0.281487 0.612272 0.5 51 63.54 4.89551e-05 -3.53992 63.540000 Cu 0.399182 0.61721 2.69503e-16 53 63.54 0.000118762 -3.53993 63.540000 Cu 0.369587 0.636886 0.5 56 63.54 9.82241e-06 -3.53993 63.540000 Cu 0.546222 0.602386 1.5352e-16 38 63.54 9.02934e-05 -3.53987 63.540000 Cu 0.663789 0.607313 0.5 44 63.54 0.000186205 -3.53987 63.540000 Cu 0.516771 0.622109 0.5 55 63.54 2.43879e-05 -3.53991 63.540000 Cu 0.634375 0.627024 1.20314e-17 57 63.54 2.54319e-05 -3.5399 63.540000 Cu 0.781487 0.612272 1.22239e-16 42 63.54 4.89551e-05 -3.53992 63.540000 Cu 0.899182 0.61721 0.5 48 63.54 0.000118762 -3.53993 63.540000 Cu 0.75194 0.631956 0.5 59 63.54 1.93361e-05 -3.5399 63.540000 Cu 0.869587 0.636886 2.43515e-16 61 63.54 9.82241e-06 -3.53993 63.540000 Cu 0.104837 0.646727 1 65 63.54 3.69699e-06 -3.53992 63.540000 Cu 0.192965 0.671347 1.61461e-16 66 63.54 1.3065e-05 -3.53993 63.540000 Cu 0.222449 0.651654 0.5 67 63.54 4.72736e-06 -3.53992 63.540000 Cu 0.0753171 0.666425 0.5 68 63.54 1.6867e-05 -3.53993 63.540000 Cu 0.340061 0.656581 2.69503e-16 69 63.54 1.17904e-05 -3.53992 63.540000 Cu 0.457698 0.661503 0.5 71 63.54 1.08875e-05 -3.53992 63.540000 Cu 0.310638 0.676271 0.5 72 63.54 9.50003e-06 -3.53993 63.540000 Cu 0.487231 0.641811 2.85625e-16 54 63.54 7.91148e-06 -3.53993 63.540000 Cu 0.722449 0.651654 2.43515e-16 58 63.54 4.72736e-06 -3.53992 63.540000 Cu 0.604837 0.646727 0.5 60 63.54 3.69699e-06 -3.53992 63.540000 Cu 0.575317 0.666425 9.16791e-17 74 63.54 1.6867e-05 -3.53993 63.540000 Cu 0.692965 0.671347 0.5 76 63.54 1.3065e-05 -3.53993 63.540000 Cu 0.987231 0.641811 0.5 63 63.54 7.91148e-06 -3.53993 63.540000 Cu 0.957698 0.661503 2.44237e-16 62 63.54 1.08875e-05 -3.53992 63.540000 Cu 0.840061 0.656581 0.5 64 63.54 1.17904e-05 -3.53992 63.540000 Cu 0.810638 0.676271 1.21517e-16 77 63.54 9.50003e-06 -3.53993 63.540000 Cu 0.0459059 0.68611 3.99682e-16 81 63.54 2.75005e-06 -3.53992 63.540000 Cu 0.134153 0.71071 4.21098e-16 82 63.54 9.22451e-07 -3.53993 63.540000 Cu 0.163559 0.691025 0.5 83 63.54 2.88496e-06 -3.53993 63.540000 Cu 0.0165349 0.705791 0.5 84 63.54 5.79782e-06 -3.53992 63.540000 Cu 0.428283 0.681192 1.21998e-16 70 63.54 5.92696e-06 -3.53992 63.540000 Cu 0.281195 0.695943 4.66817e-17 85 63.54 8.21584e-06 -3.53993 63.540000 Cu 0.398885 0.700871 0.5 87 63.54 6.20367e-06 -3.53993 63.540000 Cu 0.251795 0.715626 0.5 88 63.54 4.20868e-06 -3.53993 63.540000 Cu 0.545906 0.68611 0.5 73 63.54 2.75005e-06 -3.53992 63.540000 Cu 0.663559 0.691025 0 75 63.54 2.88496e-06 -3.53993 63.540000 Cu 0.516535 0.705791 1.06357e-16 89 63.54 5.79782e-06 -3.53992 63.540000 Cu 0.634153 0.71071 0.5 92 63.54 9.22451e-07 -3.53993 63.540000 Cu 0.898885 0.700871 1.21998e-16 78 63.54 6.20367e-06 -3.53993 63.540000 Cu 0.928283 0.681192 0.5 79 63.54 5.92696e-06 -3.53992 63.540000 Cu 0.781195 0.695943 0.5 80 63.54 8.21584e-06 -3.53993 63.540000 Cu 0.751795 0.715626 2.43515e-16 93 63.54 4.20868e-06 -3.53993 63.540000 Cu 0.0752047 0.750067 0 98 63.54 5.93309e-05 -3.53994 63.540000 Cu 0.104761 0.730397 0.5 99 63.54 3.15869e-05 -3.53993 63.540000 Cu 0.22236 0.735311 5.22162e-17 101 63.54 1.65158e-05 -3.53993 63.540000 Cu 0.192833 0.754998 0.5 104 63.54 9.6619e-05 -3.53993 63.540000 Cu 0.369409 0.720546 2.40628e-19 86 63.54 1.05681e-05 -3.53993 63.540000 Cu 0.310375 0.759915 1.91539e-16 102 63.54 4.7222e-05 -3.53992 63.540000 Cu 0.340007 0.74023 0.5 103 63.54 4.6294e-05 -3.53993 63.540000 Cu 0.457584 0.74515 4.81255e-19 105 63.54 3.35471e-05 -3.53993 63.540000 Cu 0.487109 0.725475 0.5 90 63.54 1.34256e-05 -3.53994 63.540000 Cu 0.604761 0.730397 1 91 63.54 3.15869e-05 -3.53993 63.540000 Cu 0.72236 0.735311 0.5 96 63.54 1.65158e-05 -3.53993 63.540000 Cu 0.575205 0.750067 0.5 108 63.54 5.93309e-05 -3.53994 63.540000 Cu 0.692833 0.754998 1 109 63.54 9.6619e-05 -3.53993 63.540000 Cu 0.987109 0.725475 0 97 63.54 1.34256e-05 -3.53994 63.540000 Cu 0.840007 0.74023 1 94 63.54 4.6294e-05 -3.53993 63.540000 Cu 0.869409 0.720546 0.5 95 63.54 1.05681e-05 -3.53993 63.540000 Cu 0.957584 0.74515 0.5 100 63.54 3.35471e-05 -3.53993 63.540000 Cu 0.810375 0.759915 0.5 111 63.54 4.7222e-05 -3.53992 63.540000 Cu 0.0155744 0.789433 1 114 63.54 2.33633e-05 -3.53991 63.540000 Cu 0.0454329 0.769761 0.5 115 63.54 2.3119e-05 -3.53991 63.540000 Cu 0.162986 0.774675 1 117 63.54 5.11461e-06 -3.53992 63.540000 Cu 0.133132 0.79436 0.5 120 63.54 9.71058e-06 -3.53992 63.540000 Cu 0.427939 0.764831 0.5 107 63.54 4.89119e-05 -3.53992 63.540000 Cu 0.250669 0.799281 1.40526e-16 118 63.54 1.92947e-05 -3.53992 63.540000 Cu 0.28053 0.7796 0.5 119 63.54 2.02019e-06 -3.53992 63.540000 Cu 0.398096 0.784524 9.14385e-18 121 63.54 1.79214e-05 -3.53991 63.540000 Cu 0.545433 0.769761 3.35435e-16 106 63.54 2.3119e-05 -3.53991 63.540000 Cu 0.662986 0.774675 0.5 112 63.54 5.11461e-06 -3.53992 63.540000 Cu 0.515574 0.789433 0.5 123 63.54 2.33633e-05 -3.53991 63.540000 Cu 0.633132 0.79436 0 125 63.54 9.71058e-06 -3.53992 63.540000 Cu 0.78053 0.7796 0 110 63.54 2.02019e-06 -3.53992 63.540000 Cu 0.927939 0.764831 0 113 63.54 4.89119e-05 -3.53992 63.540000 Cu 0.898096 0.784524 0.5 116 63.54 1.79214e-05 -3.53991 63.540000 Cu 0.750669 0.799281 0.5 127 63.54 1.92947e-05 -3.53992 63.540000 Cu 0.103338 0.814036 1 133 63.54 2.90665e-05 -3.53992 63.540000 Cu 0.191294 0.838646 1 134 63.54 2.73487e-05 -3.53993 63.540000 Cu 0.220959 0.818951 0.5 135 63.54 2.3381e-05 -3.53993 63.540000 Cu 0.0736902 0.833721 0.5 136 63.54 2.38089e-05 -3.53993 63.540000 Cu 0.368229 0.804195 0.5 124 63.54 2.4319e-05 -3.53993 63.540000 Cu 0.338491 0.82388 4.81255e-19 137 63.54 3.07746e-05 -3.53993 63.540000 Cu 0.456098 0.828805 0.5 139 63.54 2.56256e-05 -3.53993 63.540000 Cu 0.485834 0.809122 1.63145e-16 122 63.54 1.21804e-05 -3.53992 63.540000 Cu 0.720959 0.818951 1.21517e-16 126 63.54 2.3381e-05 -3.53993 63.540000 Cu 0.603338 0.814036 0.5 128 63.54 2.90665e-05 -3.53992 63.540000 Cu 0.57369 0.833721 0 142 63.54 2.38089e-05 -3.53993 63.540000 Cu 0.691294 0.838646 0.5 144 63.54 2.73487e-05 -3.53993 63.540000 Cu 0.985834 0.809122 0.5 131 63.54 1.21804e-05 -3.53992 63.540000 Cu 0.868229 0.804195 1 129 63.54 2.4319e-05 -3.53993 63.540000 Cu 0.956098 0.828805 1 130 63.54 2.56256e-05 -3.53993 63.540000 Cu 0.838491 0.82388 0.5 132 63.54 3.07746e-05 -3.53993 63.540000 Cu 0.0441536 0.853405 1 149 63.54 1.06796e-05 -3.53994 63.540000 Cu 0.132163 0.878008 1 150 63.54 1.71136e-05 -3.53993 63.540000 Cu 0.161793 0.85832 0.5 151 63.54 3.45426e-05 -3.53993 63.540000 Cu 0.0145373 0.873077 0.5 152 63.54 2.73394e-05 -3.53993 63.540000 Cu 0.426507 0.848476 3.65994e-16 138 63.54 1.21631e-05 -3.53994 63.540000 Cu 0.308916 0.843554 0.5 140 63.54 1.48029e-05 -3.53993 63.540000 Cu 0.279366 0.863249 3.10409e-17 153 63.54 1.33385e-05 -3.53993 63.540000 Cu 0.396938 0.868167 0.5 155 63.54 5.98287e-06 -3.53992 63.540000 Cu 0.544154 0.853405 0.5 141 63.54 1.06796e-05 -3.53994 63.540000 Cu 0.661793 0.85832 1 143 63.54 3.45426e-05 -3.53993 63.540000 Cu 0.514537 0.873077 6.25632e-18 157 63.54 2.73394e-05 -3.53993 63.540000 Cu 0.632163 0.878008 0.5 160 63.54 1.71136e-05 -3.53993 63.540000 Cu 0.808916 0.843554 4.81255e-19 145 63.54 1.48029e-05 -3.53993 63.540000 Cu 0.896938 0.868167 3.01025e-16 146 63.54 5.98287e-06 -3.53992 63.540000 Cu 0.926507 0.848476 0.5 147 63.54 1.21631e-05 -3.53994 63.540000 Cu 0.779366 0.863249 0.5 148 63.54 1.33385e-05 -3.53993 63.540000 Cu 0.0727357 0.917392 1 166 63.54 0.000131539 -3.5399 63.540000 Cu 0.1024 0.897694 0.5 167 63.54 5.94836e-05 -3.53993 63.540000 Cu 0.220079 0.902624 1 169 63.54 5.07379e-05 -3.53993 63.540000 Cu 0.249705 0.882946 0.5 156 63.54 3.47258e-05 -3.53992 63.540000 Cu 0.367328 0.887857 0 154 63.54 1.26288e-05 -3.53992 63.540000 Cu 0.33773 0.907562 0.5 171 63.54 0.000127659 -3.53989 63.540000 Cu 0.45525 0.91249 3.65273e-16 173 63.54 5.78647e-05 -3.53989 63.540000 Cu 0.484889 0.892772 0.5 158 63.54 2.20919e-05 -3.53992 63.540000 Cu 0.6024 0.897694 1.35473e-16 159 63.54 5.94836e-05 -3.53993 63.540000 Cu 0.720079 0.902624 0.5 164 63.54 5.07379e-05 -3.53993 63.540000 Cu 0.572736 0.917392 0.5 176 63.54 0.000131539 -3.5399 63.540000 Cu 0.749705 0.882946 4.98099e-17 161 63.54 3.47258e-05 -3.53992 63.540000 Cu 0.984889 0.892772 0 165 63.54 2.20919e-05 -3.53992 63.540000 Cu 0.83773 0.907562 1 162 63.54 0.000127659 -3.53989 63.540000 Cu 0.867328 0.887857 0.5 163 63.54 1.26288e-05 -3.53992 63.540000 Cu 0.95525 0.91249 0.5 168 63.54 5.78647e-05 -3.53989 63.540000 Cu 0.190197 0.922268 0.5 172 63.54 0.000693186 -3.53988 63.540000 Cu 0.0147855 0.956956 2.61562e-16 182 63.54 0.0273391 -3.53413 63.540000 Cu 0.0433279 0.937117 0.5 183 63.54 0.00108568 -3.53973 63.540000 Cu 0.160416 0.94201 1 185 63.54 0.00180064 -3.53962 63.540000 Cu 0.308017 0.927243 0 170 63.54 0.0006861 -3.5399 63.540000 Cu 0.425826 0.932222 0.5 175 63.54 0.00168804 -3.53962 63.540000 Cu 0.277564 0.946793 0.5 187 63.54 0.00802167 -3.53863 63.540000 Cu 0.396637 0.951807 1 189 63.54 0.0104432 -3.5378 63.540000 Cu 0.543328 0.937117 1.22239e-16 174 63.54 0.00108568 -3.53973 63.540000 Cu 0.690197 0.922268 4.3313e-17 177 63.54 0.000693186 -3.53988 63.540000 Cu 0.660416 0.94201 0.5 180 63.54 0.00180064 -3.53962 63.540000 Cu 0.514785 0.956956 0.5 191 63.54 0.0273391 -3.53413 63.540000 Cu 0.777564 0.946793 1 178 63.54 0.00802167 -3.53863 63.540000 Cu 0.808017 0.927243 0.5 179 63.54 0.0006861 -3.5399 63.540000 Cu 0.925826 0.932222 0 181 63.54 0.00168804 -3.53962 63.540000 Cu 0.896637 0.951807 0.5 184 63.54 0.0104432 -3.5378 63.540000 Cu 0.130746 0.961886 0.5 188 63.54 0.0347465 -3.53372 63.540000 Cu 0.103637 0.98284 1 201 63.54 0.586949 -3.44018 63.540000 Cu 0.212246 0.986568 0.5 202 63.54 0.648557 -3.46007 63.540000 Cu 0.247211 0.966589 1 186 63.54 0.0560468 -3.53501 63.540000 Cu 0.33819 0.989918 1.48948e-16 207 63.54 3.20527 -3.43572 63.540000 Cu 0.365449 0.970841 0.5 192 63.54 0.0872075 -3.52784 63.540000 Cu 0.459275 0.994461 0.5 205 63.54 8.97213 -3.40221 63.540000 Cu 0.487529 0.976546 1 190 63.54 0.432985 -3.4769 63.540000 Cu 0.630746 0.961886 8.2054e-17 193 63.54 0.0347465 -3.53372 63.540000 Cu 0.712246 0.986568 4.54786e-17 194 63.54 0.648557 -3.46007 63.540000 Cu 0.603637 0.98284 0.5 196 63.54 0.586949 -3.44018 63.540000 Cu 0.747211 0.966589 0.5 195 63.54 0.0560468 -3.53501 63.540000 Cu 0.83819 0.989918 0.5 212 63.54 3.20527 -3.43572 63.540000 Cu 0.987529 0.976546 0.5 199 63.54 0.432985 -3.4769 63.540000 Cu 0.865449 0.970841 0 197 63.54 0.0872075 -3.52784 63.540000 Cu 0.959275 0.994461 1 198 63.54 8.97213 -3.40221