Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.4501 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.9222 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.60238 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 0.0962947 0.0146643 1 211 63.546 7.4811 -3.19339 63.546000 Cu 0.117244 0.0352599 0.5 221 63.546 3.43346 -3.40147 63.546000 Cu 0.000734081 0.0146475 0.5 212 63.546 1.60214 -3.51359 63.546000 Cu 0.0108745 0.0394686 5.29704e-18 219 63.546 0.665216 -3.49441 63.546000 Cu 0.214266 0.0305861 2.40774e-19 223 63.546 9.2572 -3.2133 63.546000 Cu 0.304097 0.0145879 0.5 225 63.546 7.59292 -3.36965 63.546000 Cu 0.401554 0.0146632 2.40774e-19 227 63.546 2.24876 -3.4658 63.546000 Cu 0.41696 0.0418194 0.5 230 63.546 0.438246 -3.4376 63.546000 Cu 0.510882 0.0394689 4.81549e-19 228 63.546 0.664677 -3.4944 63.546000 Cu 0.500739 0.0146475 0.5 229 63.546 1.6017 -3.51356 63.546000 Cu 0.596296 0.0146645 5.75451e-17 231 63.546 7.48105 -3.1934 63.546000 Cu 0.617246 0.0352614 0.5 234 63.546 3.43381 -3.4015 63.546000 Cu 0.714261 0.0305879 4.81549e-19 232 63.546 9.25711 -3.21334 63.546000 Cu 0.804094 0.0145891 0.5 210 63.546 7.59336 -3.36953 63.546000 Cu 0.901546 0.0146631 3.61162e-18 209 63.546 2.24988 -3.46577 63.546000 Cu 0.916954 0.0418204 0.5 217 63.546 0.438427 -3.43762 63.546000 Cu 0.132728 0.0581142 9.63097e-19 220 63.546 0.0590878 -3.53184 63.546000 Cu 0.0333225 0.0632733 0.5 222 63.546 0.126637 -3.50649 63.546000 Cu 0.0561356 0.0869224 4.81549e-19 240 63.546 0.00612716 -3.51684 63.546000 Cu 0.153435 0.0814883 0.5 242 63.546 0.0448953 -3.52806 63.546000 Cu 0.236983 0.0528069 0.5 226 63.546 0.816343 -3.45173 63.546000 Cu 0.330297 0.0461878 1.20387e-18 224 63.546 0.722655 -3.40004 63.546000 Cu 0.251345 0.0764648 4.81549e-19 244 63.546 0.0688519 -3.53145 63.546000 Cu 0.346906 0.0724545 0.5 246 63.546 0.101762 -3.51474 63.546000 Cu 0.439396 0.0681158 2.40774e-19 248 63.546 0.136698 -3.49668 63.546000 Cu 0.556134 0.0869242 0 249 63.546 0.00610517 -3.51685 63.546000 Cu 0.533327 0.0632744 0.5 250 63.546 0.126522 -3.50649 63.546000 Cu 0.632729 0.0581174 4.81549e-19 252 63.546 0.0590185 -3.53185 63.546000 Cu 0.751343 0.076468 0 253 63.546 0.0687732 -3.53145 63.546000 Cu 0.736979 0.05281 0.5 254 63.546 0.816306 -3.45174 63.546000 Cu 0.653434 0.0814916 0.5 255 63.546 0.0447428 -3.52806 63.546000 Cu 0.830291 0.0461894 0 215 63.546 0.722475 -3.40002 63.546000 Cu 0.939393 0.068116 0 216 63.546 0.136678 -3.49667 63.546000 Cu 0.846903 0.0724567 0.5 218 63.546 0.101833 -3.51475 63.546000 Cu 0.172463 0.105581 4.81549e-19 241 63.546 0.0130501 -3.52308 63.546000 Cu 0.0763372 0.110722 0.5 243 63.546 0.00659499 -3.52021 63.546000 Cu 0.190948 0.129908 0.5 264 63.546 0.00133684 -3.51824 63.546000 Cu 0.363741 0.0968316 0 245 63.546 0.02187 -3.50864 63.546000 Cu 0.267936 0.100964 0.5 247 63.546 0.0082527 -3.5222 63.546000 Cu 0.286454 0.125308 0 266 63.546 0.00389093 -3.51579 63.546000 Cu 0.382554 0.120722 0.5 268 63.546 0.00585798 -3.51705 63.546000 Cu 0.459911 0.0922514 0.5 251 63.546 0.0295916 -3.50455 63.546000 Cu 0.479495 0.115895 0 270 63.546 0.00262736 -3.51765 63.546000 Cu 0.576336 0.110724 0.5 272 63.546 0.00658211 -3.5202 63.546000 Cu 0.78646 0.125309 1.15572e-17 235 63.546 0.00386562 -3.51578 63.546000 Cu 0.672465 0.105583 0 274 63.546 0.0130027 -3.52309 63.546000 Cu 0.76794 0.100966 0.5 275 63.546 0.00819996 -3.5222 63.546000 Cu 0.690949 0.12991 0.5 276 63.546 0.0013297 -3.51824 63.546000 Cu 0.863746 0.0968329 0 236 63.546 0.0218696 -3.50863 63.546000 Cu 0.979503 0.115895 0 237 63.546 0.0026381 -3.51765 63.546000 Cu 0.959914 0.0922512 0.5 238 63.546 0.0295682 -3.50455 63.546000 Cu 0.882562 0.120723 0.5 239 63.546 0.00582695 -3.51705 63.546000 Cu 0.0951586 0.134731 0 262 63.546 0.00289499 -3.5208 63.546000 Cu 0.113781 0.158823 0.5 265 63.546 0.000388529 -3.51952 63.546000 Cu 0.0175957 0.163638 5.27296e-17 259 63.546 0.000547299 -3.52105 63.546000 Cu 0.209738 0.154093 0 263 63.546 0.000411529 -3.51713 63.546000 Cu 0.305672 0.149378 0.5 269 63.546 0.00111577 -3.51686 63.546000 Cu 0.32491 0.173367 5.10442e-17 287 63.546 0.00022065 -3.51884 63.546000 Cu 0.595154 0.134731 2.40774e-19 271 63.546 0.00288018 -3.52078 63.546000 Cu 0.401964 0.144592 0 267 63.546 0.000741685 -3.5199 63.546000 Cu 0.421216 0.168516 0.5 289 63.546 9.05481e-05 -3.52028 63.546000 Cu 0.498622 0.139679 0.5 273 63.546 0.000966703 -3.52198 63.546000 Cu 0.517594 0.163639 0 291 63.546 0.000552869 -3.52106 63.546000 Cu 0.613777 0.158823 0.5 293 63.546 0.000387222 -3.51953 63.546000 Cu 0.709734 0.154093 0 295 63.546 0.000402795 -3.51714 63.546000 Cu 0.824905 0.173367 0 256 63.546 0.000223559 -3.51883 63.546000 Cu 0.80567 0.149377 0.5 257 63.546 0.00111403 -3.51687 63.546000 Cu 0.901968 0.144591 0 258 63.546 0.000734596 -3.51991 63.546000 Cu 0.998628 0.139678 0.5 260 63.546 0.000967512 -3.52199 63.546000 Cu 0.921212 0.168515 0.5 261 63.546 8.95942e-05 -3.52027 63.546000 Cu 0.0556321 0.211716 0 280 63.546 6.90476e-06 -3.51928 63.546000 Cu 0.0365829 0.187671 0.5 281 63.546 0.000148636 -3.51971 63.546000 Cu 0.132665 0.182901 2.33551e-17 283 63.546 4.02576e-05 -3.5189 63.546000 Cu 0.151718 0.206948 0.5 286 63.546 8.4896e-05 -3.51898 63.546000 Cu 0.228732 0.178152 0.5 285 63.546 0.000242046 -3.51827 63.546000 Cu 0.24784 0.20216 2.16697e-17 284 63.546 0.000154765 -3.51902 63.546000 Cu 0.344114 0.197336 0.5 290 63.546 1.07648e-05 -3.5194 63.546000 Cu 0.440399 0.192494 0 288 63.546 0.000108826 -3.51982 63.546000 Cu 0.536588 0.187674 0.5 294 63.546 0.000143596 -3.51972 63.546000 Cu 0.459531 0.216498 0.5 311 63.546 8.91914e-05 -3.51955 63.546000 Cu 0.555639 0.211718 0 313 63.546 6.62773e-06 -3.51926 63.546000 Cu 0.728728 0.178152 0.5 296 63.546 0.000246039 -3.51827 63.546000 Cu 0.632665 0.182903 0 292 63.546 4.11561e-05 -3.51891 63.546000 Cu 0.651723 0.20695 0.5 315 63.546 8.43818e-05 -3.51897 63.546000 Cu 0.747841 0.20216 0 317 63.546 0.000154155 -3.51901 63.546000 Cu 0.844109 0.197334 0.5 278 63.546 1.14021e-05 -3.51939 63.546000 Cu 0.940392 0.192491 0 279 63.546 0.000112636 -3.51981 63.546000 Cu 0.959529 0.216496 0.5 282 63.546 9.1605e-05 -3.51956 63.546000 Cu 0.0939457 0.259754 0 302 63.546 1.67464e-05 -3.51902 63.546000 Cu 0.0747213 0.235748 0.5 303 63.546 5.28621e-05 -3.51905 63.546000 Cu 0.170882 0.230959 0 305 63.546 5.85693e-05 -3.51906 63.546000 Cu 0.190106 0.254947 0.5 308 63.546 1.10162e-05 -3.51932 63.546000 Cu 0.267096 0.226143 0.5 307 63.546 5.05995e-06 -3.51934 63.546000 Cu 0.363331 0.22131 0 309 63.546 7.17537e-05 -3.51965 63.546000 Cu 0.286327 0.250134 8.18633e-18 306 63.546 1.70739e-05 -3.51954 63.546000 Cu 0.382492 0.245329 0.5 312 63.546 1.62593e-05 -3.5196 63.546000 Cu 0.478619 0.24053 0 310 63.546 1.38426e-05 -3.51939 63.546000 Cu 0.574726 0.23575 0.5 316 63.546 5.17558e-05 -3.51907 63.546000 Cu 0.593948 0.259755 0 335 63.546 1.70027e-05 -3.51901 63.546000 Cu 0.767105 0.226144 0.5 318 63.546 5.159e-06 -3.51936 63.546000 Cu 0.786343 0.250137 0 297 63.546 1.79889e-05 -3.51954 63.546000 Cu 0.670892 0.230962 0 314 63.546 5.88607e-05 -3.51909 63.546000 Cu 0.690119 0.25495 0.5 337 63.546 8.15887e-06 -3.51932 63.546000 Cu 0.863334 0.22131 0 277 63.546 7.30458e-05 -3.51966 63.546000 Cu 0.882507 0.245331 0.5 299 63.546 1.84156e-05 -3.5196 63.546000 Cu 0.978622 0.24053 5.2248e-17 301 63.546 1.42412e-05 -3.51937 63.546000 Cu 0.113239 0.283754 0.5 325 63.546 2.28648e-05 -3.51956 63.546000 Cu 0.0170821 0.288552 4.81549e-19 323 63.546 2.02356e-05 -3.51909 63.546000 Cu 0.209371 0.278943 5.75451e-17 327 63.546 1.74971e-06 -3.51962 63.546000 Cu 0.228642 0.302939 0.5 330 63.546 1.85866e-05 -3.51952 63.546000 Cu 0.324822 0.298129 1.54096e-17 328 63.546 1.7805e-05 -3.51903 63.546000 Cu 0.3055 0.274134 0.5 329 63.546 2.63928e-05 -3.51943 63.546000 Cu 0.401654 0.269336 0 331 63.546 2.7961e-05 -3.51908 63.546000 Cu 0.497801 0.264549 0.5 333 63.546 1.89798e-05 -3.51891 63.546000 Cu 0.420967 0.293333 0.5 334 63.546 4.43624e-05 -3.51889 63.546000 Cu 0.517064 0.28855 0 332 63.546 2.41606e-05 -3.5191 63.546000 Cu 0.613231 0.283753 0.5 338 63.546 2.33286e-05 -3.51956 63.546000 Cu 0.709374 0.278944 0 336 63.546 1.97931e-06 -3.5196 63.546000 Cu 0.728636 0.302938 0.5 358 63.546 1.84694e-05 -3.51954 63.546000 Cu 0.901672 0.269338 0 298 63.546 2.48165e-05 -3.51908 63.546000 Cu 0.997809 0.26455 0.5 304 63.546 1.95441e-05 -3.51892 63.546000 Cu 0.805512 0.274135 0.5 300 63.546 2.42508e-05 -3.51945 63.546000 Cu 0.824828 0.29813 3.13007e-18 319 63.546 1.65095e-05 -3.51903 63.546000 Cu 0.920981 0.293335 0.5 321 63.546 4.02291e-05 -3.51889 63.546000 Cu 0.132404 0.307769 7.94555e-18 324 63.546 6.86114e-05 -3.51992 63.546000 Cu 0.0362825 0.312582 0.5 326 63.546 4.77418e-05 -3.5195 63.546000 Cu 0.0554265 0.336617 2.40774e-19 344 63.546 0.000376782 -3.51991 63.546000 Cu 0.151675 0.331761 0.5 346 63.546 0.000102698 -3.51962 63.546000 Cu 0.247967 0.326923 3.56346e-17 348 63.546 0.000100952 -3.51891 63.546000 Cu 0.363403 0.346176 0 349 63.546 0.000107086 -3.5188 63.546000 Cu 0.344124 0.322133 0.5 350 63.546 0.00010891 -3.51865 63.546000 Cu 0.440225 0.317365 0 352 63.546 4.37969e-05 -3.51897 63.546000 Cu 0.536269 0.312583 0.5 354 63.546 5.37559e-05 -3.51952 63.546000 Cu 0.555425 0.336617 4.81549e-19 353 63.546 0.000370507 -3.5199 63.546000 Cu 0.459349 0.341429 0.5 355 63.546 0.000187068 -3.51953 63.546000 Cu 0.632394 0.307768 2.40774e-19 356 63.546 7.07357e-05 -3.51996 63.546000 Cu 0.747958 0.326922 4.81549e-19 357 63.546 9.96928e-05 -3.51891 63.546000 Cu 0.651671 0.33176 0.5 359 63.546 0.000100324 -3.51959 63.546000 Cu 0.940227 0.317364 4.81549e-19 320 63.546 4.30163e-05 -3.51895 63.546000 Cu 0.844122 0.322131 0.5 322 63.546 0.000114498 -3.51864 63.546000 Cu 0.863395 0.346174 4.81549e-19 340 63.546 0.000108672 -3.51885 63.546000 Cu 0.959348 0.341427 0.5 342 63.546 0.000184568 -3.51958 63.546000 Cu 0.171166 0.355709 1.78173e-17 345 63.546 0.000373362 -3.51882 63.546000 Cu 0.0748417 0.360606 0.5 347 63.546 0.000343496 -3.5204 63.546000 Cu 0.0946723 0.38453 4.95995e-17 366 63.546 0.000690716 -3.52011 63.546000 Cu 0.190906 0.379685 0.5 368 63.546 0.00177208 -3.51664 63.546000 Cu 0.267361 0.350909 0.5 351 63.546 0.000501742 -3.51808 63.546000 Cu 0.286731 0.374971 0 370 63.546 0.000762878 -3.51701 63.546000 Cu 0.382606 0.370281 0.5 372 63.546 0.000325185 -3.51967 63.546000 Cu 0.574841 0.360608 0.5 376 63.546 0.000346678 -3.5204 63.546000 Cu 0.478637 0.365503 0 374 63.546 0.00100017 -3.5211 63.546000 Cu 0.594671 0.384531 1.2761e-17 375 63.546 0.000683495 -3.52007 63.546000 Cu 0.498028 0.389486 0.5 377 63.546 0.00173499 -3.52243 63.546000 Cu 0.671164 0.355708 4.81549e-19 378 63.546 0.00038192 -3.51885 63.546000 Cu 0.767355 0.350907 0.5 379 63.546 0.000508755 -3.5181 63.546000 Cu 0.786727 0.374969 5.75451e-17 339 63.546 0.00075471 -3.51701 63.546000 Cu 0.690904 0.379687 0.5 380 63.546 0.00173983 -3.51664 63.546000 Cu 0.978632 0.365503 0 341 63.546 0.00102365 -3.52109 63.546000 Cu 0.882603 0.370279 0.5 343 63.546 0.000322423 -3.51966 63.546000 Cu 0.998018 0.389484 0.5 364 63.546 0.00173216 -3.52244 63.546000 Cu 0.114754 0.40839 0.5 369 63.546 0.0070975 -3.5171 63.546000 Cu 0.134205 0.432284 0 387 63.546 0.0246093 -3.50896 63.546000 Cu 0.0177524 0.41326 0 363 63.546 0.00239211 -3.51845 63.546000 Cu 0.210726 0.40377 1.99843e-17 367 63.546 0.00492583 -3.51523 63.546000 Cu 0.306027 0.399187 0.5 373 63.546 0.0012717 -3.51789 63.546000 Cu 0.229923 0.428168 0.5 389 63.546 0.00906978 -3.52124 63.546000 Cu 0.325064 0.423572 0 391 63.546 0.0133772 -3.5226 63.546000 Cu 0.401596 0.394409 0 371 63.546 0.00379398 -3.52093 63.546000 Cu 0.420914 0.418446 0.5 393 63.546 0.00884248 -3.52048 63.546000 Cu 0.517756 0.41326 2.40774e-19 395 63.546 0.00242218 -3.51847 63.546000 Cu 0.61475 0.408391 0.5 397 63.546 0.0070386 -3.51715 63.546000 Cu 0.710726 0.403769 2.40774e-19 399 63.546 0.00498282 -3.51524 63.546000 Cu 0.634205 0.432289 5.75451e-17 396 63.546 0.0242244 -3.50893 63.546000 Cu 0.729923 0.428169 0.5 400 63.546 0.00905128 -3.52121 63.546000 Cu 0.806014 0.399185 0.5 361 63.546 0.00128092 -3.51789 63.546000 Cu 0.90159 0.394405 4.81549e-19 362 63.546 0.00374893 -3.52094 63.546000 Cu 0.825055 0.42357 0 360 63.546 0.0134331 -3.52258 63.546000 Cu 0.920912 0.418443 0.5 365 63.546 0.00880816 -3.52047 63.546000 Cu 0.0379247 0.43687 0.5 385 63.546 0.0322248 -3.50517 63.546000 Cu 0.0590817 0.460968 3.9487e-17 384 63.546 0.14952 -3.49737 63.546000 Cu 0.151636 0.456682 0.5 390 63.546 0.10104 -3.51592 63.546000 Cu 0.247082 0.452742 2.40774e-19 388 63.546 0.0687095 -3.53255 63.546000 Cu 0.344629 0.447727 0.5 394 63.546 0.0484773 -3.52768 63.546000 Cu 0.261719 0.476486 0.5 406 63.546 0.808781 -3.45727 63.546000 Cu 0.365987 0.471147 8.66788e-17 407 63.546 0.0658399 -3.53212 63.546000 Cu 0.441722 0.442269 4.81549e-19 392 63.546 0.00603512 -3.51716 63.546000 Cu 0.537938 0.436875 0.5 398 63.546 0.0319813 -3.50517 63.546000 Cu 0.465212 0.465937 0.5 409 63.546 0.123363 -3.50523 63.546000 Cu 0.559112 0.46097 2.40774e-19 411 63.546 0.150112 -3.49731 63.546000 Cu 0.747093 0.45274 5.75451e-17 8 63.546 0.0681364 -3.53254 63.546000 Cu 0.761754 0.476489 0.5 2 63.546 0.805854 -3.45743 63.546000 Cu 0.651633 0.45668 0.5 207 63.546 0.101814 -3.51593 63.546000 Cu 0.844626 0.447724 0.5 382 63.546 0.048143 -3.52766 63.546000 Cu 0.941718 0.442264 5.75451e-17 383 63.546 0.00599813 -3.51716 63.546000 Cu 0.865982 0.471147 2.40774e-19 381 63.546 0.0652563 -3.53231 63.546000 Cu 0.965206 0.465935 0.5 386 63.546 0.123357 -3.50518 63.546000 Cu 0.082268 0.48732 0.5 404 63.546 0.430993 -3.43273 63.546000 Cu 0.168804 0.482939 4.81549e-19 405 63.546 0.715306 -3.4024 63.546000 Cu 0.0987069 0.514602 4.81549e-19 3 63.546 2.25409 -3.46586 63.546000 Cu 0.196153 0.514501 0.5 5 63.546 7.60724 -3.36958 63.546000 Cu 0.381723 0.494098 0.5 410 63.546 3.5471 -3.40539 63.546000 Cu 0.284922 0.49865 3.2023e-17 6 63.546 9.30161 -3.21407 63.546000 Cu 0.582285 0.487324 0.5 203 63.546 0.431824 -3.43267 63.546000 Cu 0.488433 0.489714 3.90054e-17 408 63.546 0.684112 -3.49003 63.546000 Cu 0.403985 0.514591 2.09955e-16 9 63.546 7.49541 -3.1932 63.546000 Cu 0.499489 0.514568 0.5 11 63.546 1.60002 -3.51343 63.546000 Cu 0.598714 0.514598 2.35959e-17 13 63.546 2.25674 -3.466 63.546000 Cu 0.668797 0.48294 5.75451e-17 412 63.546 0.715861 -3.40252 63.546000 Cu 0.784978 0.498658 4.81549e-19 401 63.546 9.29571 -3.21373 63.546000 Cu 0.696174 0.514503 0.5 15 63.546 7.60429 -3.36953 63.546000 Cu 0.881729 0.4941 0.5 402 63.546 3.54554 -3.4051 63.546000 Cu 0.988437 0.489708 4.81549e-19 403 63.546 0.687328 -3.49 63.546000 Cu 0.999498 0.514571 0.5 4 63.546 1.60121 -3.51361 63.546000 Cu 0.903926 0.514583 1 1 63.546 7.481 -3.19323 63.546000 Cu 0.0831053 0.541754 0.5 23 63.546 0.441088 -3.43669 63.546000 Cu 0.169737 0.546139 3.61162e-18 25 63.546 0.723438 -3.39999 63.546000 Cu 0.285725 0.530505 4.76733e-17 7 63.546 9.2775 -3.21398 63.546000 Cu 0.382741 0.535146 0.5 12 63.546 3.45278 -3.4016 63.546000 Cu 0.26298 0.552713 0.5 28 63.546 0.814697 -3.45259 63.546000 Cu 0.367171 0.558021 0 29 63.546 0.0594355 -3.53221 63.546000 Cu 0.489142 0.539392 0 10 63.546 0.664271 -3.49321 63.546000 Cu 0.583089 0.54175 0.5 16 63.546 0.43957 -3.43674 63.546000 Cu 0.466562 0.563192 0.5 31 63.546 0.125704 -3.50615 63.546000 Cu 0.78575 0.530497 5.75451e-17 17 63.546 9.27151 -3.21377 63.546000 Cu 0.669746 0.546138 0 14 63.546 0.72232 -3.40021 63.546000 Cu 0.762971 0.552715 0.5 20 63.546 0.815394 -3.45264 63.546000 Cu 0.989156 0.539401 9.63097e-19 21 63.546 0.666539 -3.49356 63.546000 Cu 0.88273 0.535148 0.5 19 63.546 3.45382 -3.40186 63.546000 Cu 0.867169 0.558024 5.75451e-17 18 63.546 0.0593161 -3.53215 63.546000 Cu 0.966556 0.563195 0.5 24 63.546 0.125506 -3.50621 63.546000 Cu 0.0604866 0.568052 4.81549e-19 22 63.546 0.137365 -3.49664 63.546000 Cu 0.152986 0.572389 0.5 26 63.546 0.101056 -3.5151 63.546000 Cu 0.0398608 0.592185 0.5 43 63.546 0.0298558 -3.50469 63.546000 Cu 0.136042 0.596768 1.22073e-16 45 63.546 0.0219876 -3.50875 63.546000 Cu 0.248541 0.576398 6.78984e-17 27 63.546 0.0671174 -3.5318 63.546000 Cu 0.346369 0.581412 0.5 32 63.546 0.0448669 -3.52797 63.546000 Cu 0.231819 0.600905 0.5 48 63.546 0.00789742 -3.52205 63.546000 Cu 0.327245 0.605516 5.75451e-17 49 63.546 0.0129747 -3.52306 63.546000 Cu 0.443621 0.586846 2.74483e-17 30 63.546 0.00621943 -3.51693 63.546000 Cu 0.560483 0.568049 4.81549e-17 33 63.546 0.136857 -3.49677 63.546000 Cu 0.539853 0.592185 0.5 36 63.546 0.0299631 -3.50469 63.546000 Cu 0.653 0.572387 0.5 35 63.546 0.100463 -3.51511 63.546000 Cu 0.748523 0.576395 0 37 63.546 0.0677031 -3.5317 63.546000 Cu 0.636043 0.596769 0 34 63.546 0.0221894 -3.50874 63.546000 Cu 0.731809 0.600905 0.5 40 63.546 0.00790298 -3.52204 63.546000 Cu 0.846362 0.581412 0.5 39 63.546 0.0449671 -3.528 63.546000 Cu 0.943614 0.586846 0 41 63.546 0.00621221 -3.51697 63.546000 Cu 0.827241 0.605518 0 38 63.546 0.0128812 -3.52304 63.546000 Cu 0.020183 0.615824 7.43993e-17 42 63.546 0.00258699 -3.51772 63.546000 Cu 0.117119 0.620664 0.5 46 63.546 0.00578943 -3.51705 63.546000 Cu 0.00101766 0.639617 0.5 63 63.546 0.00107108 -3.52203 63.546000 Cu 0.0976617 0.644534 2.40774e-19 65 63.546 0.000666342 -3.5199 63.546000 Cu 0.193994 0.649326 0.5 67 63.546 0.00109914 -3.51683 63.546000 Cu 0.213221 0.625257 0 47 63.546 0.0039218 -3.51577 63.546000 Cu 0.308725 0.629858 0.5 52 63.546 0.00125704 -3.51824 63.546000 Cu 0.40451 0.634674 2.40774e-19 50 63.546 0.00286415 -3.52083 63.546000 Cu 0.423357 0.610647 0.5 51 63.546 0.00706041 -3.52025 63.546000 Cu 0.520175 0.615822 0 53 63.546 0.00259933 -3.51772 63.546000 Cu 0.501014 0.639618 0.5 56 63.546 0.00105376 -3.52204 63.546000 Cu 0.597659 0.644536 0 54 63.546 0.000677818 -3.51991 63.546000 Cu 0.617122 0.620661 0.5 55 63.546 0.00580135 -3.51707 63.546000 Cu 0.713213 0.625255 5.75451e-17 57 63.546 0.00387655 -3.51576 63.546000 Cu 0.693981 0.649326 0.5 60 63.546 0.00109392 -3.51683 63.546000 Cu 0.923345 0.61065 0.5 44 63.546 0.00707507 -3.52027 63.546000 Cu 0.808721 0.629856 0.5 59 63.546 0.00125549 -3.51825 63.546000 Cu 0.904501 0.634673 1.22795e-16 61 63.546 0.00292527 -3.52083 63.546000 Cu 0.0784612 0.668467 0.5 68 63.546 9.54787e-05 -3.52034 63.546000 Cu 0.174778 0.673319 1.08348e-17 66 63.546 0.000189038 -3.51883 63.546000 Cu 0.0593471 0.692457 0 85 63.546 9.70912e-05 -3.51988 63.546000 Cu 0.289945 0.654045 4.81549e-19 69 63.546 0.000432951 -3.51704 63.546000 Cu 0.270959 0.678107 0.5 72 63.546 0.000202788 -3.51823 63.546000 Cu 0.385898 0.658777 0.5 71 63.546 0.000342999 -3.51943 63.546000 Cu 0.367037 0.682865 0 70 63.546 3.71189e-05 -3.51884 63.546000 Cu 0.482066 0.663592 1.22073e-16 73 63.546 0.000535485 -3.52102 63.546000 Cu 0.578453 0.668466 0.5 75 63.546 0.000100682 -3.5203 63.546000 Cu 0.559339 0.692458 1.22073e-16 74 63.546 9.44393e-05 -3.5199 63.546000 Cu 0.463126 0.687637 0.5 76 63.546 0.00012474 -3.51971 63.546000 Cu 0.674768 0.673318 2.40774e-19 77 63.546 0.000177221 -3.51882 63.546000 Cu 0.789935 0.654047 2.40774e-19 58 63.546 0.000450735 -3.51708 63.546000 Cu 0.770957 0.678106 0.5 79 63.546 0.000201917 -3.51821 63.546000 Cu 0.982065 0.663592 2.40774e-19 62 63.546 0.000528963 -3.52105 63.546000 Cu 0.885893 0.658778 0.5 64 63.546 0.000338403 -3.51945 63.546000 Cu 0.867036 0.682864 5.75451e-17 81 63.546 3.62244e-05 -3.51882 63.546000 Cu 0.963134 0.687635 0.5 83 63.546 0.000124174 -3.51969 63.546000 Cu 0.136503 0.721291 0 86 63.546 5.04008e-05 -3.51963 63.546000 Cu 0.155632 0.697299 0.5 87 63.546 7.70513e-06 -3.51947 63.546000 Cu 0.0402987 0.716473 0.5 88 63.546 7.25848e-05 -3.51949 63.546000 Cu 0.251898 0.702126 0 89 63.546 0.000106728 -3.51909 63.546000 Cu 0.348033 0.706915 0.5 91 63.546 4.782e-05 -3.51899 63.546000 Cu 0.232756 0.726127 0.5 92 63.546 1.11124e-05 -3.51936 63.546000 Cu 0.328992 0.730943 1.22073e-16 90 63.546 5.50868e-05 -3.51915 63.546000 Cu 0.444159 0.711688 9.63097e-18 93 63.546 6.71457e-06 -3.51926 63.546000 Cu 0.540297 0.716476 0.5 95 63.546 6.66711e-05 -3.51948 63.546000 Cu 0.425184 0.735731 0.5 96 63.546 3.81258e-05 -3.51906 63.546000 Cu 0.751894 0.702124 9.63097e-19 78 63.546 0.000101667 -3.51911 63.546000 Cu 0.655621 0.697299 0.5 80 63.546 7.08516e-06 -3.51949 63.546000 Cu 0.6365 0.721292 7.22323e-19 97 63.546 5.11541e-05 -3.5196 63.546000 Cu 0.732758 0.726125 0.5 99 63.546 1.02522e-05 -3.51935 63.546000 Cu 0.944166 0.711686 4.81549e-19 82 63.546 6.41533e-06 -3.51926 63.546000 Cu 0.848034 0.706913 0.5 84 63.546 4.62676e-05 -3.519 63.546000 Cu 0.828993 0.73094 3.2023e-17 101 63.546 5.04673e-05 -3.51913 63.546000 Cu 0.925182 0.735728 0.5 103 63.546 3.61607e-05 -3.51905 63.546000 Cu 0.0213019 0.740511 0 105 63.546 1.17866e-05 -3.51928 63.546000 Cu 0.0984185 0.769328 0 106 63.546 2.14679e-05 -3.51913 63.546000 Cu 0.117466 0.745315 0.5 107 63.546 1.57726e-05 -3.5195 63.546000 Cu 0.00224165 0.764539 0.5 108 63.546 6.31998e-06 -3.51899 63.546000 Cu 0.194601 0.774129 0.5 109 63.546 1.90303e-05 -3.51943 63.546000 Cu 0.213672 0.750125 0 110 63.546 9.09163e-06 -3.51946 63.546000 Cu 0.309918 0.754944 0.5 112 63.546 1.97618e-05 -3.51929 63.546000 Cu 0.290777 0.778943 2.40774e-19 111 63.546 2.28235e-06 -3.51957 63.546000 Cu 0.521308 0.740512 1.22073e-16 94 63.546 1.18371e-05 -3.51928 63.546000 Cu 0.406094 0.75975 5.75451e-17 113 63.546 2.14878e-05 -3.51903 63.546000 Cu 0.502249 0.764541 0.5 115 63.546 7.56864e-06 -3.519 63.546000 Cu 0.598428 0.76933 1.22554e-16 117 63.546 2.12766e-05 -3.51914 63.546000 Cu 0.713681 0.750123 7.22323e-19 98 63.546 9.82454e-06 -3.51947 63.546000 Cu 0.617473 0.745314 0.5 100 63.546 1.46637e-05 -3.51951 63.546000 Cu 0.694608 0.774131 0.5 119 63.546 1.77235e-05 -3.51945 63.546000 Cu 0.79078 0.778943 2.40774e-19 121 63.546 1.95044e-06 -3.51958 63.546000 Cu 0.906091 0.759747 5.08034e-17 102 63.546 1.85767e-05 -3.51904 63.546000 Cu 0.809921 0.754942 0.5 104 63.546 1.8807e-05 -3.51931 63.546000 Cu 0.0601472 0.817378 1.22554e-16 126 63.546 2.85571e-05 -3.51893 63.546000 Cu 0.0792501 0.793339 0.5 127 63.546 3.70621e-05 -3.51886 63.546000 Cu 0.175409 0.798134 1.44465e-18 129 63.546 2.68855e-05 -3.519 63.546000 Cu 0.156262 0.822145 0.5 130 63.546 0.000111947 -3.51865 63.546000 Cu 0.271633 0.802942 0.5 132 63.546 1.81959e-05 -3.51949 63.546000 Cu 0.367905 0.807774 2.64852e-18 133 63.546 6.46271e-05 -3.51985 63.546000 Cu 0.38695 0.783757 0.5 116 63.546 2.26445e-05 -3.51952 63.546000 Cu 0.483144 0.788557 4.81549e-19 114 63.546 1.69295e-05 -3.51911 63.546000 Cu 0.464075 0.812596 0.5 135 63.546 6.68653e-05 -3.51944 63.546000 Cu 0.560152 0.81738 4.81549e-19 137 63.546 2.78946e-05 -3.51894 63.546000 Cu 0.579259 0.793341 0.5 120 63.546 3.44806e-05 -3.51885 63.546000 Cu 0.675417 0.798136 2.40774e-19 118 63.546 2.42698e-05 -3.51899 63.546000 Cu 0.771638 0.802944 0.5 124 63.546 1.81055e-05 -3.51947 63.546000 Cu 0.656269 0.822147 0.5 139 63.546 0.000109034 -3.51865 63.546000 Cu 0.983137 0.788556 1.92619e-18 125 63.546 1.57961e-05 -3.51911 63.546000 Cu 0.867906 0.807775 3.25045e-17 122 63.546 6.51758e-05 -3.51983 63.546000 Cu 0.886947 0.783757 0.5 123 63.546 2.20951e-05 -3.51953 63.546000 Cu 0.964071 0.812595 0.5 128 63.546 6.50938e-05 -3.51943 63.546000 Cu 0.0411063 0.841453 0.5 147 63.546 0.000184701 -3.51957 63.546000 Cu 0.13709 0.846201 6.01936e-18 149 63.546 8.5043e-05 -3.51878 63.546000 Cu 0.0219101 0.865534 2.11881e-17 146 63.546 0.00095596 -3.52104 63.546000 Cu 0.252427 0.826932 2.40774e-19 131 63.546 0.000134047 -3.519 63.546000 Cu 0.348757 0.831772 0.5 136 63.546 0.000113543 -3.51972 63.546000 Cu 0.233142 0.850934 0.5 152 63.546 0.000483409 -3.51811 63.546000 Cu 0.32936 0.855738 3.00968e-17 153 63.546 0.00035612 -3.51893 63.546000 Cu 0.445015 0.836637 0 134 63.546 0.000354077 -3.51987 63.546000 Cu 0.541106 0.841454 0.5 140 63.546 0.000185327 -3.51957 63.546000 Cu 0.425695 0.860639 0.5 155 63.546 0.000363692 -3.52034 63.546000 Cu 0.521908 0.865534 0 157 63.546 0.00094839 -3.52104 63.546000 Cu 0.637093 0.846203 4.18947e-17 138 63.546 8.22827e-05 -3.51878 63.546000 Cu 0.752432 0.826933 0 141 63.546 0.000132016 -3.51899 63.546000 Cu 0.733145 0.850935 0.5 144 63.546 0.000476245 -3.51811 63.546000 Cu 0.829363 0.85574 2.69667e-17 142 63.546 0.000351633 -3.51894 63.546000 Cu 0.848762 0.831773 0.5 143 63.546 0.000117996 -3.51972 63.546000 Cu 0.945017 0.836637 2.40774e-19 145 63.546 0.000356839 -3.51988 63.546000 Cu 0.925698 0.86064 0.5 148 63.546 0.000370579 -3.52035 63.546000 Cu 0.117973 0.870311 0.5 150 63.546 0.000333741 -3.5196 63.546000 Cu 0.00260274 0.889528 0.5 167 63.546 0.00177353 -3.52256 63.546000 Cu 0.0990273 0.894455 4.81549e-19 169 63.546 0.00386403 -3.52088 63.546000 Cu 0.194583 0.89923 0.5 171 63.546 0.00121891 -3.51785 63.546000 Cu 0.213847 0.875003 4.81549e-19 151 63.546 0.000798477 -3.51695 63.546000 Cu 0.309698 0.879721 0.5 156 63.546 0.00178235 -3.51668 63.546000 Cu 0.289914 0.903815 7.22323e-19 173 63.546 0.00477419 -3.51517 63.546000 Cu 0.385874 0.908442 0.5 175 63.546 0.00693904 -3.51708 63.546000 Cu 0.405948 0.884572 0 154 63.546 0.000656165 -3.52015 63.546000 Cu 0.502598 0.889527 0.5 160 63.546 0.00176197 -3.52257 63.546000 Cu 0.599023 0.894454 2.40774e-19 158 63.546 0.00384354 -3.52089 63.546000 Cu 0.617972 0.870312 0.5 159 63.546 0.000334725 -3.5196 63.546000 Cu 0.713848 0.875004 0 161 63.546 0.00078982 -3.51695 63.546000 Cu 0.694581 0.89923 0.5 164 63.546 0.00121919 -3.51784 63.546000 Cu 0.789916 0.903816 2.40774e-19 162 63.546 0.00476538 -3.51516 63.546000 Cu 0.809699 0.879722 0.5 163 63.546 0.00177015 -3.51668 63.546000 Cu 0.905951 0.884573 0 165 63.546 0.000652364 -3.52015 63.546000 Cu 0.885879 0.908443 0.5 168 63.546 0.00690775 -3.51708 63.546000 Cu 0.0797177 0.918504 0.5 172 63.546 0.00906031 -3.52048 63.546000 Cu 0.0589019 0.942341 1.87804e-17 189 63.546 0.00635351 -3.51727 63.546000 Cu 0.155971 0.947803 0.5 191 63.546 0.0490688 -3.52771 63.546000 Cu 0.175564 0.923625 5.75451e-17 170 63.546 0.0130956 -3.52256 63.546000 Cu 0.366359 0.932334 0 174 63.546 0.0254555 -3.50903 63.546000 Cu 0.270678 0.928218 0.5 176 63.546 0.00872223 -3.521 63.546000 Cu 0.253435 0.952815 1.03533e-17 193 63.546 0.0684978 -3.53239 63.546000 Cu 0.482884 0.913321 1.44465e-17 177 63.546 0.00240784 -3.51857 63.546000 Cu 0.558901 0.94234 1.22073e-16 178 63.546 0.0063452 -3.51728 63.546000 Cu 0.462688 0.936931 0.5 180 63.546 0.0323904 -3.50537 63.546000 Cu 0.579715 0.918503 0.5 179 63.546 0.00905847 -3.52049 63.546000 Cu 0.675563 0.923624 0 181 63.546 0.0130749 -3.52256 63.546000 Cu 0.753435 0.952813 1.22073e-16 182 63.546 0.0683685 -3.53239 63.546000 Cu 0.655971 0.947802 0.5 184 63.546 0.049067 -3.52771 63.546000 Cu 0.77068 0.928218 0.5 183 63.546 0.00870502 -3.521 63.546000 Cu 0.982888 0.913322 0 166 63.546 0.00240803 -3.51857 63.546000 Cu 0.866362 0.932334 0 185 63.546 0.02545 -3.50903 63.546000 Cu 0.962692 0.936932 0.5 187 63.546 0.0323313 -3.50536 63.546000 Cu 0.11875 0.994211 0.5 214 63.546 3.56935 -3.40563 63.546000 Cu 0.134543 0.971239 5.75451e-17 190 63.546 0.0657515 -3.53254 63.546000 Cu 0.0353315 0.96601 0.5 192 63.546 0.122158 -3.50486 63.546000 Cu 0.0119712 0.989773 1.44465e-17 206 63.546 0.690109 -3.4892 63.546000 Cu 0.215503 0.998769 7.22323e-19 213 63.546 9.30084 -3.21349 63.546000 Cu 0.331657 0.983003 0 194 63.546 0.717398 -3.40257 63.546000 Cu 0.348841 0.956747 0.5 195 63.546 0.0993825 -3.51616 63.546000 Cu 0.238771 0.976577 0.5 196 63.546 0.808086 -3.45825 63.546000 Cu 0.441441 0.961031 6.98246e-18 197 63.546 0.149866 -3.49756 63.546000 Cu 0.511976 0.989772 2.40774e-19 198 63.546 0.689959 -3.48921 63.546000 Cu 0.535333 0.966009 0.5 199 63.546 0.122231 -3.50487 63.546000 Cu 0.418165 0.987369 0.5 200 63.546 0.430362 -3.43183 63.546000 Cu 0.715503 0.99877 8.16225e-17 208 63.546 9.3009 -3.21354 63.546000 Cu 0.618751 0.994211 0.5 233 63.546 3.56946 -3.40564 63.546000 Cu 0.634547 0.971238 6.42868e-17 201 63.546 0.065612 -3.53255 63.546000 Cu 0.738772 0.976576 0.5 202 63.546 0.808323 -3.45826 63.546000 Cu 0.941441 0.961031 2.86521e-17 186 63.546 0.149908 -3.49756 63.546000 Cu 0.848841 0.956746 0.5 188 63.546 0.0993667 -3.51617 63.546000 Cu 0.831655 0.983002 2.40774e-19 204 63.546 0.717574 -3.40256 63.546000 Cu 0.918163 0.987368 0.5 205 63.546 0.430511 -3.43182