Number of particles = 398 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.023 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.3079 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62329 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 0.0990146 0.0446581 1 210 63.546 0.0711661 -3.54379 63.546000 Cu 0.0399584 0.024281 0.5 211 63.546 0.0905492 -3.53697 63.546000 Cu 0.119698 0.00828551 1 213 63.546 0.316696 -3.52876 63.546000 Cu 0.177159 0.0301173 0.5 215 63.546 0.0925836 -3.52569 63.546000 Cu 0.237309 0.0519156 4.78771e-19 227 63.546 0.081675 -3.52176 63.546000 Cu 0.256188 0.0180369 4.78771e-19 214 63.546 0.518128 -3.47276 63.546000 Cu 0.338017 0.0037793 0.5 216 63.546 0.489687 -3.50016 63.546000 Cu 0.317784 0.0375993 0.5 229 63.546 0.129633 -3.52298 63.546000 Cu 0.399141 0.0219068 1.80257e-16 231 63.546 0.0273572 -3.53255 63.546000 Cu 0.480094 0.00526001 0.5 233 63.546 0.0501624 -3.52638 63.546000 Cu 0.459569 0.0406248 0.5 234 63.546 0.0150596 -3.53812 63.546000 Cu 0.539958 0.024281 0 232 63.546 0.0905492 -3.53697 63.546000 Cu 0.619698 0.00828551 0.5 235 63.546 0.316696 -3.52876 63.546000 Cu 0.599015 0.0446581 0.5 255 63.546 0.0711661 -3.54379 63.546000 Cu 0.677159 0.0301173 2.42976e-16 257 63.546 0.0925836 -3.52569 63.546000 Cu 0.737309 0.0519156 0.5 260 63.546 0.081675 -3.52176 63.546000 Cu 0.756188 0.0180369 0.5 259 63.546 0.518128 -3.47276 63.546000 Cu 0.838017 0.0037793 1 203 63.546 0.489687 -3.50016 63.546000 Cu 0.980094 0.00526001 1 204 63.546 0.0501624 -3.52638 63.546000 Cu 0.899141 0.0219068 0.5 205 63.546 0.0273572 -3.53255 63.546000 Cu 0.959569 0.0406248 1 209 63.546 0.0150596 -3.53812 63.546000 Cu 0.817784 0.0375993 2.27416e-17 258 63.546 0.129633 -3.52298 63.546000 Cu 0.0194686 0.0600932 0.5 212 63.546 0.0310634 -3.54283 63.546000 Cu 0.0791677 0.080337 1.22086e-16 223 63.546 0.0177562 -3.54314 63.546000 Cu 0.218401 0.0864388 0 224 63.546 0.0152219 -3.53388 63.546000 Cu 0.158177 0.0656528 0.5 225 63.546 0.0140515 -3.53821 63.546000 Cu 0.139094 0.100877 0.5 226 63.546 0.00285145 -3.53984 63.546000 Cu 0.378879 0.0565742 1.22086e-17 228 63.546 0.0126841 -3.53579 63.546000 Cu 0.298349 0.0718713 0.5 230 63.546 0.0360935 -3.5315 63.546000 Cu 0.279266 0.10648 0.5 247 63.546 0.00938263 -3.53608 63.546000 Cu 0.359274 0.0913537 1.93902e-17 249 63.546 0.00485162 -3.53794 63.546000 Cu 0.499705 0.0955508 0 250 63.546 0.00959522 -3.54259 63.546000 Cu 0.439472 0.0758162 0.5 251 63.546 0.00555015 -3.54055 63.546000 Cu 0.419998 0.110946 0.5 252 63.546 0.00178962 -3.54089 63.546000 Cu 0.519469 0.0600932 7.13368e-17 253 63.546 0.0310634 -3.54283 63.546000 Cu 0.658177 0.0656528 6.5831e-17 254 63.546 0.0140515 -3.53821 63.546000 Cu 0.579168 0.080337 0.5 256 63.546 0.0177562 -3.54314 63.546000 Cu 0.639094 0.100877 1.21847e-16 281 63.546 0.00285145 -3.53984 63.546000 Cu 0.718401 0.0864388 0.5 283 63.546 0.0152219 -3.53388 63.546000 Cu 0.878879 0.0565742 0.5 207 63.546 0.0126841 -3.53579 63.546000 Cu 0.939472 0.0758162 1 206 63.546 0.00555015 -3.54055 63.546000 Cu 0.859274 0.0913537 0.5 208 63.546 0.00485162 -3.53794 63.546000 Cu 0.919998 0.110946 1.22565e-16 219 63.546 0.00178962 -3.54089 63.546000 Cu 0.999705 0.0955508 0.5 221 63.546 0.00959522 -3.54259 63.546000 Cu 0.779266 0.10648 4.285e-17 282 63.546 0.00938263 -3.53608 63.546000 Cu 0.798349 0.0718713 1 285 63.546 0.0360935 -3.5315 63.546000 Cu 0.0599007 0.11571 9.57541e-19 220 63.546 0.00447696 -3.54184 63.546000 Cu 0.0411096 0.150905 1 241 63.546 0.0010296 -3.54105 63.546000 Cu 0.18116 0.156164 2.13053e-17 242 63.546 0.000763313 -3.53876 63.546000 Cu 0.12035 0.135986 0.5 243 63.546 0.000752952 -3.53993 63.546000 Cu 0.199639 0.121259 1 245 63.546 0.00364648 -3.53752 63.546000 Cu 0.260608 0.141282 0.5 248 63.546 0.00222598 -3.53805 63.546000 Cu 0.340232 0.126224 2.39385e-19 246 63.546 0.0013639 -3.53899 63.546000 Cu 0.321561 0.161158 0 273 63.546 0.000479758 -3.53933 63.546000 Cu 0.461737 0.165966 1 274 63.546 0.000577581 -3.54092 63.546000 Cu 0.401108 0.146025 0.5 275 63.546 0.000492371 -3.54053 63.546000 Cu 0.480555 0.130818 2.39385e-19 277 63.546 0.002506 -3.54166 63.546000 Cu 0.62035 0.135986 1 278 63.546 0.000752952 -3.53993 63.546000 Cu 0.559901 0.11571 0.5 279 63.546 0.00447696 -3.54184 63.546000 Cu 0.54111 0.150905 0.5 280 63.546 0.0010296 -3.54105 63.546000 Cu 0.699639 0.121259 0.5 284 63.546 0.00364648 -3.53752 63.546000 Cu 0.68116 0.156164 0.5 307 63.546 0.000763313 -3.53876 63.546000 Cu 0.760608 0.141282 2.27416e-17 309 63.546 0.00222598 -3.53805 63.546000 Cu 0.901108 0.146025 1.21847e-16 217 63.546 0.000492371 -3.54053 63.546000 Cu 0.840232 0.126224 0.5 218 63.546 0.0013639 -3.53899 63.546000 Cu 0.980555 0.130818 0.5 222 63.546 0.002506 -3.54166 63.546000 Cu 0.961737 0.165966 0.5 239 63.546 0.000577581 -3.54092 63.546000 Cu 0.821561 0.161158 0.5 310 63.546 0.000479758 -3.53933 63.546000 Cu 0.0222112 0.186015 7.18156e-19 238 63.546 0.000250411 -3.54076 63.546000 Cu 0.101718 0.171032 0.5 244 63.546 0.000279682 -3.54009 63.546000 Cu 0.0826177 0.20607 0.5 267 63.546 0.000129735 -3.53998 63.546000 Cu 0.162284 0.191114 1 269 63.546 0.000182585 -3.53933 63.546000 Cu 0.24193 0.176174 0.5 271 63.546 0.00050149 -3.53888 63.546000 Cu 0.222776 0.211114 0.5 272 63.546 2.42593e-05 -3.53919 63.546000 Cu 0.00292766 0.221103 1.21847e-16 265 63.546 1.96656e-05 -3.54049 63.546000 Cu 0.302537 0.196132 0 270 63.546 0.000193286 -3.53957 63.546000 Cu 0.382188 0.181072 0.5 276 63.546 0.000204582 -3.54034 63.546000 Cu 0.362917 0.216125 0.5 299 63.546 8.26191e-05 -3.54021 63.546000 Cu 0.442626 0.201075 0 301 63.546 7.90878e-05 -3.54078 63.546000 Cu 0.502928 0.221103 0.5 304 63.546 1.96656e-05 -3.54049 63.546000 Cu 0.582618 0.20607 2.27416e-17 302 63.546 0.000129735 -3.53998 63.546000 Cu 0.522211 0.186015 0.5 303 63.546 0.000250411 -3.54076 63.546000 Cu 0.601718 0.171032 1 305 63.546 0.000279682 -3.54009 63.546000 Cu 0.74193 0.176174 1 306 63.546 0.00050149 -3.53888 63.546000 Cu 0.662284 0.191114 0.5 308 63.546 0.000182585 -3.53933 63.546000 Cu 0.722776 0.211114 4.35681e-17 333 63.546 2.42593e-05 -3.53919 63.546000 Cu 0.862917 0.216125 1.21368e-16 236 63.546 8.26191e-05 -3.54021 63.546000 Cu 0.882188 0.181072 2.27416e-17 237 63.546 0.000204582 -3.54034 63.546000 Cu 0.942626 0.201075 0.5 240 63.546 7.90878e-05 -3.54078 63.546000 Cu 0.802537 0.196132 0.5 334 63.546 0.000193286 -3.53957 63.546000 Cu 0.142975 0.226082 0 266 63.546 7.67546e-05 -3.53937 63.546000 Cu 0.0632494 0.2411 0.5 268 63.546 0.000150959 -3.54009 63.546000 Cu 0.0441588 0.276143 0.5 291 63.546 0.000171781 -3.54045 63.546000 Cu 0.123819 0.261049 1.22326e-16 293 63.546 0.000326962 -3.53954 63.546000 Cu 0.203455 0.246068 0.5 295 63.546 0.00017011 -3.5391 63.546000 Cu 0.264033 0.266092 4.38075e-17 294 63.546 0.000225067 -3.53939 63.546000 Cu 0.283179 0.231112 0 297 63.546 6.91402e-05 -3.53957 63.546000 Cu 0.423211 0.236163 2.27416e-17 298 63.546 0.000146998 -3.54059 63.546000 Cu 0.343589 0.251165 0.5 300 63.546 0.000162351 -3.54016 63.546000 Cu 0.404074 0.271248 6.22402e-18 325 63.546 0.000545064 -3.54063 63.546000 Cu 0.483606 0.256182 0.5 327 63.546 0.000230835 -3.54068 63.546000 Cu 0.544159 0.276143 1 326 63.546 0.000171781 -3.54045 63.546000 Cu 0.563249 0.2411 1 329 63.546 0.000150959 -3.54009 63.546000 Cu 0.703455 0.246068 1 330 63.546 0.00017011 -3.5391 63.546000 Cu 0.642975 0.226082 0.5 331 63.546 7.67546e-05 -3.53937 63.546000 Cu 0.623819 0.261049 0.5 332 63.546 0.000326962 -3.53954 63.546000 Cu 0.764033 0.266092 0.5 359 63.546 0.000225067 -3.53939 63.546000 Cu 0.843589 0.251165 2.27416e-17 261 63.546 0.000162351 -3.54016 63.546000 Cu 0.983606 0.256182 2.27416e-17 262 63.546 0.000230835 -3.54068 63.546000 Cu 0.923211 0.236163 0.5 263 63.546 0.000146998 -3.54059 63.546000 Cu 0.904074 0.271248 0.5 264 63.546 0.000545064 -3.54063 63.546000 Cu 0.783179 0.231112 0.5 335 63.546 6.91402e-05 -3.53957 63.546000 Cu 0.104929 0.296024 1 290 63.546 0.000703825 -3.53946 63.546000 Cu 0.0253246 0.311187 0.5 292 63.546 0.000450991 -3.54054 63.546000 Cu 0.184513 0.281007 0.5 296 63.546 0.000867481 -3.53894 63.546000 Cu 0.0860851 0.330939 2.27416e-17 317 63.546 0.00216909 -3.53875 63.546000 Cu 0.16582 0.315905 0.5 319 63.546 0.00313598 -3.53785 63.546000 Cu 0.245285 0.301069 7.18156e-19 321 63.546 0.000644707 -3.53878 63.546000 Cu 0.385211 0.306358 1 322 63.546 0.00157317 -3.54113 63.546000 Cu 0.324652 0.28621 0.5 323 63.546 0.000262424 -3.54014 63.546000 Cu 0.305974 0.321274 0.5 324 63.546 0.00102641 -3.53994 63.546000 Cu 0.46463 0.291272 0.5 328 63.546 0.000725243 -3.54102 63.546000 Cu 0.445753 0.326416 0.5 351 63.546 0.00285163 -3.54178 63.546000 Cu 0.525325 0.311187 1 353 63.546 0.000450991 -3.54054 63.546000 Cu 0.66582 0.315905 1 354 63.546 0.00313598 -3.53785 63.546000 Cu 0.604929 0.296024 0.5 355 63.546 0.000703825 -3.53946 63.546000 Cu 0.586085 0.330939 0.5 356 63.546 0.00216909 -3.53875 63.546000 Cu 0.684513 0.281007 2.27416e-17 357 63.546 0.000867481 -3.53894 63.546000 Cu 0.745285 0.301069 0.5 360 63.546 0.000644707 -3.53878 63.546000 Cu 0.945753 0.326416 2.27416e-17 286 63.546 0.00285163 -3.54178 63.546000 Cu 0.885211 0.306358 0.5 287 63.546 0.00157317 -3.54113 63.546000 Cu 0.96463 0.291272 2.27416e-17 289 63.546 0.000725243 -3.54102 63.546000 Cu 0.824652 0.28621 2.27416e-17 358 63.546 0.000262424 -3.54014 63.546000 Cu 0.805974 0.321274 9.14452e-17 383 63.546 0.00102641 -3.53994 63.546000 Cu 0.0669446 0.365789 1 314 63.546 0.00602224 -3.53785 63.546000 Cu 0.226612 0.335964 1 318 63.546 0.00335073 -3.53727 63.546000 Cu 0.146999 0.350685 0.5 320 63.546 0.0112992 -3.5358 63.546000 Cu 0.12792 0.385256 0.5 343 63.546 0.0411147 -3.53133 63.546000 Cu 0.207829 0.370749 2.48961e-17 345 63.546 0.0157414 -3.53346 63.546000 Cu 0.00625811 0.346245 0.5 315 63.546 0.00160562 -3.54079 63.546000 Cu 0.347058 0.376904 1 346 63.546 0.0204697 -3.5433 63.546000 Cu 0.287125 0.356375 0.5 347 63.546 0.00360795 -3.53971 63.546000 Cu 0.366285 0.341552 1 349 63.546 0.00574302 -3.54197 63.546000 Cu 0.426472 0.361664 0.5 352 63.546 0.0101307 -3.54246 63.546000 Cu 0.486768 0.381343 0 375 63.546 0.00509693 -3.54045 63.546000 Cu 0.506258 0.346245 7.18156e-19 350 63.546 0.00160562 -3.54079 63.546000 Cu 0.62792 0.385256 1.10117e-17 376 63.546 0.0411147 -3.53133 63.546000 Cu 0.566945 0.365789 0.5 377 63.546 0.00602224 -3.53785 63.546000 Cu 0.646999 0.350685 1 379 63.546 0.0112992 -3.5358 63.546000 Cu 0.726612 0.335964 0.5 381 63.546 0.00335073 -3.53727 63.546000 Cu 0.707829 0.370749 0.5 382 63.546 0.0157414 -3.53346 63.546000 Cu 0.866285 0.341552 0.5 288 63.546 0.00574302 -3.54197 63.546000 Cu 0.847058 0.376904 0.5 312 63.546 0.0204697 -3.5433 63.546000 Cu 0.926472 0.361664 3.59078e-17 313 63.546 0.0101307 -3.54246 63.546000 Cu 0.986768 0.381343 0.5 316 63.546 0.00509693 -3.54045 63.546000 Cu 0.787125 0.356375 2.27416e-17 380 63.546 0.00360795 -3.53971 63.546000 Cu 0.0277362 0.435199 4.78771e-19 338 63.546 0.0289678 -3.533 63.546000 Cu 0.0474876 0.400553 1 341 63.546 0.0141855 -3.53588 63.546000 Cu 0.189116 0.405245 2.39385e-19 342 63.546 0.0845536 -3.52029 63.546000 Cu 0.10881 0.419507 0.5 344 63.546 0.139388 -3.52243 63.546000 Cu 0.17069 0.439067 1 367 63.546 0.550108 -3.4671 63.546000 Cu 0.249545 0.427118 0.5 369 63.546 0.104727 -3.52451 63.546000 Cu 0.268117 0.391592 0.5 348 63.546 0.0167499 -3.53814 63.546000 Cu 0.327464 0.412568 4.78771e-19 371 63.546 0.0767907 -3.54417 63.546000 Cu 0.466989 0.416524 1 372 63.546 0.0146888 -3.53836 63.546000 Cu 0.406888 0.397104 0.5 373 63.546 0.0315411 -3.54295 63.546000 Cu 0.386835 0.432901 0.5 374 63.546 0.0919648 -3.53735 63.546000 Cu 0.547488 0.400553 0.5 378 63.546 0.0141855 -3.53588 63.546000 Cu 0.527736 0.435199 0.5 391 63.546 0.0289678 -3.533 63.546000 Cu 0.60881 0.419507 1 393 63.546 0.139388 -3.52243 63.546000 Cu 0.749545 0.427118 1 394 63.546 0.104727 -3.52451 63.546000 Cu 0.689116 0.405245 0.5 395 63.546 0.0845536 -3.52029 63.546000 Cu 0.67069 0.439067 0.5 396 63.546 0.550108 -3.4671 63.546000 Cu 0.768117 0.391592 2.27416e-17 397 63.546 0.0167499 -3.53814 63.546000 Cu 0.906888 0.397104 1 311 63.546 0.0315411 -3.54295 63.546000 Cu 0.886835 0.432901 1 337 63.546 0.0919648 -3.53735 63.546000 Cu 0.966989 0.416524 0.5 339 63.546 0.0146888 -3.53836 63.546000 Cu 0.827464 0.412568 0.5 398 63.546 0.0767907 -3.54417 63.546000 Cu 0.150526 0.471393 1 364 63.546 7.32596 -3.25656 63.546000 Cu 0.0891852 0.453298 0.5 365 63.546 0.522036 -3.50046 63.546000 Cu 0.0789078 0.487363 0.5 366 63.546 3.15811 -3.47762 63.546000 Cu 0.232253 0.463783 0.5 370 63.546 5.30091 -3.4336 63.546000 Cu 0.00956262 0.469964 1.01739e-16 363 63.546 0.182886 -3.53484 63.546000 Cu 0.307283 0.448918 1 368 63.546 0.329974 -3.53012 63.546000 Cu 0.287091 0.487427 0 385 63.546 4.37469 -3.54783 63.546000 Cu 0.435091 0.487386 1 386 63.546 0.331408 -3.53164 63.546000 Cu 0.368084 0.46933 0.5 387 63.546 0.356536 -3.50813 63.546000 Cu 0.447007 0.451867 1 389 63.546 0.0556081 -3.5272 63.546000 Cu 0.509563 0.469964 0.5 392 63.546 0.182886 -3.53484 63.546000 Cu 0.732253 0.463783 2.27416e-17 16 63.546 5.30091 -3.4336 63.546000 Cu 0.650526 0.471393 0.5 34 63.546 7.32596 -3.25656 63.546000 Cu 0.578908 0.487363 2.27416e-17 202 63.546 3.15811 -3.47762 63.546000 Cu 0.589185 0.453298 1 390 63.546 0.522036 -3.50046 63.546000 Cu 0.787091 0.487427 0.5 3 63.546 4.37469 -3.54783 63.546000 Cu 0.807283 0.448918 0.5 5 63.546 0.329974 -3.53012 63.546000 Cu 0.868084 0.46933 1 336 63.546 0.356536 -3.50813 63.546000 Cu 0.947007 0.451867 0.5 340 63.546 0.0556081 -3.5272 63.546000 Cu 0.935091 0.487386 0.5 362 63.546 0.331408 -3.53164 63.546000 Cu 0.233641 0.511156 0.5 384 63.546 5.31053 -3.43769 63.546000 Cu 0.0107088 0.504763 1 1 63.546 0.170879 -3.53309 63.546000 Cu 0.0911045 0.521358 0.5 2 63.546 0.481343 -3.49936 63.546000 Cu 0.0304639 0.539481 2.39385e-19 9 63.546 0.0282338 -3.53137 63.546000 Cu 0.112377 0.555121 0.5 11 63.546 0.126955 -3.52242 63.546000 Cu 0.151895 0.503201 1 32 63.546 7.325 -3.26542 63.546000 Cu 0.173319 0.535585 1 33 63.546 0.504978 -3.47437 63.546000 Cu 0.449104 0.522887 2.27416e-17 14 63.546 0.0517167 -3.52574 63.546000 Cu 0.30955 0.525899 1 35 63.546 0.314845 -3.53013 63.546000 Cu 0.389755 0.541878 0.5 37 63.546 0.0872282 -3.53671 63.546000 Cu 0.25264 0.547661 0.5 38 63.546 0.0904815 -3.5278 63.546000 Cu 0.369307 0.505519 0.5 388 63.546 0.341083 -3.50697 63.546000 Cu 0.733641 0.511156 1 195 63.546 5.31053 -3.43769 63.546000 Cu 0.651895 0.503201 0.5 4 63.546 7.325 -3.26542 63.546000 Cu 0.510709 0.504763 0.5 15 63.546 0.170879 -3.53309 63.546000 Cu 0.591105 0.521358 1 17 63.546 0.481343 -3.49936 63.546000 Cu 0.612377 0.555121 1 18 63.546 0.126955 -3.52242 63.546000 Cu 0.673319 0.535585 0.5 19 63.546 0.504978 -3.47437 63.546000 Cu 0.530464 0.539481 0.5 20 63.546 0.0282338 -3.53137 63.546000 Cu 0.889755 0.541878 2.39385e-19 6 63.546 0.0872282 -3.53671 63.546000 Cu 0.949104 0.522887 0.5 7 63.546 0.0517167 -3.52574 63.546000 Cu 0.80955 0.525899 0.5 8 63.546 0.314845 -3.53013 63.546000 Cu 0.75264 0.547661 1 21 63.546 0.0904815 -3.5278 63.546000 Cu 0.869307 0.505519 2.39385e-19 361 63.546 0.341083 -3.50697 63.546000 Cu 0.0521568 0.574089 1 10 63.546 0.0132419 -3.53484 63.546000 Cu 0.133476 0.58934 0.5 13 63.546 0.0362013 -3.53123 63.546000 Cu 0.0737943 0.608794 1 29 63.546 0.00519156 -3.53686 63.546000 Cu 0.193494 0.56939 3.32746e-17 58 63.546 0.0768425 -3.52293 63.546000 Cu 0.214331 0.603851 4.78771e-19 59 63.546 0.0143399 -3.53449 63.546000 Cu 0.331472 0.56218 0 36 63.546 0.0708734 -3.54445 63.546000 Cu 0.470767 0.558176 6.70279e-18 39 63.546 0.0141728 -3.53701 63.546000 Cu 0.411761 0.577603 0.5 42 63.546 0.0294434 -3.54216 63.546000 Cu 0.273331 0.583108 0.5 60 63.546 0.0141155 -3.53939 63.546000 Cu 0.353206 0.597767 1.02218e-16 61 63.546 0.0187867 -3.54324 63.546000 Cu 0.49267 0.593303 2.27416e-17 40 63.546 0.00483636 -3.53941 63.546000 Cu 0.693494 0.56939 0.5 24 63.546 0.0768425 -3.52293 63.546000 Cu 0.552157 0.574089 0.5 41 63.546 0.0132419 -3.53484 63.546000 Cu 0.633476 0.58934 1 43 63.546 0.0362013 -3.53123 63.546000 Cu 0.714331 0.603851 0.5 45 63.546 0.0143399 -3.53449 63.546000 Cu 0.573794 0.608794 0.5 46 63.546 0.00519156 -3.53686 63.546000 Cu 0.99267 0.593303 0.5 27 63.546 0.00483636 -3.53941 63.546000 Cu 0.970767 0.558176 0.5 12 63.546 0.0141728 -3.53701 63.546000 Cu 0.773331 0.583108 1 22 63.546 0.0141155 -3.53939 63.546000 Cu 0.831472 0.56218 0.5 23 63.546 0.0708734 -3.54445 63.546000 Cu 0.911761 0.577603 1 25 63.546 0.0294434 -3.54216 63.546000 Cu 0.853206 0.597767 0.5 28 63.546 0.0187867 -3.54324 63.546000 Cu 0.0950782 0.6436 1.97253e-16 30 63.546 0.00158033 -3.53846 63.546000 Cu 0.0143406 0.628356 0.5 31 63.546 0.00145862 -3.54012 63.546000 Cu 0.0355427 0.663373 0.5 53 63.546 0.000506483 -3.54016 63.546000 Cu 0.154751 0.623861 0.5 82 63.546 0.00904962 -3.53604 63.546000 Cu 0.175689 0.65862 0.5 86 63.546 0.00239877 -3.53798 63.546000 Cu 0.235334 0.638598 2.27416e-17 83 63.546 0.0032128 -3.53808 63.546000 Cu 0.374739 0.63306 0 62 63.546 0.00514828 -3.54191 63.546000 Cu 0.433668 0.612981 0.5 63 63.546 0.00861035 -3.54195 63.546000 Cu 0.294583 0.618243 0.5 64 63.546 0.00319833 -3.54038 63.546000 Cu 0.455066 0.648183 0.5 68 63.546 0.00218891 -3.54139 63.546000 Cu 0.315552 0.653297 0.5 85 63.546 0.00089576 -3.54035 63.546000 Cu 0.654751 0.623861 0 44 63.546 0.00904962 -3.53604 63.546000 Cu 0.514341 0.628356 1.89114e-17 65 63.546 0.00145862 -3.54012 63.546000 Cu 0.535543 0.663373 2.39385e-19 66 63.546 0.000506483 -3.54016 63.546000 Cu 0.595078 0.6436 0.5 67 63.546 0.00158033 -3.53846 63.546000 Cu 0.675689 0.65862 1 69 63.546 0.00239877 -3.53798 63.546000 Cu 0.735334 0.638598 0.5 50 63.546 0.0032128 -3.53808 63.546000 Cu 0.933668 0.612981 1 26 63.546 0.00861035 -3.54195 63.546000 Cu 0.794583 0.618243 6.84642e-17 47 63.546 0.00319833 -3.54038 63.546000 Cu 0.815552 0.653297 1.2448e-17 48 63.546 0.00089576 -3.54035 63.546000 Cu 0.874739 0.63306 0.5 49 63.546 0.00514828 -3.54191 63.546000 Cu 0.955066 0.648183 2.27416e-17 51 63.546 0.00218891 -3.54139 63.546000 Cu 0.115973 0.678477 0 55 63.546 0.000398761 -3.53917 63.546000 Cu 0.136403 0.713406 1 56 63.546 7.71421e-05 -3.53945 63.546000 Cu 0.0562104 0.698386 0.5 57 63.546 0.000178693 -3.54016 63.546000 Cu 0.196335 0.693477 0.5 108 63.546 0.000543106 -3.53887 63.546000 Cu 0.256074 0.673473 1 84 63.546 0.000827397 -3.53892 63.546000 Cu 0.395757 0.668216 0 87 63.546 0.00135371 -3.54127 63.546000 Cu 0.416346 0.703321 2.39385e-19 88 63.546 0.000182532 -3.54098 63.546000 Cu 0.475942 0.6833 0.5 89 63.546 0.00039416 -3.54108 63.546000 Cu 0.336226 0.688327 0.5 90 63.546 0.000344486 -3.54024 63.546000 Cu 0.276516 0.708407 9.57541e-19 109 63.546 0.000204209 -3.53941 63.546000 Cu 0.49648 0.71837 0.5 94 63.546 9.94756e-05 -3.54051 63.546000 Cu 0.696335 0.693477 1 70 63.546 0.000543106 -3.53887 63.546000 Cu 0.615973 0.678477 0.5 72 63.546 0.000398761 -3.53917 63.546000 Cu 0.55621 0.698386 4.9074e-17 91 63.546 0.000178693 -3.54016 63.546000 Cu 0.636403 0.713406 0.5 93 63.546 7.71421e-05 -3.53945 63.546000 Cu 0.99648 0.71837 3.08807e-17 77 63.546 9.94756e-05 -3.54051 63.546000 Cu 0.975942 0.6833 7.18156e-19 52 63.546 0.00039416 -3.54108 63.546000 Cu 0.895757 0.668216 0.5 54 63.546 0.00135371 -3.54127 63.546000 Cu 0.756074 0.673473 0.5 71 63.546 0.000827397 -3.53892 63.546000 Cu 0.836226 0.688327 2.39385e-19 73 63.546 0.000344486 -3.54024 63.546000 Cu 0.916346 0.703321 0.5 75 63.546 0.000182532 -3.54098 63.546000 Cu 0.776516 0.708407 0.5 76 63.546 0.000204209 -3.53941 63.546000 Cu 0.0166786 0.753447 1 78 63.546 0.000149871 -3.54085 63.546000 Cu 0.0765097 0.733384 0.5 79 63.546 0.000152347 -3.5401 63.546000 Cu 0.0966165 0.768419 0.5 81 63.546 0.000182827 -3.54041 63.546000 Cu 0.216614 0.728394 0.5 112 63.546 6.00285e-05 -3.53906 63.546000 Cu 0.156593 0.748357 1 132 63.546 0.000200423 -3.53944 63.546000 Cu 0.236639 0.763287 0.5 134 63.546 0.000470971 -3.53879 63.546000 Cu 0.296748 0.743352 1 110 63.546 0.000196964 -3.53938 63.546000 Cu 0.356663 0.723366 0.5 111 63.546 0.000198916 -3.54044 63.546000 Cu 0.436707 0.73841 1.22326e-16 113 63.546 9.75724e-05 -3.54079 63.546000 Cu 0.456802 0.773507 1 114 63.546 0.000668878 -3.54108 63.546000 Cu 0.376838 0.758405 0.5 116 63.546 0.000251043 -3.54041 63.546000 Cu 0.57651 0.733384 7.39701e-17 92 63.546 0.000152347 -3.5401 63.546000 Cu 0.716614 0.728394 1 95 63.546 6.00285e-05 -3.53906 63.546000 Cu 0.656593 0.748357 0.5 98 63.546 0.000200423 -3.53944 63.546000 Cu 0.516679 0.753447 0.5 115 63.546 0.000149871 -3.54085 63.546000 Cu 0.596617 0.768419 1.0533e-16 117 63.546 0.000182827 -3.54041 63.546000 Cu 0.736639 0.763287 2.68112e-17 96 63.546 0.000470971 -3.53879 63.546000 Cu 0.856663 0.723366 1.29268e-17 74 63.546 0.000198916 -3.54044 63.546000 Cu 0.936707 0.73841 0.5 80 63.546 9.75724e-05 -3.54079 63.546000 Cu 0.796748 0.743352 0.5 97 63.546 0.000196964 -3.53938 63.546000 Cu 0.876838 0.758405 1.05569e-16 99 63.546 0.000251043 -3.54041 63.546000 Cu 0.956802 0.773507 0.5 101 63.546 0.000668878 -3.54108 63.546000 Cu 0.0367732 0.788559 4.78771e-19 103 63.546 0.00102532 -3.54123 63.546000 Cu 0.0572636 0.823724 7.85184e-17 104 63.546 0.00413862 -3.54196 63.546000 Cu 0.116721 0.803472 0.5 105 63.546 0.000702523 -3.5403 63.546000 Cu 0.176532 0.783302 2.39385e-19 133 63.546 0.000773861 -3.53905 63.546000 Cu 0.19675 0.818201 1.22086e-16 158 63.546 0.00313444 -3.53792 63.546000 Cu 0.316756 0.778297 7.15762e-17 135 63.546 0.000513032 -3.5395 63.546000 Cu 0.33704 0.813219 1 136 63.546 0.00147302 -3.53846 63.546000 Cu 0.396947 0.793453 0.5 137 63.546 0.00064869 -3.54037 63.546000 Cu 0.256665 0.798172 0.5 138 63.546 0.00253718 -3.53815 63.546000 Cu 0.477139 0.808636 2.27416e-17 139 63.546 0.00264128 -3.54133 63.546000 Cu 0.417532 0.828484 0.5 142 63.546 0.00166992 -3.54001 63.546000 Cu 0.277073 0.83295 0.5 160 63.546 0.00957324 -3.536 63.546000 Cu 0.616721 0.803472 1 118 63.546 0.000702523 -3.5403 63.546000 Cu 0.676532 0.783302 0.5 119 63.546 0.000773861 -3.53905 63.546000 Cu 0.536773 0.788559 0.5 120 63.546 0.00102532 -3.54123 63.546000 Cu 0.69675 0.818201 0.5 124 63.546 0.00313444 -3.53792 63.546000 Cu 0.557264 0.823724 0.5 141 63.546 0.00413862 -3.54196 63.546000 Cu 0.896947 0.793453 1 100 63.546 0.00064869 -3.54037 63.546000 Cu 0.816756 0.778297 0.5 102 63.546 0.000513032 -3.5395 63.546000 Cu 0.977139 0.808636 0.5 106 63.546 0.00264128 -3.54133 63.546000 Cu 0.756665 0.798172 1 121 63.546 0.00253718 -3.53815 63.546000 Cu 0.83704 0.813219 0.5 123 63.546 0.00147302 -3.53846 63.546000 Cu 0.917532 0.828484 5.79312e-17 125 63.546 0.00166992 -3.54001 63.546000 Cu 0.777073 0.83295 2.27416e-17 122 63.546 0.00957324 -3.536 63.546000 Cu 0.137193 0.838565 0.5 107 63.546 0.00295202 -3.54041 63.546000 Cu 0.0781667 0.859061 1.19693e-18 129 63.546 0.0173667 -3.54313 63.546000 Cu 0.019245 0.879262 0.5 131 63.546 0.0284948 -3.54215 63.546000 Cu 0.217156 0.852996 1.22565e-16 159 63.546 0.013947 -3.53464 63.546000 Cu 0.157767 0.873778 0.5 180 63.546 0.014796 -3.53901 63.546000 Cu 0.237326 0.887529 1.22565e-16 181 63.546 0.076593 -3.52253 63.546000 Cu 0.357755 0.848047 0 161 63.546 0.0048463 -3.53724 63.546000 Cu 0.378715 0.88281 4.78771e-19 162 63.546 0.0128301 -3.5356 63.546000 Cu 0.438601 0.863549 0.5 163 63.546 0.00463332 -3.53974 63.546000 Cu 0.297676 0.867543 0.5 164 63.546 0.0353098 -3.53182 63.546000 Cu 0.498021 0.843847 2.39385e-19 140 63.546 0.00893365 -3.54195 63.546000 Cu 0.637193 0.838565 1 143 63.546 0.00295202 -3.54041 63.546000 Cu 0.657767 0.873778 2.39385e-19 144 63.546 0.014796 -3.53901 63.546000 Cu 0.717156 0.852996 0.5 145 63.546 0.013947 -3.53464 63.546000 Cu 0.578167 0.859061 0.5 146 63.546 0.0173667 -3.54313 63.546000 Cu 0.519245 0.879262 7.18156e-19 165 63.546 0.0284948 -3.54215 63.546000 Cu 0.737326 0.887529 0.5 150 63.546 0.076593 -3.52253 63.546000 Cu 0.998021 0.843847 0.5 127 63.546 0.00893365 -3.54195 63.546000 Cu 0.938601 0.863549 1.19693e-18 126 63.546 0.00463332 -3.53974 63.546000 Cu 0.857755 0.848047 0.5 128 63.546 0.0048463 -3.53724 63.546000 Cu 0.797676 0.867543 2.39385e-19 147 63.546 0.0353098 -3.53182 63.546000 Cu 0.878715 0.88281 0.5 149 63.546 0.0128301 -3.5356 63.546000 Cu 0.0992026 0.894731 1 130 63.546 0.0704136 -3.54389 63.546000 Cu 0.0404586 0.915074 0.5 153 63.546 0.0869242 -3.53647 63.546000 Cu 0.120304 0.931118 7.18156e-19 155 63.546 0.321143 -3.52879 63.546000 Cu 0.177688 0.909315 0.5 184 63.546 0.0962436 -3.52629 63.546000 Cu 0.459827 0.898727 0.5 168 63.546 0.0139784 -3.53762 63.546000 Cu 0.256803 0.921386 1.23044e-16 182 63.546 0.5188 -3.47239 63.546000 Cu 0.318147 0.901822 0.5 183 63.546 0.125997 -3.52297 63.546000 Cu 0.399677 0.917477 4.78771e-19 185 63.546 0.0285415 -3.53257 63.546000 Cu 0.480683 0.934086 0.5 187 63.546 0.0544209 -3.52649 63.546000 Cu 0.338635 0.935647 0.5 188 63.546 0.490309 -3.50098 63.546000 Cu 0.540459 0.915074 1.22805e-16 166 63.546 0.0869242 -3.53647 63.546000 Cu 0.599203 0.894731 0.5 167 63.546 0.0704136 -3.54389 63.546000 Cu 0.677688 0.909315 1 169 63.546 0.0962436 -3.52629 63.546000 Cu 0.620304 0.931118 0.5 172 63.546 0.321143 -3.52879 63.546000 Cu 0.818147 0.901822 4.78771e-19 148 63.546 0.125997 -3.52297 63.546000 Cu 0.959827 0.898727 1 151 63.546 0.0139784 -3.53762 63.546000 Cu 0.980683 0.934086 1 152 63.546 0.0544209 -3.52649 63.546000 Cu 0.899677 0.917477 0.5 154 63.546 0.0285415 -3.53257 63.546000 Cu 0.756803 0.921386 0.5 171 63.546 0.5188 -3.47239 63.546000 Cu 0.838635 0.935647 1 173 63.546 0.490309 -3.50098 63.546000 Cu 0.141395 0.969712 0 156 63.546 4.39776 -3.54456 63.546000 Cu 0.0599697 0.951554 0.5 157 63.546 0.353078 -3.50643 63.546000 Cu 0.0596039 0.98782 0.5 178 63.546 0.350906 -3.50631 63.546000 Cu 0.19571 0.945955 0.5 196 63.546 5.32323 -3.43392 63.546000 Cu 0.195249 0.993525 0.5 200 63.546 5.3465 -3.43374 63.546000 Cu 0.418533 0.952258 1.19693e-16 186 63.546 0.182171 -3.53469 63.546000 Cu 0.27747 0.953798 1 197 63.546 7.37035 -3.26244 63.546000 Cu 0.27696 0.985636 2.04196e-16 198 63.546 7.31352 -3.26351 63.546000 Cu 0.34959 0.969723 0.5 199 63.546 3.22754 -3.47767 63.546000 Cu 0.418145 0.987115 2.27416e-17 201 63.546 0.171355 -3.5339 63.546000 Cu 0.493456 0.969677 0.5 192 63.546 0.337974 -3.53139 63.546000 Cu 0.69571 0.945955 1 170 63.546 5.32323 -3.43392 63.546000 Cu 0.55997 0.951554 0 189 63.546 0.353078 -3.50643 63.546000 Cu 0.559604 0.98782 2.27416e-17 190 63.546 0.350906 -3.50631 63.546000 Cu 0.641395 0.969712 0.5 191 63.546 4.39776 -3.54456 63.546000 Cu 0.695249 0.993525 1 193 63.546 5.3465 -3.43374 63.546000 Cu 0.993456 0.969677 9.8148e-18 177 63.546 0.337974 -3.53139 63.546000 Cu 0.84959 0.969723 1 174 63.546 3.22754 -3.47767 63.546000 Cu 0.918533 0.952258 0.5 175 63.546 0.182171 -3.53469 63.546000 Cu 0.77747 0.953798 0.5 176 63.546 7.37035 -3.26244 63.546000 Cu 0.918145 0.987115 0.5 179 63.546 0.171355 -3.5339 63.546000 Cu 0.77696 0.985636 0.5 194 63.546 7.31352 -3.26351