Number of particles = 398 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.0221 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.3072 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62338 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 0.0990695 0.0446588 3.63856e-17 210 63.546 0.0698381 -3.54371 63.546000 Cu 0.0399887 0.024277 0.5 211 63.546 0.0897957 -3.53701 63.546000 Cu 0.119773 0.00827977 1 213 63.546 0.317086 -3.52847 63.546000 Cu 0.177224 0.0301134 0.5 215 63.546 0.0929089 -3.52536 63.546000 Cu 0.256207 0.0180373 1 214 63.546 0.522915 -3.47303 63.546000 Cu 0.338074 0.00376412 0.5 216 63.546 0.488246 -3.50031 63.546000 Cu 0.317822 0.037583 0.5 229 63.546 0.128626 -3.52292 63.546000 Cu 0.39919 0.0218925 7.18138e-19 231 63.546 0.027038 -3.5325 63.546000 Cu 0.539989 0.024277 1.22802e-16 232 63.546 0.0897957 -3.53701 63.546000 Cu 0.480168 0.00524681 0.5 233 63.546 0.0512399 -3.52636 63.546000 Cu 0.459652 0.0406153 0.5 234 63.546 0.015235 -3.53828 63.546000 Cu 0.599069 0.0446588 0.5 255 63.546 0.0698381 -3.54371 63.546000 Cu 0.619773 0.00827977 0.5 235 63.546 0.317086 -3.52847 63.546000 Cu 0.677224 0.0301134 1 257 63.546 0.0929089 -3.52536 63.546000 Cu 0.756207 0.0180373 0.5 259 63.546 0.522915 -3.47303 63.546000 Cu 0.838074 0.00376412 1 203 63.546 0.488246 -3.50031 63.546000 Cu 0.980168 0.00524681 0 204 63.546 0.0512399 -3.52636 63.546000 Cu 0.89919 0.0218925 0.5 205 63.546 0.027038 -3.5325 63.546000 Cu 0.959652 0.0406153 1 209 63.546 0.015235 -3.53828 63.546000 Cu 0.817822 0.037583 1 258 63.546 0.128626 -3.52292 63.546000 Cu 0.0195545 0.0600955 0.5 212 63.546 0.0302478 -3.54272 63.546000 Cu 0.0792353 0.0803239 8.0192e-17 223 63.546 0.0182929 -3.54294 63.546000 Cu 0.158248 0.0656374 0.5 225 63.546 0.014127 -3.53817 63.546000 Cu 0.218502 0.086437 1 224 63.546 0.0153489 -3.53394 63.546000 Cu 0.237379 0.0518949 1.22323e-16 227 63.546 0.0795204 -3.52159 63.546000 Cu 0.378959 0.0565718 0 228 63.546 0.0129814 -3.53606 63.546000 Cu 0.298449 0.0718655 0.5 230 63.546 0.0359679 -3.53177 63.546000 Cu 0.359363 0.0913563 4.78758e-19 249 63.546 0.00489265 -3.53789 63.546000 Cu 0.49978 0.0955443 4.90727e-17 250 63.546 0.00930249 -3.54242 63.546000 Cu 0.439541 0.0758207 0.5 251 63.546 0.0051826 -3.5405 63.546000 Cu 0.519555 0.0600955 4.64396e-17 253 63.546 0.0302478 -3.54272 63.546000 Cu 0.579235 0.0803239 0.5 256 63.546 0.0182929 -3.54294 63.546000 Cu 0.658248 0.0656374 1 254 63.546 0.014127 -3.53817 63.546000 Cu 0.737379 0.0518949 0.5 260 63.546 0.0795204 -3.52159 63.546000 Cu 0.718502 0.086437 0.5 283 63.546 0.0153489 -3.53394 63.546000 Cu 0.798449 0.0718655 0 285 63.546 0.0359679 -3.53177 63.546000 Cu 0.939541 0.0758207 0 206 63.546 0.0051826 -3.5405 63.546000 Cu 0.878959 0.0565718 0.5 207 63.546 0.0129814 -3.53606 63.546000 Cu 0.859363 0.0913563 0.5 208 63.546 0.00489265 -3.53789 63.546000 Cu 0.99978 0.0955443 0.5 221 63.546 0.00930249 -3.54242 63.546000 Cu 0.0599565 0.115679 1 220 63.546 0.0050353 -3.54191 63.546000 Cu 0.139199 0.100849 0.5 226 63.546 0.00302329 -3.53973 63.546000 Cu 0.120356 0.135965 0.5 243 63.546 0.00080423 -3.54003 63.546000 Cu 0.199727 0.121245 1 245 63.546 0.00341487 -3.53747 63.546000 Cu 0.340266 0.126236 4.78758e-19 246 63.546 0.0015981 -3.53882 63.546000 Cu 0.279369 0.106484 0.5 247 63.546 0.00985066 -3.53598 63.546000 Cu 0.260566 0.141288 0.5 248 63.546 0.00240305 -3.53803 63.546000 Cu 0.401048 0.146035 0.5 275 63.546 0.000428945 -3.54064 63.546000 Cu 0.420038 0.110948 0.5 252 63.546 0.00156117 -3.5407 63.546000 Cu 0.48055 0.130809 1 277 63.546 0.00255921 -3.54162 63.546000 Cu 0.559957 0.115679 0.5 279 63.546 0.0050353 -3.54191 63.546000 Cu 0.620356 0.135965 0 278 63.546 0.00080423 -3.54003 63.546000 Cu 0.639199 0.100849 1.21126e-16 281 63.546 0.00302329 -3.53973 63.546000 Cu 0.779369 0.106484 1 282 63.546 0.00985066 -3.53598 63.546000 Cu 0.699727 0.121245 0.5 284 63.546 0.00341487 -3.53747 63.546000 Cu 0.760566 0.141288 0 309 63.546 0.00240305 -3.53803 63.546000 Cu 0.901048 0.146035 0 217 63.546 0.000428945 -3.54064 63.546000 Cu 0.840266 0.126236 0.5 218 63.546 0.0015981 -3.53882 63.546000 Cu 0.920038 0.110948 0 219 63.546 0.00156117 -3.5407 63.546000 Cu 0.98055 0.130809 0.5 222 63.546 0.00255921 -3.54162 63.546000 Cu 0.0220489 0.186011 0 238 63.546 0.000333979 -3.54056 63.546000 Cu 0.0410891 0.150891 2.39379e-19 241 63.546 0.00126796 -3.54106 63.546000 Cu 0.18104 0.15616 4.06945e-17 242 63.546 0.000717335 -3.53877 63.546000 Cu 0.101601 0.171034 0.5 244 63.546 0.000285812 -3.53998 63.546000 Cu 0.162048 0.191127 7.18138e-19 269 63.546 0.000200038 -3.5393 63.546000 Cu 0.302303 0.196145 1 270 63.546 0.000132358 -3.53927 63.546000 Cu 0.241747 0.176191 0.5 271 63.546 0.000523374 -3.5388 63.546000 Cu 0.321433 0.161182 2.39379e-19 273 63.546 0.000562012 -3.53946 63.546000 Cu 0.382034 0.181096 0.5 276 63.546 0.000190528 -3.54018 63.546000 Cu 0.461662 0.165975 0 274 63.546 0.000637699 -3.54098 63.546000 Cu 0.541089 0.150891 0.5 280 63.546 0.00126796 -3.54106 63.546000 Cu 0.522049 0.186011 0.5 303 63.546 0.000333979 -3.54056 63.546000 Cu 0.601601 0.171034 0 305 63.546 0.000285812 -3.53998 63.546000 Cu 0.741747 0.176191 1 306 63.546 0.000523374 -3.5388 63.546000 Cu 0.68104 0.15616 0.5 307 63.546 0.000717335 -3.53877 63.546000 Cu 0.662048 0.191127 0.5 308 63.546 0.000200038 -3.5393 63.546000 Cu 0.802303 0.196145 0.5 334 63.546 0.000132358 -3.53927 63.546000 Cu 0.882034 0.181096 1 237 63.546 0.000190528 -3.54018 63.546000 Cu 0.961662 0.165975 0.5 239 63.546 0.000637699 -3.54098 63.546000 Cu 0.821433 0.161182 0.5 310 63.546 0.000562012 -3.53946 63.546000 Cu 0.142795 0.226106 4.78758e-19 266 63.546 8.08415e-05 -3.53952 63.546000 Cu 0.0823765 0.206079 0.5 267 63.546 9.1219e-05 -3.54012 63.546000 Cu 0.0631129 0.241129 0.5 268 63.546 0.000141387 -3.54013 63.546000 Cu 0.00273268 0.2211 0 265 63.546 2.4108e-05 -3.54055 63.546000 Cu 0.203348 0.246076 0.5 295 63.546 0.000184011 -3.53919 63.546000 Cu 0.222535 0.211121 0.5 272 63.546 1.29012e-05 -3.53906 63.546000 Cu 0.283021 0.231106 1.22083e-16 297 63.546 9.75264e-05 -3.53954 63.546000 Cu 0.362736 0.216127 0.5 299 63.546 0.000108935 -3.54001 63.546000 Cu 0.423097 0.236156 2.99224e-17 298 63.546 6.94463e-05 -3.54053 63.546000 Cu 0.442406 0.201071 3.68644e-17 301 63.546 7.43842e-05 -3.54049 63.546000 Cu 0.582376 0.206079 4.78758e-19 302 63.546 9.1219e-05 -3.54012 63.546000 Cu 0.502733 0.2211 0.5 304 63.546 2.4108e-05 -3.54055 63.546000 Cu 0.563113 0.241129 1 329 63.546 0.000141387 -3.54013 63.546000 Cu 0.703348 0.246076 7.18138e-19 330 63.546 0.000184011 -3.53919 63.546000 Cu 0.642795 0.226106 0.5 331 63.546 8.08415e-05 -3.53952 63.546000 Cu 0.722535 0.211121 1 333 63.546 1.29012e-05 -3.53906 63.546000 Cu 0.783021 0.231106 0.5 335 63.546 9.75264e-05 -3.53954 63.546000 Cu 0.862736 0.216127 0 236 63.546 0.000108935 -3.54001 63.546000 Cu 0.942406 0.201071 0.5 240 63.546 7.43842e-05 -3.54049 63.546000 Cu 0.923097 0.236156 0.5 263 63.546 6.94463e-05 -3.54053 63.546000 Cu 0.104817 0.296028 1.22083e-16 290 63.546 0.000784054 -3.53931 63.546000 Cu 0.0440666 0.276164 0.5 291 63.546 0.000240078 -3.54022 63.546000 Cu 0.123709 0.261084 5.09878e-17 293 63.546 0.000168122 -3.53929 63.546000 Cu 0.18444 0.281016 0.5 296 63.546 0.000930127 -3.53869 63.546000 Cu 0.263953 0.266103 1 294 63.546 0.000223234 -3.53928 63.546000 Cu 0.343501 0.251164 0.5 300 63.546 0.000108413 -3.54018 63.546000 Cu 0.324514 0.286215 0.5 323 63.546 0.000264289 -3.53993 63.546000 Cu 0.403967 0.27125 1 325 63.546 0.000435482 -3.54082 63.546000 Cu 0.544067 0.276164 4.47639e-17 326 63.546 0.000240078 -3.54022 63.546000 Cu 0.483509 0.256188 0.5 327 63.546 0.00016413 -3.54073 63.546000 Cu 0.464497 0.291297 0.5 328 63.546 0.000990382 -3.54109 63.546000 Cu 0.604817 0.296028 0.5 355 63.546 0.000784054 -3.53931 63.546000 Cu 0.623709 0.261084 0.5 332 63.546 0.000168122 -3.53929 63.546000 Cu 0.68444 0.281016 1 357 63.546 0.000930127 -3.53869 63.546000 Cu 0.763953 0.266103 0.5 359 63.546 0.000223234 -3.53928 63.546000 Cu 0.843501 0.251164 1 261 63.546 0.000108413 -3.54018 63.546000 Cu 0.983509 0.256188 2.39379e-19 262 63.546 0.00016413 -3.54073 63.546000 Cu 0.903967 0.27125 0.5 264 63.546 0.000435482 -3.54082 63.546000 Cu 0.964497 0.291297 2.72892e-17 289 63.546 0.000990382 -3.54109 63.546000 Cu 0.824514 0.286215 1 358 63.546 0.000264289 -3.53993 63.546000 Cu 0.0251734 0.311197 0.5 292 63.546 0.000428808 -3.54042 63.546000 Cu 0.0859474 0.330948 5.69723e-17 317 63.546 0.00229862 -3.53876 63.546000 Cu 0.165701 0.315919 0.5 319 63.546 0.00298087 -3.53806 63.546000 Cu 0.00608621 0.346254 0.5 315 63.546 0.00144459 -3.54066 63.546000 Cu 0.226454 0.335982 5.26634e-18 318 63.546 0.0032468 -3.53735 63.546000 Cu 0.245186 0.301069 1 321 63.546 0.000739536 -3.53871 63.546000 Cu 0.385091 0.306372 1 322 63.546 0.00162233 -3.54111 63.546000 Cu 0.305833 0.321283 0.5 324 63.546 0.000893575 -3.53999 63.546000 Cu 0.366151 0.341573 4.78758e-19 349 63.546 0.00594623 -3.54191 63.546000 Cu 0.506086 0.346254 1 350 63.546 0.00144459 -3.54066 63.546000 Cu 0.445601 0.326439 0.5 351 63.546 0.00319832 -3.54156 63.546000 Cu 0.525173 0.311197 1.43628e-17 353 63.546 0.000428808 -3.54042 63.546000 Cu 0.585947 0.330948 0.5 356 63.546 0.00229862 -3.53876 63.546000 Cu 0.665701 0.315919 7.1335e-17 354 63.546 0.00298087 -3.53806 63.546000 Cu 0.745186 0.301069 0.5 360 63.546 0.000739536 -3.53871 63.546000 Cu 0.726454 0.335982 0.5 381 63.546 0.0032468 -3.53735 63.546000 Cu 0.805833 0.321283 0 383 63.546 0.000893575 -3.53999 63.546000 Cu 0.945601 0.326439 3.61463e-17 286 63.546 0.00319832 -3.54156 63.546000 Cu 0.885091 0.306372 0.5 287 63.546 0.00162233 -3.54111 63.546000 Cu 0.866151 0.341573 0.5 288 63.546 0.00594623 -3.54191 63.546000 Cu 0.0668263 0.365806 8.97672e-17 314 63.546 0.00600566 -3.53782 63.546000 Cu 0.146784 0.350704 0.5 320 63.546 0.0107949 -3.53574 63.546000 Cu 0.127844 0.385271 0.5 343 63.546 0.0405515 -3.53118 63.546000 Cu 0.207737 0.370759 1.32616e-16 345 63.546 0.0160281 -3.53333 63.546000 Cu 0.34697 0.376921 0 346 63.546 0.0208857 -3.54322 63.546000 Cu 0.286961 0.356385 0.5 347 63.546 0.00338236 -3.53969 63.546000 Cu 0.268073 0.391592 0.5 348 63.546 0.0162323 -3.53807 63.546000 Cu 0.406792 0.397122 0.5 373 63.546 0.0321829 -3.54287 63.546000 Cu 0.426342 0.361684 0.5 352 63.546 0.0103928 -3.54251 63.546000 Cu 0.486724 0.381357 1 375 63.546 0.00492475 -3.54054 63.546000 Cu 0.566826 0.365806 0.5 377 63.546 0.00600566 -3.53782 63.546000 Cu 0.627844 0.385271 7.18138e-19 376 63.546 0.0405515 -3.53118 63.546000 Cu 0.646784 0.350704 1 379 63.546 0.0107949 -3.53574 63.546000 Cu 0.786961 0.356385 9.62304e-17 380 63.546 0.00338236 -3.53969 63.546000 Cu 0.707737 0.370759 0.5 382 63.546 0.0160281 -3.53333 63.546000 Cu 0.768073 0.391592 1 397 63.546 0.0162323 -3.53807 63.546000 Cu 0.906792 0.397122 0 311 63.546 0.0321829 -3.54287 63.546000 Cu 0.84697 0.376921 0.5 312 63.546 0.0208857 -3.54322 63.546000 Cu 0.926342 0.361684 1 313 63.546 0.0103928 -3.54251 63.546000 Cu 0.986724 0.381357 0.5 316 63.546 0.00492475 -3.54054 63.546000 Cu 0.0276309 0.435229 0 338 63.546 0.0273432 -3.53301 63.546000 Cu 0.0474069 0.400568 1 341 63.546 0.0142765 -3.5361 63.546000 Cu 0.189059 0.40525 1.40994e-16 342 63.546 0.085329 -3.51987 63.546000 Cu 0.108761 0.419517 0.5 344 63.546 0.139575 -3.52238 63.546000 Cu 0.170666 0.439038 0 367 63.546 0.566725 -3.46749 63.546000 Cu 0.307195 0.448912 7.42076e-18 368 63.546 0.330903 -3.53025 63.546000 Cu 0.249508 0.427121 0.5 369 63.546 0.10659 -3.52397 63.546000 Cu 0.327393 0.412573 1.18253e-16 371 63.546 0.0762124 -3.5441 63.546000 Cu 0.386759 0.432904 0.5 374 63.546 0.0908309 -3.53729 63.546000 Cu 0.466882 0.416543 6.96594e-17 372 63.546 0.0147499 -3.53854 63.546000 Cu 0.547407 0.400568 0.5 378 63.546 0.0142765 -3.5361 63.546000 Cu 0.527631 0.435229 0.5 391 63.546 0.0273432 -3.53301 63.546000 Cu 0.608761 0.419517 1 393 63.546 0.139575 -3.52238 63.546000 Cu 0.749508 0.427121 2.02515e-16 394 63.546 0.10659 -3.52397 63.546000 Cu 0.689059 0.40525 0.5 395 63.546 0.085329 -3.51987 63.546000 Cu 0.670666 0.439038 0.5 396 63.546 0.566725 -3.46749 63.546000 Cu 0.807195 0.448912 0.5 5 63.546 0.330903 -3.53025 63.546000 Cu 0.886759 0.432904 1.21365e-16 337 63.546 0.0908309 -3.53729 63.546000 Cu 0.966882 0.416543 0.5 339 63.546 0.0147499 -3.53854 63.546000 Cu 0.827393 0.412573 0.5 398 63.546 0.0762124 -3.5441 63.546000 Cu 0.15037 0.471402 4.4333e-16 364 63.546 7.33854 -3.25578 63.546000 Cu 0.0890673 0.453307 0.5 365 63.546 0.521645 -3.50035 63.546000 Cu 0.0789579 0.487369 0.5 366 63.546 3.15449 -3.47675 63.546000 Cu 0.00950807 0.469979 2.42252e-16 363 63.546 0.184892 -3.53465 63.546000 Cu 0.232201 0.463789 0.5 370 63.546 5.29703 -3.43468 63.546000 Cu 0.287079 0.487388 0 385 63.546 4.37199 -3.5477 63.546000 Cu 0.368132 0.469316 0.5 387 63.546 0.348437 -3.50832 63.546000 Cu 0.578958 0.487369 0 202 63.546 3.15449 -3.47675 63.546000 Cu 0.435093 0.487397 0 386 63.546 0.331095 -3.53172 63.546000 Cu 0.446944 0.451873 0 389 63.546 0.0558983 -3.52724 63.546000 Cu 0.589067 0.453307 2.63317e-17 390 63.546 0.521645 -3.50035 63.546000 Cu 0.509508 0.469979 0.5 392 63.546 0.184892 -3.53465 63.546000 Cu 0.787079 0.487388 0.5 3 63.546 4.37199 -3.5477 63.546000 Cu 0.732201 0.463789 2.51348e-17 16 63.546 5.29703 -3.43468 63.546000 Cu 0.65037 0.471402 0.5 34 63.546 7.33854 -3.25578 63.546000 Cu 0.868132 0.469316 3.01618e-17 336 63.546 0.348437 -3.50832 63.546000 Cu 0.946944 0.451873 0.5 340 63.546 0.0558983 -3.52724 63.546000 Cu 0.935093 0.487397 0.5 362 63.546 0.331095 -3.53172 63.546000 Cu 0.0108145 0.504789 1.77141e-16 1 63.546 0.167379 -3.5335 63.546000 Cu 0.0911738 0.52136 0.5 2 63.546 0.477042 -3.49986 63.546000 Cu 0.030528 0.5395 1.44585e-16 9 63.546 0.028199 -3.53135 63.546000 Cu 0.151955 0.503165 4.95994e-16 32 63.546 7.33369 -3.26517 63.546000 Cu 0.173364 0.535585 1.34531e-16 33 63.546 0.500479 -3.47515 63.546000 Cu 0.233725 0.51117 0.5 384 63.546 5.31118 -3.43765 63.546000 Cu 0.309601 0.525895 1.08678e-16 35 63.546 0.318162 -3.52952 63.546000 Cu 0.252649 0.54767 0.5 38 63.546 0.0897388 -3.52766 63.546000 Cu 0.369309 0.505511 0.5 388 63.546 0.347493 -3.50656 63.546000 Cu 0.389798 0.541889 0.5 37 63.546 0.0869694 -3.53656 63.546000 Cu 0.449104 0.522904 1 14 63.546 0.0522249 -3.52554 63.546000 Cu 0.510815 0.504789 0.5 15 63.546 0.167379 -3.5335 63.546000 Cu 0.530528 0.5395 0.5 20 63.546 0.028199 -3.53135 63.546000 Cu 0.591174 0.52136 1 17 63.546 0.477042 -3.49986 63.546000 Cu 0.733725 0.51117 1.20887e-16 195 63.546 5.31118 -3.43765 63.546000 Cu 0.651955 0.503165 0.5 4 63.546 7.33369 -3.26517 63.546000 Cu 0.673364 0.535585 0.5 19 63.546 0.500479 -3.47515 63.546000 Cu 0.752649 0.54767 4.69183e-17 21 63.546 0.0897388 -3.52766 63.546000 Cu 0.889798 0.541889 7.54045e-17 6 63.546 0.0869694 -3.53656 63.546000 Cu 0.949104 0.522904 0.5 7 63.546 0.0522249 -3.52554 63.546000 Cu 0.809601 0.525895 0.5 8 63.546 0.318162 -3.52952 63.546000 Cu 0.869309 0.505511 9.67092e-17 361 63.546 0.347493 -3.50656 63.546000 Cu 0.0520896 0.574109 5.48178e-17 10 63.546 0.0138197 -3.53477 63.546000 Cu 0.112388 0.555132 0.5 11 63.546 0.127036 -3.52242 63.546000 Cu 0.133384 0.589345 0.5 13 63.546 0.0356519 -3.53137 63.546000 Cu 0.193415 0.569392 1 58 63.546 0.0756885 -3.52292 63.546000 Cu 0.331454 0.562182 0 36 63.546 0.0715344 -3.54448 63.546000 Cu 0.273231 0.583119 0.5 60 63.546 0.0138797 -3.53954 63.546000 Cu 0.353083 0.59778 8.37827e-17 61 63.546 0.0186347 -3.54317 63.546000 Cu 0.470732 0.558186 0 39 63.546 0.0142994 -3.53698 63.546000 Cu 0.492523 0.593311 1.37643e-16 40 63.546 0.0050352 -3.53925 63.546000 Cu 0.55209 0.574109 0.5 41 63.546 0.0138197 -3.53477 63.546000 Cu 0.411686 0.577613 0.5 42 63.546 0.0296921 -3.54217 63.546000 Cu 0.612388 0.555132 1 18 63.546 0.127036 -3.52242 63.546000 Cu 0.773231 0.583119 1 22 63.546 0.0138797 -3.53954 63.546000 Cu 0.693415 0.569392 0.5 24 63.546 0.0756885 -3.52292 63.546000 Cu 0.633384 0.589345 1 43 63.546 0.0356519 -3.53137 63.546000 Cu 0.992523 0.593311 0.5 27 63.546 0.0050352 -3.53925 63.546000 Cu 0.970732 0.558186 0.5 12 63.546 0.0142994 -3.53698 63.546000 Cu 0.831454 0.562182 0.5 23 63.546 0.0715344 -3.54448 63.546000 Cu 0.911686 0.577613 5.96054e-17 25 63.546 0.0296921 -3.54217 63.546000 Cu 0.853083 0.59778 0.5 28 63.546 0.0186347 -3.54317 63.546000 Cu 0.0736324 0.608796 1.21365e-16 29 63.546 0.00480341 -3.53686 63.546000 Cu 0.0949739 0.643594 2.6212e-16 30 63.546 0.0015252 -3.5384 63.546000 Cu 0.0141891 0.62835 0.5 31 63.546 0.00158563 -3.54011 63.546000 Cu 0.154602 0.623883 0.5 82 63.546 0.00984027 -3.53574 63.546000 Cu 0.214198 0.603873 2.39379e-19 59 63.546 0.0148944 -3.53457 63.546000 Cu 0.374587 0.63307 1 62 63.546 0.00483557 -3.54199 63.546000 Cu 0.294405 0.618252 0.5 64 63.546 0.00325301 -3.54031 63.546000 Cu 0.235171 0.638605 3.54281e-17 83 63.546 0.00319051 -3.53776 63.546000 Cu 0.573632 0.608796 0.5 46 63.546 0.00480341 -3.53686 63.546000 Cu 0.43348 0.612983 0.5 63 63.546 0.00883878 -3.54187 63.546000 Cu 0.514189 0.62835 0 65 63.546 0.00158563 -3.54011 63.546000 Cu 0.454925 0.648182 0.5 68 63.546 0.00227506 -3.54143 63.546000 Cu 0.594974 0.643594 0.5 67 63.546 0.0015252 -3.5384 63.546000 Cu 0.654602 0.623883 2.36985e-17 44 63.546 0.00984027 -3.53574 63.546000 Cu 0.714198 0.603873 0.5 45 63.546 0.0148944 -3.53457 63.546000 Cu 0.735171 0.638605 0.5 50 63.546 0.00319051 -3.53776 63.546000 Cu 0.794405 0.618252 2.39379e-19 47 63.546 0.00325301 -3.54031 63.546000 Cu 0.93348 0.612983 0 26 63.546 0.00883878 -3.54187 63.546000 Cu 0.874587 0.63307 0.5 49 63.546 0.00483557 -3.54199 63.546000 Cu 0.954925 0.648182 0 51 63.546 0.00227506 -3.54143 63.546000 Cu 0.0354626 0.663369 0.5 53 63.546 0.000436264 -3.54026 63.546000 Cu 0.115939 0.678486 1 55 63.546 0.000487162 -3.53914 63.546000 Cu 0.0562874 0.698378 0.5 57 63.546 0.000192761 -3.54017 63.546000 Cu 0.175588 0.658617 0.5 86 63.546 0.00229621 -3.53782 63.546000 Cu 0.196382 0.693476 0.5 108 63.546 0.000535847 -3.53887 63.546000 Cu 0.256035 0.673465 1.8911e-17 84 63.546 0.000660123 -3.53899 63.546000 Cu 0.315462 0.653309 0.5 85 63.546 0.000842431 -3.54033 63.546000 Cu 0.336308 0.688336 0.5 90 63.546 0.000308795 -3.5402 63.546000 Cu 0.395679 0.668223 0 87 63.546 0.00115412 -3.54107 63.546000 Cu 0.535463 0.663369 7.34894e-17 66 63.546 0.000436264 -3.54026 63.546000 Cu 0.476004 0.683288 0.5 89 63.546 0.000528915 -3.54072 63.546000 Cu 0.556287 0.698378 1 91 63.546 0.000192761 -3.54017 63.546000 Cu 0.675588 0.658617 2.39379e-19 69 63.546 0.00229621 -3.53782 63.546000 Cu 0.696382 0.693476 3.13587e-17 70 63.546 0.000535847 -3.53887 63.546000 Cu 0.756035 0.673465 0.5 71 63.546 0.000660123 -3.53899 63.546000 Cu 0.615939 0.678486 0.5 72 63.546 0.000487162 -3.53914 63.546000 Cu 0.815462 0.653309 1 48 63.546 0.000842431 -3.54033 63.546000 Cu 0.976004 0.683288 2.39379e-19 52 63.546 0.000528915 -3.54072 63.546000 Cu 0.895679 0.668223 0.5 54 63.546 0.00115412 -3.54107 63.546000 Cu 0.836308 0.688336 2.39379e-19 73 63.546 0.000308795 -3.5402 63.546000 Cu 0.136522 0.713417 7.325e-17 56 63.546 0.000176968 -3.53935 63.546000 Cu 0.0766711 0.733403 0.5 79 63.546 0.000205609 -3.54006 63.546000 Cu 0.156775 0.748347 6.05629e-17 132 63.546 0.0002091 -3.53931 63.546000 Cu 0.276615 0.708401 8.13889e-17 109 63.546 0.000217896 -3.53935 63.546000 Cu 0.296928 0.743337 5.48178e-17 110 63.546 0.0001807 -3.53935 63.546000 Cu 0.356755 0.723353 0.5 111 63.546 0.000146976 -3.54029 63.546000 Cu 0.216705 0.72837 0.5 112 63.546 1.28654e-05 -3.53884 63.546000 Cu 0.416465 0.703302 1 88 63.546 0.000307569 -3.54073 63.546000 Cu 0.576671 0.733403 1 92 63.546 0.000205609 -3.54006 63.546000 Cu 0.496593 0.718352 0.5 94 63.546 8.95066e-05 -3.54077 63.546000 Cu 0.436884 0.738384 7.49257e-17 113 63.546 7.98105e-05 -3.54086 63.546000 Cu 0.776615 0.708401 0.5 76 63.546 0.000217896 -3.53935 63.546000 Cu 0.636522 0.713417 0.5 93 63.546 0.000176968 -3.53935 63.546000 Cu 0.716705 0.72837 7.70801e-17 95 63.546 1.28654e-05 -3.53884 63.546000 Cu 0.656775 0.748347 0.5 98 63.546 0.0002091 -3.53931 63.546000 Cu 0.796928 0.743337 0.5 97 63.546 0.0001807 -3.53935 63.546000 Cu 0.996593 0.718352 4.78758e-19 77 63.546 8.95066e-05 -3.54077 63.546000 Cu 0.856755 0.723353 8.61765e-17 74 63.546 0.000146976 -3.54029 63.546000 Cu 0.916465 0.703302 0.5 75 63.546 0.000307569 -3.54073 63.546000 Cu 0.936884 0.738384 0.5 80 63.546 7.98105e-05 -3.54086 63.546000 Cu 0.0169071 0.753445 7.18138e-19 78 63.546 0.000230509 -3.54084 63.546000 Cu 0.0968458 0.76843 0.5 81 63.546 0.000252368 -3.54022 63.546000 Cu 0.0369804 0.788557 1 103 63.546 0.00126082 -3.54119 63.546000 Cu 0.176776 0.78329 1 133 63.546 0.000725885 -3.53896 63.546000 Cu 0.377043 0.758382 0.5 116 63.546 0.000256353 -3.54026 63.546000 Cu 0.236875 0.763274 0.5 134 63.546 0.000501121 -3.53887 63.546000 Cu 0.316982 0.778269 8.64159e-17 135 63.546 0.000585297 -3.53922 63.546000 Cu 0.256894 0.798147 0.5 138 63.546 0.00260804 -3.53798 63.546000 Cu 0.397171 0.79342 0.5 137 63.546 0.000588529 -3.5404 63.546000 Cu 0.457039 0.77349 7.37288e-17 114 63.546 0.000600873 -3.54115 63.546000 Cu 0.516907 0.753445 0.5 115 63.546 0.000230509 -3.54084 63.546000 Cu 0.53698 0.788557 0.5 120 63.546 0.00126082 -3.54119 63.546000 Cu 0.596846 0.76843 0 117 63.546 0.000252368 -3.54022 63.546000 Cu 0.736875 0.763274 1.21605e-16 96 63.546 0.000501121 -3.53887 63.546000 Cu 0.676776 0.78329 0.5 119 63.546 0.000725885 -3.53896 63.546000 Cu 0.756894 0.798147 2.39379e-19 121 63.546 0.00260804 -3.53798 63.546000 Cu 0.877043 0.758382 0 99 63.546 0.000256353 -3.54026 63.546000 Cu 0.897171 0.79342 1.55596e-16 100 63.546 0.000588529 -3.5404 63.546000 Cu 0.957039 0.77349 0.5 101 63.546 0.000600873 -3.54115 63.546000 Cu 0.816982 0.778269 0.5 102 63.546 0.000585297 -3.53922 63.546000 Cu 0.0574741 0.823729 9.19216e-17 104 63.546 0.00456446 -3.54175 63.546000 Cu 0.116932 0.803463 0.5 105 63.546 0.000785163 -3.54014 63.546000 Cu 0.137414 0.838534 0.5 107 63.546 0.00264042 -3.54016 63.546000 Cu 0.19699 0.818178 6.65474e-17 158 63.546 0.00312371 -3.53761 63.546000 Cu 0.337275 0.813186 1.22083e-16 136 63.546 0.00183953 -3.53852 63.546000 Cu 0.277337 0.832919 0.5 160 63.546 0.010069 -3.53602 63.546000 Cu 0.357969 0.848044 4.78758e-19 161 63.546 0.00481917 -3.5375 63.546000 Cu 0.47735 0.808638 6.87018e-17 139 63.546 0.00305039 -3.54138 63.546000 Cu 0.498227 0.843868 2.39379e-19 140 63.546 0.0100708 -3.54198 63.546000 Cu 0.557474 0.823729 0.5 141 63.546 0.00456446 -3.54175 63.546000 Cu 0.417816 0.828481 0.5 142 63.546 0.00173696 -3.54014 63.546000 Cu 0.616932 0.803463 2.39379e-19 118 63.546 0.000785163 -3.54014 63.546000 Cu 0.777337 0.832919 1 122 63.546 0.010069 -3.53602 63.546000 Cu 0.69699 0.818178 0.5 124 63.546 0.00312371 -3.53761 63.546000 Cu 0.637414 0.838534 1 143 63.546 0.00264042 -3.54016 63.546000 Cu 0.998227 0.843868 0.5 127 63.546 0.0100708 -3.54198 63.546000 Cu 0.97735 0.808638 0.5 106 63.546 0.00305039 -3.54138 63.546000 Cu 0.837275 0.813186 0.5 123 63.546 0.00183953 -3.53852 63.546000 Cu 0.917816 0.828481 2.39379e-19 125 63.546 0.00173696 -3.54014 63.546000 Cu 0.857969 0.848044 0.5 128 63.546 0.00481917 -3.5375 63.546000 Cu 0.0782705 0.859057 4.04551e-17 129 63.546 0.017423 -3.5432 63.546000 Cu 0.0993078 0.894722 1.40516e-16 130 63.546 0.0697881 -3.54383 63.546000 Cu 0.0192767 0.879285 0.5 131 63.546 0.0301531 -3.54206 63.546000 Cu 0.157833 0.873753 0.5 180 63.546 0.0140218 -3.53919 63.546000 Cu 0.217306 0.852958 0 159 63.546 0.0150938 -3.53469 63.546000 Cu 0.378783 0.882813 1.50809e-17 162 63.546 0.0126356 -3.5353 63.546000 Cu 0.297777 0.867527 0.5 164 63.546 0.0360435 -3.53183 63.546000 Cu 0.237416 0.887506 1 181 63.546 0.0785905 -3.5227 63.546000 Cu 0.578271 0.859057 0.5 146 63.546 0.017423 -3.5432 63.546000 Cu 0.438686 0.863574 0.5 163 63.546 0.00503544 -3.53968 63.546000 Cu 0.519277 0.879285 1.60384e-17 165 63.546 0.0301531 -3.54206 63.546000 Cu 0.459922 0.898744 0.5 168 63.546 0.014212 -3.53739 63.546000 Cu 0.599308 0.894722 0.5 167 63.546 0.0697881 -3.54383 63.546000 Cu 0.657833 0.873753 1 144 63.546 0.0140218 -3.53919 63.546000 Cu 0.717306 0.852958 0.5 145 63.546 0.0150938 -3.53469 63.546000 Cu 0.737416 0.887506 0.5 150 63.546 0.0785905 -3.5227 63.546000 Cu 0.797777 0.867527 2.39379e-19 147 63.546 0.0360435 -3.53183 63.546000 Cu 0.938686 0.863574 1.21605e-16 126 63.546 0.00503544 -3.53968 63.546000 Cu 0.878783 0.882813 0.5 149 63.546 0.0126356 -3.5353 63.546000 Cu 0.959922 0.898744 1.85998e-16 151 63.546 0.014212 -3.53739 63.546000 Cu 0.0405792 0.915062 0.5 153 63.546 0.0859292 -3.53638 63.546000 Cu 0.120447 0.931088 1.31419e-16 155 63.546 0.317662 -3.52896 63.546000 Cu 0.177772 0.90931 0.5 184 63.546 0.0973365 -3.52603 63.546000 Cu 0.195736 0.945977 0.5 196 63.546 5.31704 -3.43399 63.546000 Cu 0.256868 0.921374 1 182 63.546 0.524628 -3.47196 63.546000 Cu 0.318213 0.901815 0.5 183 63.546 0.127263 -3.52304 63.546000 Cu 0.338676 0.935648 0.5 188 63.546 0.491208 -3.50089 63.546000 Cu 0.39976 0.917484 1 185 63.546 0.0274905 -3.5328 63.546000 Cu 0.540579 0.915062 1.1969e-18 166 63.546 0.0859292 -3.53638 63.546000 Cu 0.480799 0.934087 0.5 187 63.546 0.055708 -3.52676 63.546000 Cu 0.677772 0.90931 1 169 63.546 0.0973365 -3.52603 63.546000 Cu 0.695736 0.945977 1 170 63.546 5.31704 -3.43399 63.546000 Cu 0.756868 0.921374 0.5 171 63.546 0.524628 -3.47196 63.546000 Cu 0.620447 0.931088 0.5 172 63.546 0.317662 -3.52896 63.546000 Cu 0.818213 0.901815 1 148 63.546 0.127263 -3.52304 63.546000 Cu 0.980799 0.934087 1 152 63.546 0.055708 -3.52676 63.546000 Cu 0.89976 0.917484 0.5 154 63.546 0.0274905 -3.5328 63.546000 Cu 0.838676 0.935648 7.18138e-19 173 63.546 0.491208 -3.50089 63.546000 Cu 0.0600143 0.951526 0.5 157 63.546 0.347985 -3.50648 63.546000 Cu 0.141406 0.969696 0 156 63.546 4.3872 -3.54463 63.546000 Cu 0.0596274 0.987796 0.5 178 63.546 0.352736 -3.50631 63.546000 Cu 0.195255 0.993517 0.5 200 63.546 5.35034 -3.43416 63.546000 Cu 0.277533 0.953782 1.85758e-16 197 63.546 7.3739 -3.2612 63.546000 Cu 0.277042 0.985601 1 198 63.546 7.32479 -3.26439 63.546000 Cu 0.349618 0.96971 0.5 199 63.546 3.21907 -3.47713 63.546000 Cu 0.560014 0.951526 1 189 63.546 0.347985 -3.50648 63.546000 Cu 0.418598 0.952259 7.18138e-19 186 63.546 0.182029 -3.53462 63.546000 Cu 0.559627 0.987796 1 190 63.546 0.352736 -3.50631 63.546000 Cu 0.493492 0.969658 0.5 192 63.546 0.33591 -3.53129 63.546000 Cu 0.418175 0.987106 1.1969e-18 201 63.546 0.170604 -3.53369 63.546000 Cu 0.777533 0.953782 0.5 176 63.546 7.3739 -3.2612 63.546000 Cu 0.641406 0.969696 0.5 191 63.546 4.3872 -3.54463 63.546000 Cu 0.695255 0.993517 5.7451e-17 193 63.546 5.35034 -3.43416 63.546000 Cu 0.777042 0.985601 0.5 194 63.546 7.32479 -3.26439 63.546000 Cu 0.993492 0.969658 0 177 63.546 0.33591 -3.53129 63.546000 Cu 0.849618 0.96971 1 174 63.546 3.21907 -3.47713 63.546000 Cu 0.918598 0.952259 0.5 175 63.546 0.182029 -3.53462 63.546000 Cu 0.918175 0.987106 0.5 179 63.546 0.170604 -3.53369