Number of particles = 400 A = 1 Angstrom (basic length-scale) H0(1,1) = 17.9498 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.1413 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.64009 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 0.125638 0.0374422 2.26176e-15 208 63.546 0.464772 -3.60259 63.546000 Cu 0.0452378 0.0210215 0.5 209 63.546 0.0807302 -3.5428 63.546000 Cu 0.0623995 0.057064 0.5 210 63.546 0.200666 -3.5227 63.546000 Cu 0.105084 0.00107162 2.15977e-15 211 63.546 0.121083 -3.57075 63.546000 Cu 0.261113 0.0270435 2.96707e-15 212 63.546 0.804263 -3.32503 63.546000 Cu 0.182889 0.0159086 0.5 213 63.546 0.245932 -3.53263 63.546000 Cu 0.32291 0.00726651 0.5 214 63.546 0.22498 -3.46387 63.546000 Cu 0.142163 0.0750105 1.78996e-15 221 63.546 2.64654 -3.76943 63.546000 Cu 0.279408 0.0906 3.43696e-15 222 63.546 7.48336 -2.93644 63.546000 Cu 0.199506 0.0536496 0.5 223 63.546 2.21192 -3.51523 63.546000 Cu 0.280461 0.0591931 5.19452e-15 225 63.546 7.49698 -2.91654 63.546000 Cu 0.421082 0.0575851 2.97088e-15 226 63.546 0.168639 -3.49306 63.546000 Cu 0.34188 0.0409212 0.5 227 63.546 0.794899 -3.4128 63.546000 Cu 0.35102 0.0749661 0.5 228 63.546 2.56889 -3.40322 63.546000 Cu 0.403958 0.0229404 3.21488e-15 229 63.546 0.0415644 -3.50197 63.546000 Cu 0.464942 0.00450221 0.5 231 63.546 0.0110586 -3.52996 63.546000 Cu 0.484295 0.0396186 0.5 232 63.546 0.0457404 -3.51522 63.546000 Cu 0.494968 0.0749801 0.5 249 63.546 0.250226 -3.54183 63.546000 Cu 0.964942 0.00450221 1.79568e-15 202 63.546 0.0110586 -3.52996 63.546000 Cu 0.994968 0.0749801 2.02729e-15 204 63.546 0.250226 -3.54183 63.546000 Cu 0.984295 0.0396186 2.02062e-15 207 63.546 0.0457404 -3.51522 63.546000 Cu 0.82291 0.00726651 2.2732e-15 201 63.546 0.22498 -3.46387 63.546000 Cu 0.903958 0.0229404 0.5 203 63.546 0.0415644 -3.50197 63.546000 Cu 0.921082 0.0575851 0.5 205 63.546 0.168639 -3.49306 63.546000 Cu 0.545238 0.0210215 1.91864e-15 230 63.546 0.0807302 -3.5428 63.546000 Cu 0.605084 0.00107162 0.5 233 63.546 0.121083 -3.57075 63.546000 Cu 0.5624 0.057064 2.40187e-15 251 63.546 0.200666 -3.5227 63.546000 Cu 0.699506 0.0536496 4.26808e-15 252 63.546 2.21192 -3.51523 63.546000 Cu 0.625638 0.0374422 0.5 253 63.546 0.464772 -3.60259 63.546000 Cu 0.642163 0.0750105 0.5 254 63.546 2.64654 -3.76943 63.546000 Cu 0.682889 0.0159086 2.39234e-15 255 63.546 0.245932 -3.53263 63.546000 Cu 0.84188 0.0409212 3.79057e-15 256 63.546 0.794899 -3.4128 63.546000 Cu 0.761113 0.0270435 0.5 257 63.546 0.804263 -3.32503 63.546000 Cu 0.780461 0.0591931 0.5 258 63.546 7.49698 -2.91654 63.546000 Cu 0.779408 0.0906 0.5 281 63.546 7.48336 -2.93644 63.546000 Cu 0.85102 0.0749661 4.961e-15 283 63.546 2.56889 -3.40322 63.546000 Cu 0.420182 0.0923654 1.90434e-15 247 63.546 0.163621 -3.49237 63.546000 Cu 0.123763 0.112559 1.9234e-15 218 63.546 0.443589 -3.59834 63.546000 Cu 0.061493 0.0929101 0.5 219 63.546 0.204278 -3.5219 63.546000 Cu 0.0427716 0.128942 0.5 220 63.546 0.0809626 -3.54075 63.546000 Cu 0.198494 0.0965268 0.5 224 63.546 1.99088 -3.51524 63.546000 Cu 0.0213602 0.164538 0.5 237 63.546 0.036247 -3.55132 63.546000 Cu 0.1017 0.148891 1.45637e-15 239 63.546 0.115738 -3.56913 63.546000 Cu 0.239259 0.156534 1.57932e-15 240 63.546 0.107184 -3.4733 63.546000 Cu 0.180307 0.134101 0.5 241 63.546 0.219089 -3.53713 63.546000 Cu 0.159952 0.169828 0.5 242 63.546 0.0353244 -3.54526 63.546000 Cu 0.25902 0.122805 2.04159e-15 243 63.546 0.725112 -3.34126 63.546000 Cu 0.40164 0.126988 1.56121e-15 244 63.546 0.0425845 -3.49788 63.546000 Cu 0.340338 0.108987 0.5 245 63.546 0.75785 -3.41216 63.546000 Cu 0.319988 0.142632 0.5 246 63.546 0.215864 -3.46377 63.546000 Cu 0.299485 0.17666 0.5 269 63.546 0.0667108 -3.49523 63.546000 Cu 0.380546 0.161447 1.45446e-15 271 63.546 0.0245835 -3.51108 63.546000 Cu 0.461786 0.145434 0.5 273 63.546 0.0106426 -3.5269 63.546000 Cu 0.440568 0.180421 0.5 274 63.546 0.0043521 -3.53478 63.546000 Cu 0.482592 0.110339 0.5 250 63.546 0.0439087 -3.51227 63.546000 Cu 0.920182 0.0923654 0.5 206 63.546 0.163621 -3.49237 63.546000 Cu 0.982592 0.110339 2.27892e-15 217 63.546 0.0439087 -3.51227 63.546000 Cu 0.961786 0.145434 1.56598e-15 215 63.546 0.0106426 -3.5269 63.546000 Cu 0.90164 0.126988 0.5 216 63.546 0.0425845 -3.49788 63.546000 Cu 0.940568 0.180421 1.09895e-15 235 63.546 0.0043521 -3.53478 63.546000 Cu 0.561493 0.0929101 1.32007e-15 248 63.546 0.204278 -3.5219 63.546000 Cu 0.52136 0.164538 1.33342e-15 272 63.546 0.036247 -3.55132 63.546000 Cu 0.542772 0.128942 1.44493e-15 275 63.546 0.0809626 -3.54075 63.546000 Cu 0.680307 0.134101 1.79664e-15 276 63.546 0.219089 -3.53713 63.546000 Cu 0.623763 0.112559 0.5 277 63.546 0.443589 -3.59834 63.546000 Cu 0.6017 0.148891 0.5 278 63.546 0.115738 -3.56913 63.546000 Cu 0.698494 0.0965268 2.94896e-15 279 63.546 1.99088 -3.51524 63.546000 Cu 0.840338 0.108987 3.20154e-15 280 63.546 0.75785 -3.41216 63.546000 Cu 0.75902 0.122805 0.5 282 63.546 0.725112 -3.34126 63.546000 Cu 0.659952 0.169828 1.57265e-15 303 63.546 0.0353244 -3.54526 63.546000 Cu 0.799485 0.17666 1.33246e-15 304 63.546 0.0667108 -3.49523 63.546000 Cu 0.739259 0.156534 0.5 305 63.546 0.107184 -3.4733 63.546000 Cu 0.819988 0.142632 1.43636e-15 307 63.546 0.215864 -3.46377 63.546000 Cu 0.880546 0.161447 0.5 308 63.546 0.0245835 -3.51108 63.546000 Cu 0.0804095 0.184526 7.49154e-16 236 63.546 0.0355753 -3.55743 63.546000 Cu 0.000174364 0.199847 0.5 238 63.546 0.0140677 -3.54787 63.546000 Cu 0.0383447 0.254959 1 260 63.546 0.0029505 -3.54327 63.546000 Cu 0.0594004 0.219833 5.22311e-16 263 63.546 0.0108929 -3.54887 63.546000 Cu 0.198573 0.225576 4.86092e-17 264 63.546 0.00545384 -3.52556 63.546000 Cu 0.139294 0.20505 0.5 265 63.546 0.00788299 -3.54236 63.546000 Cu 0.11851 0.240107 0.5 266 63.546 0.00198091 -3.5394 63.546000 Cu 0.219078 0.190915 7.54873e-16 267 63.546 0.0211093 -3.51285 63.546000 Cu 0.359709 0.196001 1.11611e-15 268 63.546 0.0112697 -3.51944 63.546000 Cu 0.278954 0.211032 0.5 270 63.546 0.0203283 -3.51445 63.546000 Cu 0.177869 0.26034 1 291 63.546 0.00147397 -3.52992 63.546000 Cu 0.317981 0.265369 1 292 63.546 0.00115472 -3.52814 63.546000 Cu 0.258228 0.245618 0.5 293 63.546 0.00595186 -3.52335 63.546000 Cu 0.338872 0.230641 1 295 63.546 0.00388773 -3.52501 63.546000 Cu 0.419568 0.215342 0.5 297 63.546 0.00179963 -3.53471 63.546000 Cu 0.398541 0.250237 0.5 298 63.546 0.00062365 -3.53425 63.546000 Cu 0.458019 0.270003 1 323 63.546 0.00166521 -3.53958 63.546000 Cu 0.479057 0.234984 1 296 63.546 0.00473909 -3.5432 63.546000 Cu 0.979057 0.234984 0.5 261 63.546 0.00473909 -3.5432 63.546000 Cu 0.919568 0.215342 5.17545e-16 234 63.546 0.00179963 -3.53471 63.546000 Cu 0.898541 0.250237 1 259 63.546 0.00062365 -3.53425 63.546000 Cu 0.958019 0.270003 0.5 262 63.546 0.00166521 -3.53958 63.546000 Cu 0.500174 0.199847 9.9506e-16 299 63.546 0.0140677 -3.54787 63.546000 Cu 0.639294 0.20505 7.56779e-16 300 63.546 0.00788299 -3.54236 63.546000 Cu 0.580409 0.184526 0.5 301 63.546 0.0355753 -3.55743 63.546000 Cu 0.5594 0.219833 0.5 302 63.546 0.0108929 -3.54887 63.546000 Cu 0.719078 0.190915 0.5 306 63.546 0.0211093 -3.51285 63.546000 Cu 0.538345 0.254959 0.5 325 63.546 0.0029505 -3.54327 63.546000 Cu 0.61851 0.240107 1 327 63.546 0.00198091 -3.5394 63.546000 Cu 0.758228 0.245618 1 328 63.546 0.00595186 -3.52335 63.546000 Cu 0.698573 0.225576 0.5 329 63.546 0.00545384 -3.52556 63.546000 Cu 0.677869 0.26034 0.5 330 63.546 0.00147397 -3.52992 63.546000 Cu 0.778954 0.211032 1.11897e-15 331 63.546 0.0203283 -3.51445 63.546000 Cu 0.859709 0.196001 0.5 332 63.546 0.0112697 -3.51944 63.546000 Cu 0.838872 0.230641 0.5 333 63.546 0.00388773 -3.52501 63.546000 Cu 0.817981 0.265369 0.5 357 63.546 0.00115472 -3.52814 63.546000 Cu 0.0173315 0.289989 1 287 63.546 0.000640159 -3.54064 63.546000 Cu 0.157021 0.295151 1 288 63.546 0.000610437 -3.53273 63.546000 Cu 0.0976209 0.27508 0.5 289 63.546 0.000497603 -3.53819 63.546000 Cu 0.0768152 0.310035 0.5 290 63.546 0.000170651 -3.53826 63.546000 Cu 0.237451 0.280322 0.5 294 63.546 0.00157599 -3.52744 63.546000 Cu 0.0562564 0.344994 0.5 313 63.546 0.000400803 -3.53899 63.546000 Cu 0.136434 0.330003 1 315 63.546 0.000335916 -3.53331 63.546000 Cu 0.276527 0.334911 1 316 63.546 0.000184378 -3.5292 63.546000 Cu 0.216728 0.315075 0.5 317 63.546 0.000228007 -3.52954 63.546000 Cu 0.196256 0.349841 0.5 318 63.546 0.000183457 -3.52827 63.546000 Cu 0.297133 0.30013 1 319 63.546 0.000155519 -3.52997 63.546000 Cu 0.437139 0.304997 1 320 63.546 0.000371766 -3.53866 63.546000 Cu 0.377595 0.285118 0.5 321 63.546 0.000384153 -3.5339 63.546000 Cu 0.356838 0.31998 0.5 322 63.546 0.000315498 -3.53431 63.546000 Cu 0.336336 0.35482 0.5 345 63.546 0.000562286 -3.53258 63.546000 Cu 0.416503 0.339958 1 347 63.546 0.000178032 -3.53872 63.546000 Cu 0.496623 0.324994 0.5 349 63.546 3.07333e-05 -3.54058 63.546000 Cu 0.476106 0.359993 0.5 350 63.546 0.000631553 -3.54169 63.546000 Cu 0.996623 0.324994 1 284 63.546 3.07333e-05 -3.54058 63.546000 Cu 0.976106 0.359993 1 311 63.546 0.000631553 -3.54169 63.546000 Cu 0.937139 0.304997 0.5 285 63.546 0.000371766 -3.53866 63.546000 Cu 0.916503 0.339958 0.5 286 63.546 0.000178032 -3.53872 63.546000 Cu 0.597621 0.27508 1 324 63.546 0.000497603 -3.53819 63.546000 Cu 0.517332 0.289989 0.5 326 63.546 0.000640159 -3.54064 63.546000 Cu 0.556256 0.344994 1.3725e-16 348 63.546 0.000400803 -3.53899 63.546000 Cu 0.576815 0.310035 1 351 63.546 0.000170651 -3.53826 63.546000 Cu 0.716728 0.315075 1 352 63.546 0.000228007 -3.52954 63.546000 Cu 0.657021 0.295151 0.5 353 63.546 0.000610437 -3.53273 63.546000 Cu 0.636434 0.330003 0.5 354 63.546 0.000335916 -3.53331 63.546000 Cu 0.737451 0.280322 1 355 63.546 0.00157599 -3.52744 63.546000 Cu 0.877595 0.285118 1 356 63.546 0.000384153 -3.5339 63.546000 Cu 0.797133 0.30013 0.5 358 63.546 0.000155519 -3.52997 63.546000 Cu 0.696256 0.349841 1 377 63.546 0.000183457 -3.52827 63.546000 Cu 0.836336 0.35482 1 378 63.546 0.000562286 -3.53258 63.546000 Cu 0.776527 0.334911 0.5 379 63.546 0.000184378 -3.5292 63.546000 Cu 0.856838 0.31998 1 381 63.546 0.000315498 -3.53431 63.546000 Cu 0.115983 0.364859 1 312 63.546 0.000333981 -3.5341 63.546000 Cu 0.0357392 0.379965 0.5 314 63.546 0.00155777 -3.54044 63.546000 Cu 0.0750224 0.43461 1.342e-15 336 63.546 0.00201247 -3.53553 63.546000 Cu 0.0151547 0.414976 0.5 337 63.546 0.00485578 -3.5426 63.546000 Cu 0.0954509 0.399728 5.7092e-16 339 63.546 0.000693811 -3.53478 63.546000 Cu 0.235831 0.404336 5.68061e-16 340 63.546 0.00612742 -3.5229 63.546000 Cu 0.175866 0.384592 0.5 341 63.546 0.00131969 -3.52785 63.546000 Cu 0.155443 0.419306 0.5 342 63.546 0.00416102 -3.52596 63.546000 Cu 0.256158 0.369659 8.33982e-16 343 63.546 0.0013994 -3.52651 63.546000 Cu 0.396058 0.374901 6.40498e-16 344 63.546 0.000566829 -3.53842 63.546000 Cu 0.316023 0.389626 0.5 346 63.546 0.00156435 -3.52954 63.546000 Cu 0.215791 0.438899 8.60669e-16 365 63.546 0.0212305 -3.51347 63.546000 Cu 0.355587 0.444889 8.38748e-16 366 63.546 0.00795778 -3.54155 63.546000 Cu 0.295871 0.424374 0.5 367 63.546 0.0055299 -3.52472 63.546000 Cu 0.375667 0.409854 1.11134e-15 369 63.546 0.00199227 -3.53899 63.546000 Cu 0.455602 0.39502 0.5 371 63.546 0.00333409 -3.54284 63.546000 Cu 0.435165 0.430131 0.5 372 63.546 0.0115601 -3.54811 63.546000 Cu 0.494843 0.450101 1.82332e-15 387 63.546 0.0140229 -3.54795 63.546000 Cu 0.135396 0.453942 0.5 363 63.546 0.0109641 -3.5194 63.546000 Cu 0.994843 0.450101 0.5 338 63.546 0.0140229 -3.54795 63.546000 Cu 0.855587 0.444889 0.5 15 63.546 0.00795778 -3.54155 63.546000 Cu 0.955602 0.39502 7.70123e-16 309 63.546 0.00333409 -3.54284 63.546000 Cu 0.896058 0.374901 0.5 310 63.546 0.000566829 -3.53842 63.546000 Cu 0.935165 0.430131 1.09514e-15 335 63.546 0.0115601 -3.54811 63.546000 Cu 0.515155 0.414976 7.11982e-16 370 63.546 0.00485578 -3.5426 63.546000 Cu 0.535739 0.379965 3.6314e-16 373 63.546 0.00155777 -3.54044 63.546000 Cu 0.675866 0.384592 6.76717e-16 374 63.546 0.00131969 -3.52785 63.546000 Cu 0.615983 0.364859 0.5 375 63.546 0.000333981 -3.5341 63.546000 Cu 0.595451 0.399728 0.5 376 63.546 0.000693811 -3.53478 63.546000 Cu 0.756158 0.369659 0.5 380 63.546 0.0013994 -3.52651 63.546000 Cu 0.575022 0.43461 0.5 389 63.546 0.00201247 -3.53553 63.546000 Cu 0.655443 0.419306 8.99747e-16 391 63.546 0.00416102 -3.52596 63.546000 Cu 0.795871 0.424374 8.55904e-16 392 63.546 0.0055299 -3.52472 63.546000 Cu 0.735831 0.404336 0.5 393 63.546 0.00612742 -3.5229 63.546000 Cu 0.715791 0.438899 0.5 394 63.546 0.0212305 -3.51347 63.546000 Cu 0.816023 0.389626 9.30247e-16 395 63.546 0.00156435 -3.52954 63.546000 Cu 0.875667 0.409854 0.5 396 63.546 0.00199227 -3.53899 63.546000 Cu 0.635396 0.453942 9.28341e-16 388 63.546 0.0109641 -3.5194 63.546000 Cu 0.0959587 0.522944 0.5 2 63.546 0.041591 -3.50188 63.546000 Cu 0.454672 0.521025 3.22155e-16 14 63.546 0.0806903 -3.54254 63.546000 Cu 0.394825 0.501076 0.5 16 63.546 0.120951 -3.57062 63.546000 Cu 0.177004 0.507275 6.19529e-17 32 63.546 0.224512 -3.4643 63.546000 Cu 0.158033 0.540927 1 33 63.546 0.793045 -3.41226 63.546000 Cu 0.238779 0.527054 0.5 34 63.546 0.801059 -3.32441 63.546000 Cu 0.317032 0.515917 7.63451e-16 35 63.546 0.24658 -3.5333 63.546000 Cu 0.374246 0.537444 0.5 37 63.546 0.464294 -3.60266 63.546000 Cu 0.0549173 0.469529 1.07131e-15 361 63.546 0.00498768 -3.53464 63.546000 Cu 0.196147 0.473241 9.88388e-16 362 63.546 0.0707227 -3.49407 63.546000 Cu 0.1156 0.488476 0.5 364 63.546 0.0246187 -3.51212 63.546000 Cu 0.276208 0.458998 0.5 368 63.546 0.0231195 -3.51035 63.546000 Cu 0.257138 0.493358 0.5 382 63.546 0.117954 -3.46854 63.546000 Cu 0.335933 0.480118 9.93153e-16 383 63.546 0.0381422 -3.54506 63.546000 Cu 0.414991 0.465421 0.5 385 63.546 0.0365045 -3.55783 63.546000 Cu 0.0156014 0.539618 1 9 63.546 0.0457367 -3.51568 63.546000 Cu 0.0349647 0.504513 4.31764e-16 359 63.546 0.011118 -3.52981 63.546000 Cu 0.474649 0.485412 9.67419e-16 384 63.546 0.037144 -3.55271 63.546000 Cu 0.515601 0.539618 0.5 20 63.546 0.0457367 -3.51568 63.546000 Cu 0.974649 0.485412 0.5 360 63.546 0.037144 -3.55271 63.546000 Cu 0.534965 0.504513 0.5 386 63.546 0.011118 -3.52981 63.546000 Cu 0.835933 0.480118 0.5 1 63.546 0.0381422 -3.54506 63.546000 Cu 0.738779 0.527054 4.57499e-17 3 63.546 0.801059 -3.32441 63.546000 Cu 0.677004 0.507275 0.5 4 63.546 0.224512 -3.4643 63.546000 Cu 0.894825 0.501076 4.80374e-16 5 63.546 0.120951 -3.57062 63.546000 Cu 0.874246 0.537444 1 6 63.546 0.464294 -3.60266 63.546000 Cu 0.954672 0.521025 0.5 7 63.546 0.0806903 -3.54254 63.546000 Cu 0.817032 0.515917 0.5 8 63.546 0.24658 -3.5333 63.546000 Cu 0.595959 0.522944 1 17 63.546 0.041591 -3.50188 63.546000 Cu 0.658033 0.540927 0.5 19 63.546 0.793045 -3.41226 63.546000 Cu 0.914991 0.465421 1.48782e-15 334 63.546 0.0365045 -3.55783 63.546000 Cu 0.554917 0.469529 0.5 390 63.546 0.00498768 -3.53464 63.546000 Cu 0.6156 0.488476 1.33342e-15 397 63.546 0.0246187 -3.51212 63.546000 Cu 0.757138 0.493358 1.00268e-15 398 63.546 0.117954 -3.46854 63.546000 Cu 0.696147 0.473241 0.5 399 63.546 0.0707227 -3.49407 63.546000 Cu 0.776208 0.458998 7.79654e-16 400 63.546 0.0231195 -3.51035 63.546000 Cu 0.0787983 0.557589 0.5 11 63.546 0.169117 -3.49365 63.546000 Cu 0.0796727 0.592363 0.5 13 63.546 0.164713 -3.49182 63.546000 Cu 0.300375 0.553649 1 36 63.546 2.2102 -3.51412 63.546000 Cu 0.21946 0.559187 0.5 38 63.546 7.49165 -2.9171 63.546000 Cu 0.437473 0.557071 2.2589e-16 39 63.546 0.201704 -3.52319 63.546000 Cu 0.438392 0.592909 1.2505e-15 40 63.546 0.203916 -3.52164 63.546000 Cu 0.357724 0.575009 0.5 42 63.546 2.64887 -3.7695 63.546000 Cu 0.148852 0.574969 1 58 63.546 2.56906 -3.40421 63.546000 Cu 0.159546 0.608985 1.78234e-15 59 63.546 0.758419 -3.41185 63.546000 Cu 0.220472 0.590612 0.5 60 63.546 7.4801 -2.9369 63.546000 Cu 0.301374 0.596521 1.49354e-15 61 63.546 1.99716 -3.51528 63.546000 Cu 0.319604 0.634094 1.69465e-15 62 63.546 0.220007 -3.53713 63.546000 Cu 0.376121 0.612557 0.5 63 63.546 0.443287 -3.59857 63.546000 Cu 0.240858 0.622804 0.5 64 63.546 0.725613 -3.34055 63.546000 Cu 0.4571 0.628941 9.98872e-16 65 63.546 0.0808875 -3.54068 63.546000 Cu 0.0982465 0.626987 0.5 82 63.546 0.0425912 -3.49825 63.546000 Cu 0.00491725 0.574986 2.49718e-16 10 63.546 0.249864 -3.54131 63.546000 Cu 0.0172864 0.610336 1.49354e-15 29 63.546 0.0440849 -3.51232 63.546000 Cu 0.504917 0.574986 0.5 41 63.546 0.249864 -3.54131 63.546000 Cu 0.517286 0.610336 0.5 46 63.546 0.0440849 -3.51232 63.546000 Cu 0.937473 0.557071 0.5 12 63.546 0.201704 -3.52319 63.546000 Cu 0.578798 0.557589 1 18 63.546 0.169117 -3.49365 63.546000 Cu 0.71946 0.559187 1 21 63.546 7.49165 -2.9171 63.546000 Cu 0.720472 0.590612 2.88796e-16 22 63.546 7.4801 -2.9369 63.546000 Cu 0.800375 0.553649 0.5 23 63.546 2.2102 -3.51412 63.546000 Cu 0.648852 0.574969 0.5 24 63.546 2.56906 -3.40421 63.546000 Cu 0.857724 0.575009 3.74577e-16 25 63.546 2.64887 -3.7695 63.546000 Cu 0.876121 0.612557 9.7981e-16 26 63.546 0.443287 -3.59857 63.546000 Cu 0.938392 0.592909 0.5 27 63.546 0.203916 -3.52164 63.546000 Cu 0.801374 0.596521 0.5 28 63.546 1.99716 -3.51528 63.546000 Cu 0.9571 0.628941 0.5 31 63.546 0.0808875 -3.54068 63.546000 Cu 0.579673 0.592363 1.08656e-15 43 63.546 0.164713 -3.49182 63.546000 Cu 0.598247 0.626987 9.55982e-16 44 63.546 0.0425912 -3.49825 63.546000 Cu 0.659546 0.608985 0.5 45 63.546 0.758419 -3.41185 63.546000 Cu 0.740858 0.622804 1.20189e-15 47 63.546 0.725613 -3.34055 63.546000 Cu 0.819604 0.634094 0.5 49 63.546 0.220007 -3.53713 63.546000 Cu 0.0381289 0.645431 1.28671e-15 30 63.546 0.0105879 -3.52702 63.546000 Cu 0.0593409 0.680413 5.0992e-16 55 63.546 0.0043693 -3.53422 63.546000 Cu 0.0803401 0.715332 8.59716e-16 56 63.546 0.0018373 -3.53489 63.546000 Cu 0.478547 0.664535 9.82669e-16 66 63.546 0.0360897 -3.55108 63.546000 Cu 0.398208 0.648884 0.5 68 63.546 0.116175 -3.56899 63.546000 Cu 0.17992 0.642632 5.66155e-16 83 63.546 0.216791 -3.46395 63.546000 Cu 0.200428 0.676658 9.4645e-16 84 63.546 0.0672547 -3.49542 63.546000 Cu 0.260661 0.656529 0.5 85 63.546 0.107154 -3.47354 63.546000 Cu 0.119356 0.661444 0.5 86 63.546 0.0245573 -3.5109 63.546000 Cu 0.339972 0.669823 1.03033e-15 87 63.546 0.0353777 -3.54521 63.546000 Cu 0.360611 0.705041 4.37483e-16 88 63.546 0.00786171 -3.54242 63.546000 Cu 0.419514 0.684519 0.5 89 63.546 0.0355039 -3.55703 63.546000 Cu 0.280856 0.690907 0.5 90 63.546 0.021053 -3.51277 63.546000 Cu 0.499749 0.699836 7.21514e-16 91 63.546 0.0141636 -3.54778 63.546000 Cu 0.440514 0.719822 0.5 94 63.546 0.0109914 -3.54935 63.546000 Cu 0.140205 0.695994 0.5 108 63.546 0.0113357 -3.51949 63.546000 Cu 0.220956 0.711026 5.48998e-16 109 63.546 0.0205503 -3.51472 63.546000 Cu 0.301328 0.725569 0.5 111 63.546 0.00546805 -3.52563 63.546000 Cu 0.760661 0.656529 1.10753e-15 48 63.546 0.107154 -3.47354 63.546000 Cu 0.67992 0.642632 0.5 50 63.546 0.216791 -3.46395 63.546000 Cu 0.898208 0.648884 6.08092e-16 51 63.546 0.116175 -3.56899 63.546000 Cu 0.919514 0.684519 8.71154e-16 52 63.546 0.0355039 -3.55703 63.546000 Cu 0.978547 0.664535 0.5 53 63.546 0.0360897 -3.55108 63.546000 Cu 0.839972 0.669823 0.5 54 63.546 0.0353777 -3.54521 63.546000 Cu 0.999749 0.699836 0.5 57 63.546 0.0141636 -3.54778 63.546000 Cu 0.538129 0.645431 0.5 67 63.546 0.0105879 -3.52702 63.546000 Cu 0.619356 0.661444 1.10562e-15 69 63.546 0.0245573 -3.5109 63.546000 Cu 0.640205 0.695994 1.19045e-15 70 63.546 0.0113357 -3.51949 63.546000 Cu 0.700428 0.676658 0.5 71 63.546 0.0672547 -3.49542 63.546000 Cu 0.559341 0.680413 0.5 72 63.546 0.0043693 -3.53422 63.546000 Cu 0.780856 0.690907 4.31764e-16 73 63.546 0.021053 -3.51277 63.546000 Cu 0.801328 0.725569 9.922e-16 74 63.546 0.00546805 -3.52563 63.546000 Cu 0.860611 0.705041 0.5 75 63.546 0.00786171 -3.54242 63.546000 Cu 0.720956 0.711026 0.5 76 63.546 0.0205503 -3.51472 63.546000 Cu 0.940514 0.719822 1.10943e-15 77 63.546 0.0109914 -3.54935 63.546000 Cu 0.58034 0.715332 0.5 93 63.546 0.0018373 -3.53489 63.546000 Cu 0.0418515 0.769996 0.5 81 63.546 0.0016036 -3.53963 63.546000 Cu 0.0627203 0.804988 0.5 105 63.546 0.000387591 -3.53864 63.546000 Cu 0.24167 0.745613 1.34676e-15 110 63.546 0.00605671 -3.5228 63.546000 Cu 0.161022 0.730636 0.5 112 63.546 0.00395428 -3.52515 63.546000 Cu 0.381359 0.7401 1.0837e-15 113 63.546 0.00197114 -3.53936 63.546000 Cu 0.402257 0.775062 1.56979e-15 114 63.546 0.000592828 -3.53843 63.546000 Cu 0.461542 0.754947 0.5 115 63.546 0.00304501 -3.5433 63.546000 Cu 0.321985 0.760334 0.5 116 63.546 0.00150275 -3.52948 63.546000 Cu 0.482531 0.78998 0.5 120 63.546 0.000631211 -3.54071 63.546000 Cu 0.10136 0.750228 1.10086e-15 132 63.546 0.000618546 -3.53434 63.546000 Cu 0.12228 0.785112 1.9234e-15 133 63.546 0.000362219 -3.53404 63.546000 Cu 0.18189 0.765362 0.5 134 63.546 0.00119456 -3.52787 63.546000 Cu 0.262417 0.780311 1.93007e-15 135 63.546 0.00152364 -3.52742 63.546000 Cu 0.283122 0.815067 2.03682e-15 136 63.546 0.00019912 -3.52972 63.546000 Cu 0.342849 0.795144 0.5 137 63.546 0.000658674 -3.53332 63.546000 Cu 0.202725 0.800124 0.5 138 63.546 0.000154563 -3.52989 63.546000 Cu 0.423059 0.810026 1.80521e-15 139 63.546 0.000181619 -3.53822 63.546000 Cu 0.0208353 0.734978 0.5 79 63.546 0.004642 -3.54348 63.546000 Cu 0.520835 0.734978 9.56935e-16 92 63.546 0.004642 -3.54348 63.546000 Cu 0.961542 0.754947 1.12754e-15 78 63.546 0.00304501 -3.5433 63.546000 Cu 0.881359 0.7401 0.5 80 63.546 0.00197114 -3.53936 63.546000 Cu 0.661022 0.730636 9.93153e-16 95 63.546 0.00395428 -3.52515 63.546000 Cu 0.68189 0.765362 1.57742e-15 96 63.546 0.00119456 -3.52787 63.546000 Cu 0.74167 0.745613 0.5 97 63.546 0.00605671 -3.5228 63.546000 Cu 0.60136 0.750228 0.5 98 63.546 0.000618546 -3.53434 63.546000 Cu 0.821985 0.760334 1.4335e-15 99 63.546 0.00150275 -3.52948 63.546000 Cu 0.842849 0.795144 2.03873e-15 100 63.546 0.000658674 -3.53332 63.546000 Cu 0.902257 0.775062 0.5 101 63.546 0.000592828 -3.53843 63.546000 Cu 0.762417 0.780311 0.5 102 63.546 0.00152364 -3.52742 63.546000 Cu 0.982531 0.78998 1.6794e-15 103 63.546 0.000631211 -3.54071 63.546000 Cu 0.923059 0.810026 0.5 106 63.546 0.000181619 -3.53822 63.546000 Cu 0.541852 0.769996 1.81379e-15 117 63.546 0.0016036 -3.53963 63.546000 Cu 0.56272 0.804988 2.28654e-15 118 63.546 0.000387591 -3.53864 63.546000 Cu 0.62228 0.785112 0.5 119 63.546 0.000362219 -3.53404 63.546000 Cu 0.702725 0.800124 1.91768e-15 121 63.546 0.000154563 -3.52989 63.546000 Cu 0.783122 0.815067 0.5 123 63.546 0.00019912 -3.52972 63.546000 Cu 0.0833909 0.839948 0.5 107 63.546 0.000166599 -3.53866 63.546000 Cu 0.0443254 0.895012 2.15215e-15 130 63.546 0.00341776 -3.5427 63.546000 Cu 0.443628 0.844982 2.15692e-15 140 63.546 0.000381654 -3.53917 63.546000 Cu 0.363452 0.829993 0.5 142 63.546 0.000339677 -3.53328 63.546000 Cu 0.143035 0.819974 2.39138e-15 158 63.546 0.000302849 -3.53405 63.546000 Cu 0.163549 0.854813 2.50766e-15 159 63.546 0.000543258 -3.53227 63.546000 Cu 0.223352 0.834901 0.5 160 63.546 0.000189883 -3.52906 63.546000 Cu 0.303638 0.849833 2.0292e-15 161 63.546 0.000178451 -3.52818 63.546000 Cu 0.324043 0.884581 2.38757e-15 162 63.546 0.00131128 -3.52758 63.546000 Cu 0.383904 0.864849 0.5 163 63.546 0.000354235 -3.53399 63.546000 Cu 0.243761 0.869643 0.5 164 63.546 0.00148245 -3.52619 63.546000 Cu 0.464159 0.879963 2.14643e-15 165 63.546 0.00173216 -3.54072 63.546000 Cu 0.404477 0.899715 0.5 168 63.546 0.000684586 -3.53471 63.546000 Cu 0.103863 0.874888 0.5 180 63.546 0.000553333 -3.53857 63.546000 Cu 0.183897 0.889611 2.39138e-15 181 63.546 0.00161145 -3.52939 63.546000 Cu 0.264082 0.904324 0.5 183 63.546 0.00611224 -3.52282 63.546000 Cu 0.003242 0.824985 1.78901e-15 104 63.546 2.15654e-05 -3.54035 63.546000 Cu 0.0237909 0.859982 3.11194e-15 129 63.546 0.000617136 -3.54235 63.546000 Cu 0.503242 0.824985 0.5 141 63.546 2.15654e-05 -3.54035 63.546000 Cu 0.523791 0.859982 0.5 146 63.546 0.000617136 -3.54235 63.546000 Cu 0.723352 0.834901 2.63824e-15 122 63.546 0.000189883 -3.52906 63.546000 Cu 0.643035 0.819974 0.5 124 63.546 0.000302849 -3.53405 63.546000 Cu 0.863452 0.829993 2.39329e-15 125 63.546 0.000339677 -3.53328 63.546000 Cu 0.883904 0.864849 2.63348e-15 126 63.546 0.000354235 -3.53399 63.546000 Cu 0.943628 0.844982 0.5 127 63.546 0.000381654 -3.53917 63.546000 Cu 0.803638 0.849833 0.5 128 63.546 0.000178451 -3.52818 63.546000 Cu 0.964159 0.879963 0.5 131 63.546 0.00173216 -3.54072 63.546000 Cu 0.583391 0.839948 2.04063e-15 143 63.546 0.000166599 -3.53866 63.546000 Cu 0.603863 0.874888 2.39806e-15 144 63.546 0.000553333 -3.53857 63.546000 Cu 0.663549 0.854813 0.5 145 63.546 0.000543258 -3.53227 63.546000 Cu 0.743761 0.869643 2.76024e-15 147 63.546 0.00148245 -3.52619 63.546000 Cu 0.764082 0.904324 2.03492e-15 148 63.546 0.00611224 -3.52282 63.546000 Cu 0.824043 0.884581 0.5 149 63.546 0.00131128 -3.52758 63.546000 Cu 0.683897 0.889611 0.5 150 63.546 0.00161145 -3.52939 63.546000 Cu 0.904477 0.899715 2.63348e-15 151 63.546 0.000684586 -3.53471 63.546000 Cu 0.544325 0.895012 0.5 167 63.546 0.00341776 -3.5427 63.546000 Cu 0.0647725 0.930117 1.19426e-15 155 63.546 0.0114261 -3.54812 63.546000 Cu 0.0849317 0.965409 1.92149e-15 156 63.546 0.0363047 -3.55783 63.546000 Cu 0.484781 0.914965 2.3952e-15 166 63.546 0.00489952 -3.54242 63.546000 Cu 0.204073 0.924357 1.91101e-15 182 63.546 0.00565358 -3.52467 63.546000 Cu 0.124264 0.909842 0.5 184 63.546 0.00199072 -3.53882 63.546000 Cu 0.344473 0.919294 2.02729e-15 185 63.546 0.00414089 -3.52608 63.546000 Cu 0.364528 0.953931 2.27606e-15 186 63.546 0.0109646 -3.51946 63.546000 Cu 0.424895 0.934602 0.5 187 63.546 0.00198115 -3.53582 63.546000 Cu 0.284136 0.938887 0.5 188 63.546 0.0212835 -3.51321 63.546000 Cu 0.445003 0.969519 0.5 192 63.546 0.00492293 -3.53459 63.546000 Cu 0.144357 0.94488 0.5 195 63.546 0.00807305 -3.54171 63.546000 Cu 0.223726 0.95899 2.39615e-15 196 63.546 0.0229422 -3.51065 63.546000 Cu 0.242778 0.993359 2.1512e-15 197 63.546 0.116572 -3.46812 63.546000 Cu 0.303774 0.973233 0.5 198 63.546 0.0708392 -3.49444 63.546000 Cu 0.163987 0.98011 0.5 199 63.546 0.0380128 -3.54528 63.546000 Cu 0.384334 0.988471 1.91006e-15 200 63.546 0.0245482 -3.5121 63.546000 Cu 0.00510061 0.950087 0.5 157 63.546 0.0139515 -3.54803 63.546000 Cu 0.0252708 0.985401 0.5 178 63.546 0.0369126 -3.55264 63.546000 Cu 0.505101 0.950087 2.04159e-15 189 63.546 0.0139515 -3.54803 63.546000 Cu 0.525271 0.985401 1.8014e-15 190 63.546 0.0369126 -3.55264 63.546000 Cu 0.924895 0.934602 2.27796e-15 152 63.546 0.00198115 -3.53582 63.546000 Cu 0.984781 0.914965 0.5 153 63.546 0.00489952 -3.54242 63.546000 Cu 0.844473 0.919294 0.5 154 63.546 0.00414089 -3.52608 63.546000 Cu 0.624264 0.909842 2.15882e-15 169 63.546 0.00199072 -3.53882 63.546000 Cu 0.644357 0.94488 2.04159e-15 170 63.546 0.00807305 -3.54171 63.546000 Cu 0.704073 0.924357 0.5 171 63.546 0.00565358 -3.52467 63.546000 Cu 0.564772 0.930117 0.5 172 63.546 0.0114261 -3.54812 63.546000 Cu 0.784136 0.938887 2.03778e-15 173 63.546 0.0212835 -3.51321 63.546000 Cu 0.803774 0.973233 2.04445e-15 174 63.546 0.0708392 -3.49444 63.546000 Cu 0.864528 0.953931 0.5 175 63.546 0.0109646 -3.51946 63.546000 Cu 0.723726 0.95899 0.5 176 63.546 0.0229422 -3.51065 63.546000 Cu 0.945003 0.969519 1.68417e-15 177 63.546 0.00492293 -3.53459 63.546000 Cu 0.884334 0.988471 0.5 179 63.546 0.0245482 -3.5121 63.546000 Cu 0.584932 0.965409 0.5 191 63.546 0.0363047 -3.55783 63.546000 Cu 0.663987 0.98011 1.44017e-15 193 63.546 0.0380128 -3.54528 63.546000 Cu 0.742778 0.993359 0.5 194 63.546 0.116572 -3.46812