Number of particles = 460 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.7542 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 75.2297 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.49168 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 0.0320721 0.0119075 2.06489e-17 235 63.546 1.63463 -3.23529 63.546000 Cu 0.119416 0.00648288 0.5 237 63.546 8.60144 -3.13648 63.546000 Cu 0.063618 0.0348034 0.5 241 63.546 0.0953334 -3.26531 63.546000 Cu 0.151905 0.0265601 2.28535e-17 243 63.546 0.222189 -3.2524 63.546000 Cu 0.236392 0.0189929 0.5 245 63.546 0.758309 -3.2077 63.546000 Cu 0.184954 0.0481006 0.5 246 63.546 0.0485619 -3.26978 63.546000 Cu 0.274097 0.0389011 0 244 63.546 0.0353583 -3.26573 63.546000 Cu 0.327365 0.00852104 0 247 63.546 1.58357 -3.2054 63.546000 Cu 0.445981 0.0196195 1.86306e-19 248 63.546 0.411113 -3.24243 63.546000 Cu 0.361631 0.0286153 0.5 250 63.546 0.332147 -3.25805 63.546000 Cu 0.394694 0.0506463 1 264 63.546 0.0377664 -3.27673 63.546000 Cu 0.479333 0.0422404 0.5 266 63.546 0.0142667 -3.2707 63.546000 Cu 0.619417 0.00648234 4.4597e-17 251 63.546 8.60142 -3.13647 63.546000 Cu 0.532073 0.011907 0.5 252 63.546 1.6347 -3.23529 63.546000 Cu 0.563619 0.0348023 3.1051e-19 268 63.546 0.0953215 -3.2653 63.546000 Cu 0.684957 0.0480995 5.43315e-17 269 63.546 0.0485215 -3.26977 63.546000 Cu 0.651907 0.0265593 0.5 270 63.546 0.222205 -3.2524 63.546000 Cu 0.736393 0.0189925 6.26454e-17 272 63.546 0.758239 -3.20769 63.546000 Cu 0.945981 0.01962 0.5 236 63.546 0.411111 -3.24242 63.546000 Cu 0.979332 0.0422416 1.57739e-17 239 63.546 0.0142579 -3.2707 63.546000 Cu 0.861632 0.0286156 0 273 63.546 0.332181 -3.25805 63.546000 Cu 0.827365 0.00852099 0.5 274 63.546 1.5836 -3.20541 63.546000 Cu 0.774099 0.0389009 0.5 275 63.546 0.035373 -3.26573 63.546000 Cu 0.894694 0.0506474 0.5 297 63.546 0.0377647 -3.27673 63.546000 Cu 0.0986853 0.056332 2.58577e-17 240 63.546 0.0169718 -3.27864 63.546000 Cu 0.0129714 0.0646139 0.5 242 63.546 0.0111233 -3.27373 63.546000 Cu 0.047378 0.086344 3.31935e-17 256 63.546 0.00601985 -3.27677 63.546000 Cu 0.168677 0.0990943 5.20881e-18 257 63.546 0.00106297 -3.27813 63.546000 Cu 0.133587 0.0778551 0.5 258 63.546 0.00999281 -3.2759 63.546000 Cu 0.0820092 0.107859 0.5 259 63.546 0.00279939 -3.27721 63.546000 Cu 0.22078 0.0689392 6.62939e-18 260 63.546 0.00528958 -3.27835 63.546000 Cu 0.341948 0.0812497 1.00916e-19 261 63.546 0.010767 -3.28042 63.546000 Cu 0.308289 0.0596463 0.5 262 63.546 0.0309355 -3.28153 63.546000 Cu 0.2555 0.0901237 0.5 263 63.546 0.00581923 -3.28012 63.546000 Cu 0.427763 0.0727357 0.5 267 63.546 0.0041949 -3.27793 63.546000 Cu 0.375704 0.103074 0.5 286 63.546 0.00146577 -3.27869 63.546000 Cu 0.461478 0.0946927 7.76275e-20 288 63.546 0.00186878 -3.27702 63.546000 Cu 0.512975 0.0646114 2.56171e-19 265 63.546 0.0111292 -3.27372 63.546000 Cu 0.598689 0.0563299 0.5 271 63.546 0.016939 -3.27863 63.546000 Cu 0.582026 0.107851 5.28876e-17 289 63.546 0.00275187 -3.27719 63.546000 Cu 0.547387 0.0863393 0.5 290 63.546 0.00599605 -3.27676 63.546000 Cu 0.633596 0.0778518 2.10759e-17 292 63.546 0.0099442 -3.27588 63.546000 Cu 0.720786 0.0689379 0.5 294 63.546 0.00529174 -3.27835 63.546000 Cu 0.668691 0.0990894 0.5 295 63.546 0.00105439 -3.27811 63.546000 Cu 0.927762 0.0727382 2.44915e-17 238 63.546 0.00417527 -3.27792 63.546000 Cu 0.961473 0.0946978 0.5 254 63.546 0.00185385 -3.27702 63.546000 Cu 0.755509 0.0901224 5.96179e-18 293 63.546 0.00586646 -3.28011 63.546000 Cu 0.808292 0.0596466 6.17682e-17 296 63.546 0.0309753 -3.28153 63.546000 Cu 0.841952 0.081251 0.5 298 63.546 0.010791 -3.28042 63.546000 Cu 0.875706 0.103078 1.08679e-19 321 63.546 0.00145673 -3.27868 63.546000 Cu 0.0648197 0.159446 2.60285e-17 277 63.546 0.000109896 -3.27836 63.546000 Cu 0.0302622 0.137959 0.5 278 63.546 0.000929221 -3.27786 63.546000 Cu 0.116728 0.129265 2.15727e-17 280 63.546 0.00029473 -3.27834 63.546000 Cu 0.237585 0.142001 1.90343e-17 281 63.546 0.000867808 -3.27902 63.546000 Cu 0.203272 0.120462 0.5 282 63.546 0.00118303 -3.2792 63.546000 Cu 0.151232 0.150725 0.5 283 63.546 0.000236447 -3.2788 63.546000 Cu 0.28967 0.111675 0 284 63.546 0.00313563 -3.2795 63.546000 Cu 0.409738 0.124857 8.22075e-18 285 63.546 0.000393099 -3.27789 63.546000 Cu 0.323748 0.133367 0.5 287 63.546 0.000568233 -3.27868 63.546000 Cu 0.49577 0.116396 0.5 291 63.546 0.00196922 -3.27748 63.546000 Cu 0.271829 0.163621 0.5 307 63.546 0.000218294 -3.27858 63.546000 Cu 0.357941 0.155052 7.76275e-20 309 63.546 0.000107219 -3.27819 63.546000 Cu 0.444048 0.146518 0.5 311 63.546 0.000600561 -3.27786 63.546000 Cu 0.53029 0.137943 3.46995e-18 313 63.546 0.000867374 -3.27784 63.546000 Cu 0.651274 0.150714 4.15074e-17 314 63.546 0.000277332 -3.27878 63.546000 Cu 0.616756 0.129254 0.5 315 63.546 0.000283549 -3.27832 63.546000 Cu 0.564868 0.159426 0.5 316 63.546 9.00244e-05 -3.27834 63.546000 Cu 0.703294 0.120457 4.80514e-17 317 63.546 0.00123969 -3.27918 63.546000 Cu 0.737612 0.141999 0.5 320 63.546 0.00091405 -3.27901 63.546000 Cu 0.995756 0.116406 2.63157e-18 253 63.546 0.00199994 -3.2775 63.546000 Cu 0.909734 0.124866 0.5 255 63.546 0.000379444 -3.27789 63.546000 Cu 0.944031 0.146535 1.08679e-19 276 63.546 0.000624292 -3.27787 63.546000 Cu 0.823759 0.133372 6.98648e-20 318 63.546 0.000562137 -3.27867 63.546000 Cu 0.789681 0.111675 0.5 319 63.546 0.00317773 -3.27948 63.546000 Cu 0.771851 0.163627 4.48687e-18 342 63.546 0.000215987 -3.27856 63.546000 Cu 0.85794 0.155066 0.5 344 63.546 9.32226e-05 -3.27819 63.546000 Cu 0.0129768 0.189633 0 301 63.546 6.0622e-05 -3.27841 63.546000 Cu 0.133747 0.202487 6.56962e-17 302 63.546 6.43274e-05 -3.27856 63.546000 Cu 0.0993055 0.180951 0.5 303 63.546 3.42329e-05 -3.27862 63.546000 Cu 0.0474515 0.21116 0.5 304 63.546 1.35704e-06 -3.27854 63.546000 Cu 0.185617 0.172262 1.46095e-17 305 63.546 0.000241827 -3.27874 63.546000 Cu 0.219982 0.193841 0.5 308 63.546 9.37881e-05 -3.27848 63.546000 Cu 0.306148 0.185242 1.24204e-19 306 63.546 3.17283e-05 -3.27827 63.546000 Cu 0.478531 0.168078 0 310 63.546 0.000264004 -3.27806 63.546000 Cu 0.392306 0.176671 0.5 312 63.546 0.000162834 -3.27808 63.546000 Cu 0.254393 0.215426 1.63484e-17 330 63.546 1.65762e-05 -3.27832 63.546000 Cu 0.34057 0.206833 0.5 332 63.546 3.09557e-05 -3.27823 63.546000 Cu 0.426779 0.198233 4.55441e-17 334 63.546 8.32618e-05 -3.27823 63.546000 Cu 0.461288 0.219775 0.5 337 63.546 2.01785e-05 -3.27837 63.546000 Cu 0.547558 0.211127 1.0371e-17 335 63.546 1.51501e-05 -3.27848 63.546000 Cu 0.513055 0.189599 0.5 336 63.546 3.34092e-05 -3.27837 63.546000 Cu 0.599374 0.18093 0 338 63.546 6.59228e-05 -3.27858 63.546000 Cu 0.720017 0.193849 4.45892e-17 339 63.546 9.88738e-05 -3.27846 63.546000 Cu 0.685665 0.172255 0.5 340 63.546 0.000290302 -3.27871 63.546000 Cu 0.633821 0.202474 0.5 341 63.546 0.000112094 -3.27853 63.546000 Cu 0.978488 0.168104 0.5 279 63.546 0.00031431 -3.27808 63.546000 Cu 0.961162 0.219829 5.36406e-17 299 63.546 6.96143e-05 -3.27846 63.546000 Cu 0.926706 0.198274 0.5 300 63.546 0.000135076 -3.27826 63.546000 Cu 0.892278 0.176697 8.03755e-17 343 63.546 0.000180249 -3.27809 63.546000 Cu 0.806149 0.185263 0.5 345 63.546 1.68008e-05 -3.27827 63.546000 Cu 0.754384 0.21546 0.5 365 63.546 4.87803e-06 -3.27833 63.546000 Cu 0.840521 0.206876 1.36624e-17 367 63.546 5.02124e-05 -3.27825 63.546000 Cu 0.0301636 0.262892 8.94269e-18 323 63.546 2.17924e-05 -3.2784 63.546000 Cu 0.0819343 0.232692 7.76275e-21 326 63.546 2.45127e-05 -3.27852 63.546000 Cu 0.202677 0.245606 1.36935e-17 327 63.546 2.83036e-05 -3.27829 63.546000 Cu 0.168192 0.224041 0.5 328 63.546 6.12961e-05 -3.27844 63.546000 Cu 0.116447 0.254231 0.5 329 63.546 6.24988e-05 -3.27833 63.546000 Cu 0.150971 0.275779 7.51434e-18 351 63.546 0.00010372 -3.27818 63.546000 Cu 0.237156 0.267178 0.5 353 63.546 9.15367e-06 -3.27831 63.546000 Cu 0.375057 0.2284 1.31967e-19 331 63.546 3.41922e-05 -3.2783 63.546000 Cu 0.288865 0.237004 0.5 333 63.546 2.36483e-06 -3.27828 63.546000 Cu 0.323337 0.258575 4.87734e-17 355 63.546 2.23026e-05 -3.2784 63.546000 Cu 0.444066 0.271497 4.74304e-17 356 63.546 2.40337e-06 -3.2785 63.546000 Cu 0.409556 0.24995 0.5 357 63.546 1.57367e-05 -3.27846 63.546000 Cu 0.495804 0.24131 7.31562e-17 359 63.546 6.2556e-06 -3.27845 63.546000 Cu 0.616511 0.254247 3.67411e-17 360 63.546 8.67972e-05 -3.27837 63.546000 Cu 0.582044 0.232671 0.5 361 63.546 7.36275e-05 -3.27845 63.546000 Cu 0.530316 0.262859 0.5 362 63.546 6.45213e-05 -3.27839 63.546000 Cu 0.66824 0.224053 0 363 63.546 7.59105e-05 -3.27841 63.546000 Cu 0.702654 0.245658 0.5 366 63.546 1.50846e-05 -3.27837 63.546000 Cu 0.650933 0.275853 0.5 386 63.546 4.59739e-05 -3.27822 63.546000 Cu 0.737037 0.267281 0 388 63.546 2.39125e-05 -3.27837 63.546000 Cu 0.909369 0.25004 5.51388e-17 322 63.546 0.000119317 -3.27856 63.546000 Cu 0.99564 0.241367 0.5 324 63.546 1.56805e-05 -3.27855 63.546000 Cu 0.943848 0.271582 0.5 325 63.546 8.00521e-05 -3.2785 63.546000 Cu 0.788778 0.237072 1.23971e-17 364 63.546 2.20386e-05 -3.27837 63.546000 Cu 0.874937 0.228467 0.5 368 63.546 9.62209e-05 -3.2784 63.546000 Cu 0.823168 0.258681 0.5 390 63.546 0.000124815 -3.2785 63.546000 Cu 0.0993791 0.305948 2.08275e-17 348 63.546 0.000308461 -3.27808 63.546000 Cu 0.0647461 0.284405 0.5 349 63.546 0.000167766 -3.27816 63.546000 Cu 0.0131635 0.314569 0.5 350 63.546 0.000423648 -3.27801 63.546000 Cu 0.18549 0.297366 0.5 354 63.546 3.6367e-05 -3.27829 63.546000 Cu 0.13396 0.327564 0.5 374 63.546 0.000143542 -3.27824 63.546000 Cu 0.219986 0.31899 9.3153e-20 376 63.546 0.000142521 -3.27862 63.546000 Cu 0.271624 0.288771 0 352 63.546 4.82102e-05 -3.2785 63.546000 Cu 0.357811 0.280144 0.5 358 63.546 5.71433e-05 -3.27855 63.546000 Cu 0.340692 0.331912 1.55255e-20 377 63.546 0.000206316 -3.27873 63.546000 Cu 0.306107 0.310361 0.5 378 63.546 0.000195041 -3.27871 63.546000 Cu 0.392327 0.30169 5.92375e-17 380 63.546 3.73354e-05 -3.27856 63.546000 Cu 0.478592 0.293035 0.5 382 63.546 0.000102164 -3.27833 63.546000 Cu 0.426962 0.323214 0.5 383 63.546 0.000186043 -3.27824 63.546000 Cu 0.513168 0.314589 2.05635e-17 381 63.546 0.000408325 -3.27796 63.546000 Cu 0.564799 0.284425 0 384 63.546 0.000162816 -3.27817 63.546000 Cu 0.685303 0.297489 3.54292e-17 385 63.546 4.03495e-05 -3.27823 63.546000 Cu 0.59926 0.306031 0.5 387 63.546 0.000173895 -3.27799 63.546000 Cu 0.633692 0.327701 0 408 63.546 0.000132818 -3.27825 63.546000 Cu 0.719667 0.319152 0.5 410 63.546 0.000515963 -3.27867 63.546000 Cu 0.92683 0.323265 7.15726e-17 346 63.546 0.000152998 -3.27827 63.546000 Cu 0.978435 0.293081 3.45287e-17 347 63.546 5.77758e-05 -3.27831 63.546000 Cu 0.85757 0.280268 2.05325e-17 389 63.546 0.000286858 -3.27859 63.546000 Cu 0.771385 0.288909 0.5 391 63.546 0.00024682 -3.2785 63.546000 Cu 0.805784 0.31051 3.8511e-17 412 63.546 0.000725961 -3.2788 63.546000 Cu 0.892088 0.301796 0.5 413 63.546 0.00020287 -3.27861 63.546000 Cu 0.840419 0.332031 0.5 414 63.546 0.000611162 -3.27882 63.546000 Cu 0.0479347 0.336109 0 372 63.546 0.000895629 -3.27792 63.546000 Cu 0.168449 0.349253 2.67039e-17 373 63.546 0.000467775 -3.27866 63.546000 Cu 0.0826188 0.357778 0.5 375 63.546 0.000375659 -3.27811 63.546000 Cu 0.0315044 0.38799 0.5 394 63.546 0.0011037 -3.27734 63.546000 Cu 0.117095 0.379562 1 396 63.546 0.00117418 -3.27878 63.546000 Cu 0.202949 0.370947 0.5 398 63.546 0.00252535 -3.2794 63.546000 Cu 0.254476 0.340624 0.5 379 63.546 0.000789445 -3.27901 63.546000 Cu 0.289129 0.362175 5.9385e-17 400 63.546 0.00101863 -3.2793 63.546000 Cu 0.410612 0.374843 1 401 63.546 0.00361955 -3.27723 63.546000 Cu 0.375494 0.353392 0.5 402 63.546 0.000502075 -3.2784 63.546000 Cu 0.32417 0.383576 0.5 403 63.546 0.00122126 -3.27828 63.546000 Cu 0.461741 0.344735 3.97453e-18 404 63.546 0.00124127 -3.27781 63.546000 Cu 0.496631 0.366357 0.5 407 63.546 0.001949 -3.27758 63.546000 Cu 0.582383 0.357937 1 405 63.546 0.000256167 -3.27804 63.546000 Cu 0.547778 0.3362 0.5 406 63.546 0.000700129 -3.27786 63.546000 Cu 0.668129 0.349444 0.5 411 63.546 0.00128669 -3.27885 63.546000 Cu 0.531271 0.388138 7.76275e-21 429 63.546 0.00136739 -3.27704 63.546000 Cu 0.616808 0.379774 0.5 431 63.546 0.002719 -3.2787 63.546000 Cu 0.702689 0.371144 4.65765e-20 433 63.546 0.00467901 -3.27947 63.546000 Cu 0.996737 0.366258 1.11473e-17 369 63.546 0.00220129 -3.27762 63.546000 Cu 0.961776 0.34471 0.5 370 63.546 0.00134582 -3.27768 63.546000 Cu 0.910713 0.374807 0.5 371 63.546 0.00442775 -3.27715 63.546000 Cu 0.754134 0.340795 7.76275e-20 409 63.546 0.00188658 -3.27913 63.546000 Cu 0.824157 0.383612 4.01334e-17 434 63.546 0.00137329 -3.27814 63.546000 Cu 0.788905 0.362303 0.5 435 63.546 0.00178599 -3.27911 63.546000 Cu 0.875384 0.353439 0 437 63.546 0.000520071 -3.27817 63.546000 Cu 0.0658091 0.409922 9.91303e-18 393 63.546 0.0032252 -3.27818 63.546000 Cu 0.237637 0.392518 8.53903e-20 397 63.546 0.00498501 -3.2802 63.546000 Cu 0.151493 0.401363 0.5 399 63.546 0.00780983 -3.28017 63.546000 Cu 0.0147877 0.440417 3.33798e-19 417 63.546 0.0116217 -3.27048 63.546000 Cu 0.0995095 0.431896 0.5 419 63.546 0.0256871 -3.27589 63.546000 Cu 0.18577 0.423 7.46466e-17 421 63.546 0.0290144 -3.28228 63.546000 Cu 0.220108 0.443802 0.5 424 63.546 0.0466107 -3.26362 63.546000 Cu 0.309344 0.434586 3.24095e-17 422 63.546 0.0693803 -3.2669 63.546000 Cu 0.272823 0.413741 0.5 423 63.546 0.00625775 -3.27882 63.546000 Cu 0.359745 0.404848 3.1051e-20 425 63.546 0.013495 -3.27529 63.546000 Cu 0.480273 0.418285 1.00916e-19 426 63.546 0.0076438 -3.27374 63.546000 Cu 0.445616 0.396442 0.5 427 63.546 0.00607217 -3.27675 63.546000 Cu 0.395053 0.426507 0.5 428 63.546 0.0168036 -3.27807 63.546000 Cu 0.650987 0.401581 4.82843e-17 430 63.546 0.0129654 -3.28041 63.546000 Cu 0.565281 0.410146 0.5 432 63.546 0.00561591 -3.27817 63.546000 Cu 0.737429 0.392645 0.5 436 63.546 0.00611392 -3.28023 63.546000 Cu 0.514327 0.440726 0.5 449 63.546 0.0168153 -3.26973 63.546000 Cu 0.598904 0.432179 2.14951e-17 451 63.546 0.036952 -3.27613 63.546000 Cu 0.719814 0.443836 9.12434e-17 452 63.546 0.0485912 -3.26323 63.546000 Cu 0.685225 0.423155 0.5 453 63.546 0.0342693 -3.28191 63.546000 Cu 0.945863 0.396371 8.61044e-17 392 63.546 0.00537545 -3.27707 63.546000 Cu 0.980584 0.418128 0.5 395 63.546 0.0065418 -3.27432 63.546000 Cu 0.772653 0.413772 1.80251e-17 455 63.546 0.00699694 -3.27841 63.546000 Cu 0.89501 0.426427 4.7671e-17 456 63.546 0.014042 -3.27825 63.546000 Cu 0.859843 0.404822 0.5 457 63.546 0.0145073 -3.27533 63.546000 Cu 0.809184 0.434526 0.5 458 63.546 0.0739095 -3.26687 63.546000 Cu 0.133163 0.454048 7.71307e-17 418 63.546 0.418678 -3.25367 63.546000 Cu 0.0491612 0.462733 0.5 420 63.546 0.555485 -3.22725 63.546000 Cu 0.0859745 0.491388 2.8435e-17 440 63.546 9.31998 -3.28322 63.546000 Cu 0.215461 0.491168 8.5856e-17 441 63.546 9.82961 -3.02657 63.546000 Cu 0.167187 0.47446 0.5 442 63.546 2.20042 -3.21108 63.546000 Cu 0.258345 0.463477 3.85731e-17 443 63.546 1.20865 -3.18517 63.546000 Cu 0.374742 0.476523 1 444 63.546 8.63118 -3.13718 63.546000 Cu 0.34272 0.456352 0.5 445 63.546 0.319825 -3.2489 63.546000 Cu 0.303238 0.491786 0.5 446 63.546 7.54781 -3.2878 63.546000 Cu 0.430433 0.448194 1 447 63.546 0.0833654 -3.264 63.546000 Cu 0.462644 0.471294 0.5 450 63.546 1.99892 -3.23709 63.546000 Cu 0.494654 0.491418 4.97127e-17 459 63.546 9.88442 -3.1275 63.546000 Cu 0.715371 0.491194 0.5 222 63.546 9.91488 -3.02611 63.546000 Cu 0.667465 0.474503 3.77347e-16 233 63.546 2.13245 -3.20904 63.546000 Cu 0.548853 0.463086 3.92329e-17 448 63.546 0.540691 -3.22875 63.546000 Cu 0.632901 0.454256 0.5 454 63.546 0.41887 -3.25371 63.546000 Cu 0.585802 0.491515 0.5 460 63.546 9.40437 -3.28416 63.546000 Cu 0.875193 0.476353 0.5 1 63.546 8.61071 -3.13673 63.546000 Cu 0.842668 0.456266 1 18 63.546 0.313706 -3.24896 63.546000 Cu 0.75839 0.463473 0.5 229 63.546 1.17314 -3.18802 63.546000 Cu 0.803221 0.491605 7.81554e-17 232 63.546 7.60429 -3.28831 63.546000 Cu 0.96304 0.470966 2.32883e-19 415 63.546 1.97451 -3.23657 63.546000 Cu 0.930449 0.448005 0.5 416 63.546 0.0743557 -3.26451 63.546000 Cu 0.994887 0.491104 0.5 439 63.546 9.97883 -3.12868 63.546000 Cu 0.0516693 0.519391 0.5 3 63.546 0.483861 -3.23516 63.546000 Cu 0.0182364 0.54192 2.71696e-19 15 63.546 0.0134267 -3.26988 63.546000 Cu 0.136023 0.528244 1 19 63.546 0.38544 -3.25504 63.546000 Cu 0.169981 0.508067 0.5 20 63.546 1.82736 -3.20561 63.546000 Cu 0.223407 0.538581 0.5 24 63.546 0.0405426 -3.26457 63.546000 Cu 0.102972 0.550324 0.5 41 63.546 0.0384736 -3.27613 63.546000 Cu 0.378483 0.506411 9.22059e-17 4 63.546 8.59561 -3.1357 63.546000 Cu 0.466086 0.511861 0.5 6 63.546 1.77365 -3.23486 63.546000 Cu 0.261302 0.518792 9.09018e-18 21 63.546 0.839335 -3.20269 63.546000 Cu 0.312804 0.547873 1 22 63.546 0.0477144 -3.26901 63.546000 Cu 0.345863 0.526382 0.5 23 63.546 0.250227 -3.25097 63.546000 Cu 0.434462 0.53471 7.78681e-17 25 63.546 0.099238 -3.26554 63.546000 Cu 0.552163 0.519624 0 5 63.546 0.489497 -3.23424 63.546000 Cu 0.67009 0.508132 3.77029e-16 7 63.546 1.83953 -3.20641 63.546000 Cu 0.723517 0.538672 1.01149e-17 8 63.546 0.0401968 -3.26497 63.546000 Cu 0.636218 0.528431 0.5 10 63.546 0.38729 -3.25484 63.546000 Cu 0.518883 0.542212 0.5 27 63.546 0.0116712 -3.27005 63.546000 Cu 0.603561 0.550587 3.67954e-18 29 63.546 0.0309511 -3.27539 63.546000 Cu 0.878153 0.506231 0.5 2 63.546 8.59535 -3.13527 63.546000 Cu 0.761203 0.518799 0.5 9 63.546 0.859872 -3.2017 63.546000 Cu 0.84569 0.526297 3.83946e-17 11 63.546 0.256874 -3.25126 63.546000 Cu 0.934045 0.534497 0.5 13 63.546 0.0946656 -3.26444 63.546000 Cu 0.812795 0.547876 0.5 14 63.546 0.0503643 -3.26919 63.546000 Cu 0.965592 0.511511 4.5024e-19 438 63.546 1.78198 -3.23529 63.546000 Cu 0.0700602 0.572412 1 16 63.546 0.00494953 -3.2777 63.546000 Cu 0.0367573 0.594403 0.5 39 63.546 0.00164487 -3.2771 63.546000 Cu 0.189443 0.559339 0 42 63.546 0.0322829 -3.28137 63.546000 Cu 0.242763 0.589814 5.43393e-20 43 63.546 0.00611296 -3.27991 63.546000 Cu 0.156034 0.580925 0.5 45 63.546 0.0120209 -3.28037 63.546000 Cu 0.122715 0.602763 3.57087e-19 64 63.546 0.00195267 -3.27881 63.546000 Cu 0.485425 0.564524 7.99796e-17 26 63.546 0.0140728 -3.27415 63.546000 Cu 0.399386 0.556143 0.5 28 63.546 0.0162849 -3.27887 63.546000 Cu 0.277151 0.568634 0.5 44 63.546 0.00579825 -3.27796 63.546000 Cu 0.364581 0.577574 6.98648e-20 46 63.546 0.00719991 -3.2758 63.546000 Cu 0.416606 0.607623 3.1051e-20 47 63.546 0.00195565 -3.27725 63.546000 Cu 0.451122 0.586169 0.5 48 63.546 0.0061203 -3.27717 63.546000 Cu 0.329728 0.598781 0.5 49 63.546 0.000947074 -3.27801 63.546000 Cu 0.656622 0.581144 1 30 63.546 0.00961318 -3.28012 63.546000 Cu 0.689804 0.559477 0.5 31 63.546 0.0336 -3.28102 63.546000 Cu 0.570815 0.572692 0.5 32 63.546 0.00260997 -3.27767 63.546000 Cu 0.742926 0.589956 0.5 36 63.546 0.00682866 -3.28029 63.546000 Cu 0.537169 0.594629 0 50 63.546 0.00301205 -3.27741 63.546000 Cu 0.623062 0.603043 0.5 52 63.546 0.000550581 -3.27873 63.546000 Cu 0.899069 0.556049 2.87222e-19 12 63.546 0.0160648 -3.27853 63.546000 Cu 0.984854 0.564311 0.5 17 63.546 0.0103042 -3.27367 63.546000 Cu 0.777399 0.568722 1.63018e-19 33 63.546 0.00538905 -3.27827 63.546000 Cu 0.829735 0.598894 1 34 63.546 0.00105045 -3.27819 63.546000 Cu 0.864579 0.577615 0.5 35 63.546 0.010105 -3.27581 63.546000 Cu 0.950777 0.586085 1 37 63.546 0.00631844 -3.27693 63.546000 Cu 0.91648 0.607631 0.5 40 63.546 0.00276574 -3.27722 63.546000 Cu 0.00300663 0.616154 1 38 63.546 0.00251545 -3.27749 63.546000 Cu 0.0552324 0.646285 3.1051e-20 62 63.546 0.000533068 -3.27768 63.546000 Cu 0.175279 0.633098 9.3153e-20 65 63.546 0.000597734 -3.27868 63.546000 Cu 0.208952 0.611373 0.5 66 63.546 0.00334924 -3.27934 63.546000 Cu 0.089152 0.624585 0.5 67 63.546 0.000462861 -3.27779 63.546000 Cu 0.141457 0.654825 0.5 89 63.546 0.000147503 -3.27814 63.546000 Cu 0.227676 0.663392 8.53903e-20 90 63.546 0.000296089 -3.27843 63.546000 Cu 0.295489 0.620161 3.1051e-20 68 63.546 0.00176166 -3.27899 63.546000 Cu 0.348083 0.650471 6.98648e-20 69 63.546 0.000458823 -3.27873 63.546000 Cu 0.382202 0.628995 0.5 70 63.546 0.000242733 -3.27819 63.546000 Cu 0.261553 0.64174 0.5 71 63.546 0.0010081 -3.27892 63.546000 Cu 0.468876 0.637769 4.29435e-17 72 63.546 0.000545353 -3.27765 63.546000 Cu 0.434674 0.65923 0.5 75 63.546 8.59294e-05 -3.27842 63.546000 Cu 0.589282 0.62483 1.3973e-19 51 63.546 0.00117453 -3.27753 63.546000 Cu 0.503026 0.616285 0.5 53 63.546 0.00242986 -3.27738 63.546000 Cu 0.708996 0.611588 1.08679e-19 54 63.546 0.00307122 -3.27939 63.546000 Cu 0.675483 0.633333 0.5 57 63.546 0.000198001 -3.27822 63.546000 Cu 0.555419 0.64643 0.5 74 63.546 0.000926468 -3.27767 63.546000 Cu 0.641773 0.655011 2.32883e-20 76 63.546 0.0005029 -3.27798 63.546000 Cu 0.728023 0.663582 0.5 78 63.546 0.000218456 -3.27848 63.546000 Cu 0.761825 0.641911 3.1051e-20 55 63.546 0.000552659 -3.27883 63.546000 Cu 0.795521 0.620303 0.5 56 63.546 0.00172647 -3.2791 63.546000 Cu 0.882214 0.629049 9.88198e-18 58 63.546 0.000329076 -3.27816 63.546000 Cu 0.934709 0.65925 3.1051e-20 59 63.546 0.000109802 -3.2784 63.546000 Cu 0.968904 0.637718 0.5 60 63.546 0.000790237 -3.27769 63.546000 Cu 0.848252 0.650571 0.5 61 63.546 0.000386916 -3.27878 63.546000 Cu 0.0210938 0.667891 0.5 63 63.546 0.000142265 -3.27806 63.546000 Cu 0.0388151 0.719726 1.55255e-20 85 63.546 5.24782e-05 -3.27847 63.546000 Cu 0.0731434 0.698103 0.5 86 63.546 6.05725e-05 -3.27835 63.546000 Cu 0.107389 0.676481 6.2102e-20 88 63.546 0.000119493 -3.27806 63.546000 Cu 0.193598 0.685049 0.5 93 63.546 6.28041e-05 -3.27822 63.546000 Cu 0.159337 0.706694 2.0843e-17 111 63.546 2.47404e-05 -3.27829 63.546000 Cu 0.24548 0.71528 0.5 113 63.546 4.76596e-05 -3.27831 63.546000 Cu 0.279786 0.693642 0 91 63.546 0.000197778 -3.27838 63.546000 Cu 0.313997 0.672028 0.5 92 63.546 0.000477442 -3.27857 63.546000 Cu 0.400372 0.680732 6.12481e-17 94 63.546 0.000225507 -3.27855 63.546000 Cu 0.452307 0.710997 6.4097e-17 95 63.546 5.97961e-05 -3.27857 63.546000 Cu 0.486781 0.689465 0.5 96 63.546 4.37971e-05 -3.27847 63.546000 Cu 0.366007 0.70229 0.5 97 63.546 0.000253763 -3.2785 63.546000 Cu 0.521214 0.667961 2.76199e-17 73 63.546 0.000384901 -3.27827 63.546000 Cu 0.693862 0.68523 0 77 63.546 0.000176377 -3.27825 63.546000 Cu 0.607595 0.676619 0.5 79 63.546 0.000416533 -3.27818 63.546000 Cu 0.573157 0.698171 0 98 63.546 0.000130636 -3.27831 63.546000 Cu 0.659459 0.706826 0.5 100 63.546 0.000103217 -3.27824 63.546000 Cu 0.538645 0.719716 0.5 101 63.546 2.32129e-05 -3.2785 63.546000 Cu 0.7457 0.715445 1.21565e-17 102 63.546 1.92975e-05 -3.27828 63.546000 Cu 0.814269 0.672196 1.47337e-17 80 63.546 0.000145295 -3.27875 63.546000 Cu 0.866323 0.702457 0 81 63.546 4.34265e-05 -3.27853 63.546000 Cu 0.900567 0.680841 0.5 82 63.546 5.96089e-05 -3.27871 63.546000 Cu 0.78008 0.693834 0.5 83 63.546 6.3825e-05 -3.27841 63.546000 Cu 0.986877 0.689485 3.32401e-17 84 63.546 4.14687e-05 -3.27852 63.546000 Cu 0.952579 0.711094 0.5 87 63.546 3.14745e-05 -3.27855 63.546000 Cu 0.00440208 0.741331 0.5 108 63.546 2.44534e-05 -3.27849 63.546000 Cu 0.0561543 0.771575 0.5 110 63.546 5.15483e-05 -3.2785 63.546000 Cu 0.211125 0.736935 0 112 63.546 2.18762e-06 -3.27833 63.546000 Cu 0.124994 0.728337 0.5 114 63.546 3.71806e-05 -3.27838 63.546000 Cu 0.0906114 0.749967 2.28302e-17 134 63.546 6.36931e-05 -3.27851 63.546000 Cu 0.17677 0.758587 0.5 136 63.546 3.92237e-05 -3.27846 63.546000 Cu 0.331627 0.723895 3.87672e-17 115 63.546 0.000175208 -3.27843 63.546000 Cu 0.383411 0.754167 8.45985e-17 116 63.546 0.000139074 -3.27841 63.546000 Cu 0.417847 0.732562 0.5 117 63.546 0.000142616 -3.27855 63.546000 Cu 0.297244 0.745535 0.5 118 63.546 5.67072e-05 -3.27834 63.546000 Cu 0.469661 0.762839 0.5 122 63.546 7.49614e-05 -3.27849 63.546000 Cu 0.262893 0.767191 1.55255e-20 137 63.546 2.91662e-06 -3.27839 63.546000 Cu 0.349024 0.775796 0.5 139 63.546 9.11211e-05 -3.27832 63.546000 Cu 0.624962 0.728404 1 99 63.546 7.79477e-05 -3.27841 63.546000 Cu 0.711229 0.737048 0.5 105 63.546 3.36963e-05 -3.27834 63.546000 Cu 0.504144 0.741267 3.50721e-17 119 63.546 1.58409e-05 -3.27859 63.546000 Cu 0.555979 0.771541 4.49386e-17 120 63.546 4.34438e-06 -3.27856 63.546000 Cu 0.59047 0.749972 0.5 121 63.546 3.31072e-05 -3.27857 63.546000 Cu 0.676758 0.758645 0 123 63.546 6.10855e-05 -3.27849 63.546000 Cu 0.797451 0.745668 3.1051e-20 103 63.546 6.34025e-07 -3.27833 63.546000 Cu 0.831928 0.724061 0.5 104 63.546 1.36933e-05 -3.27838 63.546000 Cu 0.918165 0.732691 8.57008e-18 106 63.546 1.17931e-05 -3.27845 63.546000 Cu 0.969904 0.762923 3.31237e-17 107 63.546 7.49263e-06 -3.2784 63.546000 Cu 0.88367 0.754288 0.5 109 63.546 1.18665e-05 -3.27834 63.546000 Cu 0.762985 0.767279 0.5 125 63.546 1.45677e-05 -3.27839 63.546000 Cu 0.849178 0.775889 4.38984e-17 127 63.546 2.33802e-05 -3.27828 63.546000 Cu 0.0216325 0.793143 2.28924e-17 131 63.546 2.79555e-05 -3.27835 63.546000 Cu 0.0733483 0.823359 4.65765e-20 132 63.546 9.05652e-05 -3.27833 63.546000 Cu 0.142377 0.780228 1.08679e-19 135 63.546 0.000142285 -3.27855 63.546000 Cu 0.228541 0.788858 0.5 140 63.546 8.74728e-05 -3.2785 63.546000 Cu 0.10792 0.801817 0.5 157 63.546 9.25456e-05 -3.27857 63.546000 Cu 0.194174 0.810495 0 158 63.546 0.000285526 -3.27868 63.546000 Cu 0.159705 0.832077 0.5 161 63.546 0.000347224 -3.27876 63.546000 Cu 0.314653 0.797458 3.60192e-17 138 63.546 7.41784e-06 -3.27833 63.546000 Cu 0.435209 0.784425 9.6491e-18 141 63.546 0.000187229 -3.27832 63.546000 Cu 0.486951 0.814661 0 142 63.546 0.000319095 -3.27814 63.546000 Cu 0.400763 0.806048 0.5 144 63.546 0.000164879 -3.27817 63.546000 Cu 0.280316 0.819131 0.5 160 63.546 0.000160222 -3.27853 63.546000 Cu 0.366369 0.82771 4.52801e-17 162 63.546 7.44645e-05 -3.27819 63.546000 Cu 0.728543 0.788901 1.14501e-17 124 63.546 0.000106652 -3.27849 63.546000 Cu 0.642292 0.78024 0.5 126 63.546 9.4995e-05 -3.27858 63.546000 Cu 0.521487 0.793096 0.5 143 63.546 7.36911e-05 -3.27843 63.546000 Cu 0.607824 0.801802 0 145 63.546 3.2821e-05 -3.27861 63.546000 Cu 0.659659 0.832071 1 146 63.546 0.00026782 -3.2788 63.546000 Cu 0.694133 0.810505 0.5 147 63.546 0.000236371 -3.27869 63.546000 Cu 0.573273 0.823337 0.5 148 63.546 0.000109083 -3.27839 63.546000 Cu 0.900854 0.806102 6.2102e-20 128 63.546 0.000101693 -3.27808 63.546000 Cu 0.93538 0.784502 0.5 129 63.546 6.49886e-05 -3.27823 63.546000 Cu 0.814714 0.797515 0.5 130 63.546 2.23153e-05 -3.27828 63.546000 Cu 0.987045 0.814702 0.5 133 63.546 0.00021382 -3.27805 63.546000 Cu 0.780322 0.819156 6.98648e-20 149 63.546 0.000181734 -3.27851 63.546000 Cu 0.866403 0.82774 0.5 151 63.546 9.05808e-05 -3.27815 63.546000 Cu 0.0039661 0.866446 0 154 63.546 0.00166797 -3.27752 63.546000 Cu 0.0386618 0.844867 0.5 155 63.546 0.000845608 -3.27779 63.546000 Cu 0.245977 0.840794 0 159 63.546 0.000889907 -3.27893 63.546000 Cu 0.125058 0.853561 1.58826e-17 180 63.546 0.000319272 -3.27831 63.546000 Cu 0.176713 0.883763 0 181 63.546 0.00122753 -3.27824 63.546000 Cu 0.21153 0.862364 0.5 182 63.546 0.00131346 -3.27917 63.546000 Cu 0.0901328 0.874988 0.5 183 63.546 0.00296466 -3.2771 63.546000 Cu 0.41798 0.857954 3.8379e-17 163 63.546 0.00030971 -3.27795 63.546000 Cu 0.452431 0.83626 0.5 164 63.546 0.000564152 -3.27791 63.546000 Cu 0.332063 0.849428 0.5 165 63.546 0.00047453 -3.27858 63.546000 Cu 0.297798 0.871144 0 184 63.546 0.00278633 -3.27929 63.546000 Cu 0.383734 0.879754 0.5 186 63.546 0.00118805 -3.27867 63.546000 Cu 0.469444 0.888164 1.00916e-19 188 63.546 0.001423 -3.27724 63.546000 Cu 0.74596 0.8408 0.5 152 63.546 0.000843687 -3.27895 63.546000 Cu 0.538616 0.844849 3.88138e-20 166 63.546 0.000941112 -3.27784 63.546000 Cu 0.590112 0.87498 3.88138e-20 167 63.546 0.00303922 -3.27713 63.546000 Cu 0.625022 0.853551 0.5 168 63.546 0.000325805 -3.27835 63.546000 Cu 0.503945 0.866435 0.5 169 63.546 0.00171801 -3.27755 63.546000 Cu 0.711507 0.862361 1.47492e-19 170 63.546 0.00123099 -3.27919 63.546000 Cu 0.676696 0.883758 0.5 173 63.546 0.00122341 -3.27825 63.546000 Cu 0.832066 0.849441 1.08057e-17 150 63.546 0.000497653 -3.27859 63.546000 Cu 0.952478 0.836286 1 153 63.546 0.000509059 -3.27786 63.546000 Cu 0.917995 0.857968 0.5 156 63.546 0.000320166 -3.27795 63.546000 Cu 0.797788 0.871147 0.5 172 63.546 0.00275546 -3.27931 63.546000 Cu 0.883734 0.879759 6.01147e-17 174 63.546 0.00120532 -3.27868 63.546000 Cu 0.969451 0.88817 0.5 176 63.546 0.00143284 -3.27724 63.546000 Cu 0.0552152 0.896544 5.27091e-18 178 63.546 0.0054282 -3.27687 63.546000 Cu 0.0204682 0.918322 0.5 179 63.546 0.00778856 -3.27419 63.546000 Cu 0.105898 0.926615 3.1051e-20 204 63.546 0.0156236 -3.27813 63.546000 Cu 0.141246 0.905006 0.5 205 63.546 0.0124802 -3.27512 63.546000 Cu 0.228352 0.913956 3.34575e-18 206 63.546 0.00720598 -3.27884 63.546000 Cu 0.19176 0.934717 0.5 209 63.546 0.0744794 -3.26575 63.546000 Cu 0.349637 0.901587 1.68607e-17 185 63.546 0.00874149 -3.28015 63.546000 Cu 0.263355 0.892735 0.5 187 63.546 0.00613362 -3.28033 63.546000 Cu 0.43535 0.910127 0.5 191 63.546 0.00325991 -3.27814 63.546000 Cu 0.281238 0.944073 1 207 63.546 0.0569895 -3.26227 63.546000 Cu 0.315542 0.923269 0.5 208 63.546 0.0356936 -3.28224 63.546000 Cu 0.401661 0.932141 8.53903e-20 210 63.546 0.0265287 -3.27516 63.546000 Cu 0.48626 0.940682 0.5 212 63.546 0.0127668 -3.26947 63.546000 Cu 0.520466 0.918319 3.1051e-20 189 63.546 0.00778305 -3.27419 63.546000 Cu 0.555206 0.896539 0.5 190 63.546 0.00546535 -3.27688 63.546000 Cu 0.641236 0.905002 4.65765e-20 192 63.546 0.012551 -3.27514 63.546000 Cu 0.691756 0.934715 7.76275e-20 193 63.546 0.0745264 -3.26576 63.546000 Cu 0.728344 0.913954 0.5 194 63.546 0.0071901 -3.27885 63.546000 Cu 0.605894 0.926612 0.5 195 63.546 0.0156502 -3.27814 63.546000 Cu 0.763344 0.892734 0 171 63.546 0.00605478 -3.28033 63.546000 Cu 0.93535 0.91013 2.32883e-20 175 63.546 0.00328037 -3.27815 63.546000 Cu 0.849632 0.901589 0.5 177 63.546 0.00872294 -3.28016 63.546000 Cu 0.815537 0.923268 2.32883e-20 196 63.546 0.0356062 -3.28224 63.546000 Cu 0.901659 0.932142 0.5 198 63.546 0.0265336 -3.27517 63.546000 Cu 0.781234 0.944072 0.5 199 63.546 0.0569686 -3.26227 63.546000 Cu 0.98626 0.940683 9.3153e-20 200 63.546 0.0127758 -3.26948 63.546000 Cu 0.0376766 0.971359 1 201 63.546 2.14864 -3.23598 63.546000 Cu 0.070389 0.948237 0.5 202 63.546 0.0784145 -3.264 63.546000 Cu 0.00406229 0.991343 0.5 223 63.546 9.88683 -3.12895 63.546000 Cu 0.158067 0.956476 3.81073e-17 224 63.546 0.359307 -3.24798 63.546000 Cu 0.195688 0.992205 2.32883e-20 225 63.546 7.43621 -3.28582 63.546000 Cu 0.242473 0.963597 0.5 226 63.546 1.36673 -3.17991 63.546000 Cu 0.125637 0.976616 0.5 227 63.546 8.69235 -3.13722 63.546000 Cu 0.412879 0.992428 0.5 249 63.546 9.09079 -3.28238 63.546000 Cu 0.451667 0.962908 7.76275e-20 211 63.546 0.68929 -3.21798 63.546000 Cu 0.367788 0.954418 0.5 213 63.546 0.496033 -3.25083 63.546000 Cu 0.333919 0.974969 0 228 63.546 2.48464 -3.21263 63.546000 Cu 0.283502 0.991423 0.5 230 63.546 9.58654 -3.02835 63.546000 Cu 0.570388 0.948236 7.76275e-20 214 63.546 0.0784023 -3.26401 63.546000 Cu 0.625636 0.976616 1 215 63.546 8.69237 -3.13723 63.546000 Cu 0.658065 0.956475 0.5 216 63.546 0.359285 -3.24798 63.546000 Cu 0.537676 0.971358 0.5 217 63.546 2.14854 -3.23597 63.546000 Cu 0.742472 0.963596 9.3153e-20 218 63.546 1.3668 -3.17992 63.546000 Cu 0.695688 0.992205 0.5 221 63.546 7.43612 -3.28582 63.546000 Cu 0.504062 0.991343 1.60689e-17 231 63.546 9.88661 -3.12895 63.546000 Cu 0.912878 0.992428 1.55255e-20 234 63.546 9.09102 -3.28238 63.546000 Cu 0.867786 0.954418 7.76275e-21 197 63.546 0.495953 -3.25083 63.546000 Cu 0.951666 0.962909 0.5 203 63.546 0.689327 -3.21798 63.546000 Cu 0.783501 0.991423 1.47492e-19 219 63.546 9.58653 -3.02835 63.546000 Cu 0.833917 0.974969 0.5 220 63.546 2.48464 -3.21262