Number of particles = 460 A = 1 Angstrom (basic length-scale) H0(1,1) = 19.3675 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.8368 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.62148 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 0.0304447 0.0389339 0.75 244 63.546 0.0687502 -3.42304 63.546000 Cu 0.0809064 0.00789212 0.75 247 63.546 2.26275 -3.37019 63.546000 Cu 0.199967 0.0197287 0.75 248 63.546 0.584255 -3.36582 63.546000 Cu 0.117314 0.0282222 0.25 250 63.546 0.534526 -3.45203 63.546000 Cu 0.287004 0.0108346 0.25 252 63.546 2.13268 -3.47058 63.546000 Cu 0.0652021 0.0596197 0.25 262 63.546 0.0504117 -3.50734 63.546000 Cu 0.151331 0.0507182 0.75 264 63.546 0.0411577 -3.48125 63.546000 Cu 0.270154 0.0647055 0.75 265 63.546 0.0132705 -3.46549 63.546000 Cu 0.235999 0.0421356 0.25 266 63.546 0.0220754 -3.45187 63.546000 Cu 0.319317 0.0346345 0.75 268 63.546 0.121305 -3.42672 63.546000 Cu 0.37392 0.0061757 0.75 251 63.546 7.1605 -3.06198 63.546000 Cu 0.440811 0.0483867 0.75 269 63.546 0.11517 -3.42924 63.546000 Cu 0.407391 0.0263652 0.25 270 63.546 0.421114 -3.39702 63.546000 Cu 0.355342 0.0563989 0.25 271 63.546 0.0224558 -3.47041 63.546000 Cu 0.490837 0.0193128 0.75 272 63.546 1.46832 -3.17244 63.546000 Cu 0.617314 0.0282211 0.75 273 63.546 0.534622 -3.45199 63.546000 Cu 0.580906 0.00789146 0.25 274 63.546 2.26267 -3.37019 63.546000 Cu 0.530445 0.0389323 0.25 275 63.546 0.0687346 -3.42295 63.546000 Cu 0.477893 0.0690314 0.25 294 63.546 0.00851727 -3.48728 63.546000 Cu 0.565207 0.0596173 0.75 296 63.546 0.0505995 -3.50724 63.546000 Cu 0.651332 0.0507176 0.25 297 63.546 0.0411403 -3.48121 63.546000 Cu 0.787005 0.0108327 0.75 235 63.546 2.13272 -3.47061 63.546000 Cu 0.699967 0.0197274 0.25 236 63.546 0.584196 -3.3658 63.546000 Cu 0.873922 0.006174 0.25 237 63.546 7.16061 -3.06191 63.546000 Cu 0.735999 0.0421347 0.75 239 63.546 0.0220803 -3.45188 63.546000 Cu 0.855343 0.0564007 0.75 240 63.546 0.0224046 -3.47057 63.546000 Cu 0.819319 0.0346332 0.25 241 63.546 0.121136 -3.42677 63.546000 Cu 0.770154 0.0647073 0.25 242 63.546 0.013153 -3.46564 63.546000 Cu 0.907393 0.0263643 0.75 243 63.546 0.421086 -3.39704 63.546000 Cu 0.990837 0.0193135 0.25 245 63.546 1.46882 -3.1724 63.546000 Cu 0.940811 0.0483889 0.25 246 63.546 0.115298 -3.42941 63.546000 Cu 0.977885 0.0690371 0.75 260 63.546 0.00853098 -3.48744 63.546000 Cu 0.0994714 0.0812901 0.75 261 63.546 0.0131024 -3.50612 63.546000 Cu 0.013224 0.0901593 0.25 263 63.546 0.00987447 -3.5057 63.546000 Cu 0.185176 0.0727743 0.25 267 63.546 0.0054293 -3.49035 63.546000 Cu 0.0477852 0.111718 0.75 284 63.546 0.00460349 -3.50244 63.546000 Cu 0.167951 0.124948 0.75 285 63.546 0.000586064 -3.49128 63.546000 Cu 0.133658 0.103131 0.25 286 63.546 0.00201788 -3.49764 63.546000 Cu 0.0821066 0.13342 0.25 287 63.546 0.00080593 -3.49687 63.546000 Cu 0.219219 0.0948021 0.75 288 63.546 0.00232862 -3.4862 63.546000 Cu 0.304911 0.086487 0.25 290 63.546 0.00862845 -3.47878 63.546000 Cu 0.253824 0.116523 0.25 291 63.546 0.00308114 -3.48635 63.546000 Cu 0.288635 0.13805 0.75 313 63.546 0.00157065 -3.48895 63.546000 Cu 0.339901 0.108013 0.75 289 63.546 0.00555574 -3.48344 63.546000 Cu 0.390772 0.078069 0.75 292 63.546 0.0214039 -3.46968 63.546000 Cu 0.513243 0.0901528 0.75 293 63.546 0.0100934 -3.50568 63.546000 Cu 0.426545 0.099195 0.25 295 63.546 0.0017107 -3.4912 63.546000 Cu 0.599481 0.0812891 0.25 298 63.546 0.0131894 -3.50613 63.546000 Cu 0.37506 0.129338 0.25 315 63.546 0.000521606 -3.49296 63.546000 Cu 0.461552 0.1205 0.75 317 63.546 0.00255565 -3.50007 63.546000 Cu 0.582117 0.133428 0.75 318 63.546 0.00079356 -3.4966 63.546000 Cu 0.54781 0.111716 0.25 319 63.546 0.00472107 -3.50235 63.546000 Cu 0.496092 0.142033 0.25 320 63.546 0.00160169 -3.49912 63.546000 Cu 0.633666 0.103137 0.75 321 63.546 0.00197893 -3.49769 63.546000 Cu 0.685179 0.0727759 0.75 238 63.546 0.00540526 -3.49038 63.546000 Cu 0.753797 0.11654 0.75 253 63.546 0.00312187 -3.48651 63.546000 Cu 0.719215 0.0948101 0.25 254 63.546 0.00228726 -3.48634 63.546000 Cu 0.667937 0.124964 0.25 255 63.546 0.000565033 -3.49126 63.546000 Cu 0.804901 0.0864953 0.75 256 63.546 0.00864287 -3.47897 63.546000 Cu 0.926516 0.0992074 0.75 257 63.546 0.00172615 -3.49132 63.546000 Cu 0.890762 0.0780768 0.25 258 63.546 0.0215732 -3.46994 63.546000 Cu 0.839869 0.10803 0.25 259 63.546 0.00572089 -3.48361 63.546000 Cu 0.788572 0.13808 0.25 278 63.546 0.00171056 -3.48934 63.546000 Cu 0.875001 0.129361 0.75 280 63.546 0.00054249 -3.49328 63.546000 Cu 0.996053 0.14204 0.75 281 63.546 0.00147128 -3.49952 63.546000 Cu 0.961508 0.120512 0.25 282 63.546 0.00237736 -3.50026 63.546000 Cu 0.0648192 0.185293 0.75 306 63.546 2.73729e-05 -3.49379 63.546000 Cu 0.0304307 0.163666 0.25 307 63.546 0.000315611 -3.49637 63.546000 Cu 0.116467 0.155115 0.75 309 63.546 0.000136635 -3.49296 63.546000 Cu 0.237112 0.168153 0.75 310 63.546 0.000485219 -3.49149 63.546000 Cu 0.202479 0.146607 0.25 311 63.546 0.000939922 -3.48992 63.546000 Cu 0.15093 0.176735 0.25 312 63.546 0.000248027 -3.49192 63.546000 Cu 0.323432 0.159487 0.25 316 63.546 0.000156253 -3.49368 63.546000 Cu 0.0992397 0.206891 0.25 332 63.546 5.37555e-05 -3.4933 63.546000 Cu 0.185442 0.198293 0.75 334 63.546 0.000155474 -3.49309 63.546000 Cu 0.306225 0.211165 0.75 335 63.546 3.56022e-05 -3.49579 63.546000 Cu 0.271717 0.18965 0.25 336 63.546 6.04129e-05 -3.49415 63.546000 Cu 0.409818 0.150751 0.75 314 63.546 0.000683706 -3.49742 63.546000 Cu 0.358039 0.180964 0.75 338 63.546 0.000177742 -3.49601 63.546000 Cu 0.478684 0.19389 0.75 339 63.546 0.000170434 -3.4955 63.546000 Cu 0.4443 0.172286 0.25 340 63.546 0.000542128 -3.49718 63.546000 Cu 0.392503 0.202505 0.25 341 63.546 0.000232462 -3.49607 63.546000 Cu 0.530438 0.163674 0.75 342 63.546 0.000322776 -3.49624 63.546000 Cu 0.650855 0.176783 0.75 343 63.546 0.000338983 -3.4926 63.546000 Cu 0.616438 0.155139 0.25 344 63.546 0.000119166 -3.49303 63.546000 Cu 0.564781 0.185327 0.25 345 63.546 1.91032e-05 -3.49419 63.546000 Cu 0.599155 0.206953 0.75 367 63.546 0.000136893 -3.49361 63.546000 Cu 0.702425 0.146639 0.75 276 63.546 0.00101879 -3.4902 63.546000 Cu 0.823342 0.159526 0.75 277 63.546 0.000187633 -3.49437 63.546000 Cu 0.737019 0.1682 0.25 279 63.546 0.000630339 -3.49228 63.546000 Cu 0.90975 0.150775 0.25 283 63.546 0.000544223 -3.49796 63.546000 Cu 0.68533 0.19836 0.25 300 63.546 0.000317939 -3.49355 63.546000 Cu 0.771605 0.189707 0.75 301 63.546 0.000117542 -3.49455 63.546000 Cu 0.892448 0.202521 0.75 302 63.546 0.000180876 -3.49566 63.546000 Cu 0.857952 0.181001 0.25 303 63.546 9.2119e-05 -3.4963 63.546000 Cu 0.806131 0.211207 0.25 304 63.546 8.19035e-06 -3.49532 63.546000 Cu 0.944251 0.172301 0.75 305 63.546 0.000441315 -3.49744 63.546000 Cu 0.978675 0.19388 0.25 308 63.546 0.000159737 -3.49523 63.546000 Cu 0.0130793 0.215473 0.75 330 63.546 1.87285e-05 -3.49389 63.546000 Cu 0.133665 0.228465 0.75 331 63.546 7.98221e-05 -3.49454 63.546000 Cu 0.0474626 0.237067 0.25 333 63.546 1.08651e-05 -3.49411 63.546000 Cu 0.219927 0.21983 0.25 337 63.546 3.869e-05 -3.49508 63.546000 Cu 0.0818276 0.258659 0.75 355 63.546 9.13203e-05 -3.49486 63.546000 Cu 0.202493 0.271565 0.75 356 63.546 2.00627e-05 -3.49555 63.546000 Cu 0.168079 0.250027 0.25 357 63.546 7.42483e-05 -3.49534 63.546000 Cu 0.116196 0.280236 0.25 358 63.546 0.00018559 -3.49605 63.546000 Cu 0.254379 0.241366 0.75 359 63.546 1.48333e-06 -3.49539 63.546000 Cu 0.288814 0.262899 0.25 362 63.546 8.84186e-05 -3.49455 63.546000 Cu 0.323269 0.284448 0.75 384 63.546 0.000298086 -3.49427 63.546000 Cu 0.375074 0.254272 0.75 360 63.546 0.000184055 -3.49383 63.546000 Cu 0.34067 0.232708 0.25 361 63.546 0.000110968 -3.49515 63.546000 Cu 0.42689 0.224089 0.75 363 63.546 0.000137094 -3.49461 63.546000 Cu 0.547369 0.237134 0.75 364 63.546 6.49503e-05 -3.49365 63.546000 Cu 0.513037 0.215515 0.25 365 63.546 7.34799e-06 -3.49401 63.546000 Cu 0.461241 0.245695 0.25 366 63.546 3.18059e-05 -3.49346 63.546000 Cu 0.633537 0.228543 0.25 368 63.546 0.000255896 -3.4942 63.546000 Cu 0.409448 0.27587 0.25 386 63.546 0.000106864 -3.49382 63.546000 Cu 0.495576 0.267318 0.75 388 63.546 3.131e-05 -3.49415 63.546000 Cu 0.616135 0.280308 0.75 389 63.546 0.000317043 -3.49611 63.546000 Cu 0.581717 0.258738 0.25 390 63.546 0.000273633 -3.49487 63.546000 Cu 0.719802 0.219894 0.75 299 63.546 0.000118661 -3.49472 63.546000 Cu 0.66796 0.250094 0.75 322 63.546 0.000175906 -3.49531 63.546000 Cu 0.788774 0.262917 0.75 323 63.546 7.4086e-05 -3.49496 63.546000 Cu 0.754282 0.241406 0.25 324 63.546 1.78323e-06 -3.49534 63.546000 Cu 0.702448 0.271613 0.25 325 63.546 2.61197e-05 -3.49576 63.546000 Cu 0.840617 0.232721 0.75 326 63.546 0.000106106 -3.49499 63.546000 Cu 0.961279 0.245653 0.75 327 63.546 5.16008e-05 -3.49385 63.546000 Cu 0.926883 0.224076 0.25 328 63.546 0.00013633 -3.49445 63.546000 Cu 0.875062 0.25426 0.25 329 63.546 0.000181379 -3.49415 63.546000 Cu 0.82329 0.284438 0.25 349 63.546 0.000286036 -3.4936 63.546000 Cu 0.909494 0.275831 0.75 351 63.546 0.000140508 -3.4934 63.546000 Cu 0.995648 0.267253 0.25 353 63.546 9.60985e-06 -3.49402 63.546000 Cu 0.0300143 0.288866 0.75 352 63.546 0.000140251 -3.49535 63.546000 Cu 0.0988376 0.332014 0.75 377 63.546 0.000585075 -3.49807 63.546000 Cu 0.0644072 0.310472 0.25 378 63.546 0.000505051 -3.49796 63.546000 Cu 0.0124768 0.340735 0.25 379 63.546 0.00167919 -3.50038 63.546000 Cu 0.150671 0.301783 0.75 380 63.546 0.000112283 -3.4972 63.546000 Cu 0.271582 0.314618 0.75 381 63.546 0.000540001 -3.49257 63.546000 Cu 0.236992 0.293088 0.25 382 63.546 0.000112498 -3.49563 63.546000 Cu 0.185267 0.323276 0.25 383 63.546 0.00018681 -3.4943 63.546000 Cu 0.133373 0.353429 0.25 402 63.546 0.000516371 -3.49372 63.546000 Cu 0.21986 0.344731 0.75 404 63.546 0.0015449 -3.48947 63.546000 Cu 0.306087 0.336183 0.25 406 63.546 0.000973921 -3.4902 63.546000 Cu 0.443804 0.297506 0.75 385 63.546 1.94098e-05 -3.49402 63.546000 Cu 0.35773 0.306044 0.25 387 63.546 0.000255081 -3.49285 63.546000 Cu 0.529912 0.288945 0.25 391 63.546 0.000342371 -3.49532 63.546000 Cu 0.392107 0.327689 0.75 408 63.546 0.000112915 -3.49276 63.546000 Cu 0.51243 0.340798 0.75 409 63.546 0.00177777 -3.50021 63.546000 Cu 0.478144 0.319159 0.25 410 63.546 0.00040282 -3.49588 63.546000 Cu 0.426312 0.349397 0.25 411 63.546 0.000796107 -3.49764 63.546000 Cu 0.564295 0.310535 0.75 412 63.546 0.000662708 -3.49727 63.546000 Cu 0.650613 0.301828 0.25 413 63.546 0.000164926 -3.49664 63.546000 Cu 0.598754 0.332065 0.25 414 63.546 0.000833273 -3.4986 63.546000 Cu 0.633413 0.353462 0.75 437 63.546 0.000426033 -3.49401 63.546000 Cu 0.685193 0.323294 0.75 346 63.546 0.000150037 -3.49458 63.546000 Cu 0.736974 0.293111 0.75 347 63.546 7.38926e-05 -3.49478 63.546000 Cu 0.857818 0.305994 0.75 348 63.546 0.000432578 -3.49186 63.546000 Cu 0.771588 0.314591 0.25 350 63.546 0.000645587 -3.49194 63.546000 Cu 0.943919 0.29744 0.25 354 63.546 4.35755e-05 -3.49343 63.546000 Cu 0.719958 0.344708 0.25 370 63.546 0.00196308 -3.48977 63.546000 Cu 0.806154 0.336125 0.75 372 63.546 0.00141858 -3.49041 63.546000 Cu 0.926377 0.349337 0.75 373 63.546 0.000792377 -3.4979 63.546000 Cu 0.892217 0.327611 0.25 374 63.546 0.000303102 -3.49322 63.546000 Cu 0.978254 0.319087 0.75 376 63.546 0.000305147 -3.49634 63.546000 Cu 0.0467362 0.362274 0.75 400 63.546 0.00242385 -3.50092 63.546000 Cu 0.168091 0.374768 0.75 401 63.546 0.00502544 -3.48482 63.546000 Cu 0.0813035 0.383582 0.25 403 63.546 0.00146601 -3.49207 63.546000 Cu 0.254353 0.366267 0.25 407 63.546 0.00285134 -3.4869 63.546000 Cu 0.0291171 0.413734 0.25 423 63.546 0.00685658 -3.48726 63.546000 Cu 0.116459 0.404711 0.75 425 63.546 0.0172913 -3.4728 63.546000 Cu 0.236772 0.417984 0.75 426 63.546 0.0150298 -3.46406 63.546000 Cu 0.202584 0.396259 0.25 427 63.546 0.00879273 -3.47813 63.546000 Cu 0.151214 0.426263 0.25 428 63.546 0.0229982 -3.47178 63.546000 Cu 0.288532 0.387959 0.75 429 63.546 0.00282446 -3.48515 63.546000 Cu 0.321959 0.409958 0.25 432 63.546 0.00529461 -3.48925 63.546000 Cu 0.340368 0.357855 0.75 405 63.546 0.000591902 -3.49201 63.546000 Cu 0.407856 0.401494 0.75 430 63.546 0.0150958 -3.50612 63.546000 Cu 0.374311 0.379666 0.25 431 63.546 0.00214214 -3.49764 63.546000 Cu 0.460346 0.371113 0.75 433 63.546 0.00538098 -3.50337 63.546000 Cu 0.581471 0.383595 0.75 434 63.546 0.00128057 -3.49125 63.546000 Cu 0.546762 0.362332 0.25 435 63.546 0.00321352 -3.50075 63.546000 Cu 0.494464 0.392643 0.25 436 63.546 0.0105749 -3.50477 63.546000 Cu 0.441432 0.4231 0.25 453 63.546 0.0466027 -3.50647 63.546000 Cu 0.529161 0.413707 0.75 455 63.546 0.00658847 -3.48646 63.546000 Cu 0.651247 0.426237 0.75 456 63.546 0.022716 -3.47243 63.546000 Cu 0.616624 0.404689 0.25 457 63.546 0.0184377 -3.47245 63.546000 Cu 0.754551 0.366223 0.75 369 63.546 0.00396813 -3.48689 63.546000 Cu 0.668308 0.374756 0.25 371 63.546 0.00590228 -3.48458 63.546000 Cu 0.8405 0.357794 0.25 375 63.546 0.000888429 -3.49202 63.546000 Cu 0.702848 0.396237 0.75 392 63.546 0.00962795 -3.47818 63.546000 Cu 0.822165 0.409943 0.75 393 63.546 0.00510075 -3.48942 63.546000 Cu 0.788713 0.387933 0.25 394 63.546 0.00288313 -3.48468 63.546000 Cu 0.736924 0.417952 0.25 395 63.546 0.0156226 -3.46488 63.546000 Cu 0.874404 0.379629 0.75 396 63.546 0.00202425 -3.4975 63.546000 Cu 0.994457 0.392621 0.75 397 63.546 0.00970112 -3.50467 63.546000 Cu 0.960362 0.371066 0.25 398 63.546 0.00509892 -3.50283 63.546000 Cu 0.907996 0.401479 0.25 399 63.546 0.014371 -3.50578 63.546000 Cu 0.941594 0.423109 0.75 421 63.546 0.0448542 -3.50622 63.546000 Cu 0.0652461 0.434408 0.75 422 63.546 0.0846185 -3.43823 63.546000 Cu 0.0143559 0.463639 0.75 443 63.546 0.982644 -3.2265 63.546000 Cu 0.131272 0.476424 0.75 444 63.546 9.3626 -3.06807 63.546000 Cu 0.0981005 0.456174 0.25 445 63.546 0.294154 -3.3962 63.546000 Cu 0.057787 0.490721 0.25 446 63.546 7.8361 -3.72071 63.546000 Cu 0.186457 0.44792 0.75 447 63.546 0.116034 -3.42787 63.546000 Cu 0.304798 0.46314 0.75 448 63.546 0.499271 -3.39641 63.546000 Cu 0.270175 0.44049 0.25 449 63.546 0.0168586 -3.45172 63.546000 Cu 0.2178 0.471353 0.25 450 63.546 1.64105 -3.42697 63.546000 Cu 0.249158 0.491276 0.75 459 63.546 11.577 -3.00458 63.546000 Cu 0.631305 0.476363 0.25 6 63.546 9.38255 -3.0666 63.546000 Cu 0.598067 0.456148 0.75 18 63.546 0.300948 -3.39464 63.546000 Cu 0.471666 0.491291 0.25 222 63.546 10.6987 -2.72215 63.546000 Cu 0.514375 0.463583 0.25 229 63.546 1.00143 -3.22665 63.546000 Cu 0.557925 0.490719 0.75 232 63.546 7.86914 -3.72286 63.546000 Cu 0.423314 0.474473 0.75 233 63.546 1.83294 -3.32746 63.546000 Cu 0.354954 0.432042 0.75 451 63.546 0.0454811 -3.48711 63.546000 Cu 0.475676 0.443776 0.75 452 63.546 0.049032 -3.42975 63.546000 Cu 0.388079 0.454335 0.25 454 63.546 0.454585 -3.45327 63.546000 Cu 0.565221 0.434357 0.25 458 63.546 0.0879167 -3.43783 63.546000 Cu 0.340134 0.490995 0.25 460 63.546 9.51631 -3.85535 63.546000 Cu 0.71779 0.471327 0.75 415 63.546 1.65769 -3.42906 63.546000 Cu 0.686448 0.447875 0.25 416 63.546 0.117158 -3.42808 63.546000 Cu 0.770264 0.440463 0.75 417 63.546 0.0166762 -3.45341 63.546000 Cu 0.888143 0.454334 0.75 418 63.546 0.448815 -3.45332 63.546000 Cu 0.855138 0.432041 0.25 419 63.546 0.0439479 -3.48735 63.546000 Cu 0.804846 0.463113 0.25 420 63.546 0.494636 -3.39693 63.546000 Cu 0.975736 0.443822 0.25 424 63.546 0.0477207 -3.42981 63.546000 Cu 0.7493 0.491265 0.25 439 63.546 11.6028 -3.0077 63.546000 Cu 0.840122 0.490966 0.75 440 63.546 9.48484 -3.8524 63.546000 Cu 0.971636 0.491322 0.75 441 63.546 10.6678 -2.7215 63.546000 Cu 0.923269 0.474502 0.25 442 63.546 1.82497 -3.32812 63.546000 Cu 0.21228 0.510594 0.25 1 63.546 2.20512 -3.47598 63.546000 Cu 0.12529 0.506035 0.75 2 63.546 9.42628 -3.06035 63.546000 Cu 0.29962 0.519531 0.75 3 63.546 0.596559 -3.36465 63.546000 Cu 0.00834892 0.519236 0.75 9 63.546 1.54735 -3.16557 63.546000 Cu 0.0918759 0.5262 0.25 11 63.546 0.443756 -3.39686 63.546000 Cu 0.144191 0.556185 0.25 12 63.546 0.0224195 -3.47072 63.546000 Cu 0.180238 0.534418 0.75 13 63.546 0.127083 -3.42665 63.546000 Cu 0.0586415 0.548247 0.75 14 63.546 0.12148 -3.42845 63.546000 Cu 0.263582 0.541909 0.25 15 63.546 0.0233415 -3.45125 63.546000 Cu 0.229374 0.564489 0.75 17 63.546 0.0119701 -3.46536 63.546000 Cu 0.0215922 0.568893 0.25 33 63.546 0.00912285 -3.48815 63.546000 Cu 0.625532 0.505988 0.25 4 63.546 7.19072 -3.0617 63.546000 Cu 0.382299 0.528031 0.25 19 63.546 0.537724 -3.45093 63.546000 Cu 0.418753 0.507699 0.75 20 63.546 2.28906 -3.37143 63.546000 Cu 0.508736 0.519175 0.25 21 63.546 1.5092 -3.16834 63.546000 Cu 0.558686 0.548258 0.25 22 63.546 0.121286 -3.42922 63.546000 Cu 0.592151 0.526198 0.75 23 63.546 0.428015 -3.39656 63.546000 Cu 0.469136 0.538785 0.75 24 63.546 0.0688764 -3.42205 63.546000 Cu 0.644073 0.55625 0.75 28 63.546 0.0227294 -3.4692 63.546000 Cu 0.348227 0.550527 0.75 41 63.546 0.0407113 -3.48022 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