Number of particles = 459 A = 1 Angstrom (basic length-scale) H0(1,1) = 19.4528 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 77.9844 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.61844 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 0.0303008 0.0256837 3.0173e-17 243 63.546 1.77227 -3.43006 63.546000 Cu 0.153383 0.0393039 6.80166e-18 244 63.546 0.236625 -3.52584 63.546000 Cu 0.114154 0.02041 0.5 245 63.546 8.9151 -3.46893 63.546000 Cu 0.00301473 0.0035859 0.5 237 63.546 8.85642 -3.41144 63.546000 Cu 0.194816 0.0077643 1.75884e-17 247 63.546 7.09933 -3.22746 63.546000 Cu 0.32532 0.0203607 0 248 63.546 0.976302 -3.49624 63.546000 Cu 0.283714 0.00202494 0.5 249 63.546 7.52609 -3.39593 63.546000 Cu 0.238208 0.0307389 0.5 250 63.546 0.212674 -3.51306 63.546000 Cu 0.411641 0.0129959 0.5 252 63.546 3.5517 -3.07889 63.546000 Cu 0.44488 0.0340725 3.11618e-18 268 63.546 0.0310732 -3.53575 63.546000 Cu 0.503015 0.0035859 0 251 63.546 8.85642 -3.41144 63.546000 Cu 0.530301 0.0256837 0.5 270 63.546 1.77227 -3.43006 63.546000 Cu 0.614154 0.02041 0 272 63.546 8.9151 -3.46893 63.546000 Cu 0.653383 0.0393039 0.5 275 63.546 0.236625 -3.52584 63.546000 Cu 0.783714 0.00202494 0 234 63.546 7.52609 -3.39593 63.546000 Cu 0.82532 0.0203607 0.5 236 63.546 0.976302 -3.49624 63.546000 Cu 0.738208 0.0307389 7.28107e-18 273 63.546 0.212674 -3.51306 63.546000 Cu 0.694816 0.0077643 0.5 274 63.546 7.09933 -3.22746 63.546000 Cu 0.911641 0.0129959 4.19486e-18 235 63.546 3.5517 -3.07889 63.546000 Cu 0.94488 0.0340725 0.5 241 63.546 0.0310732 -3.53575 63.546000 Cu 0.0636579 0.0486632 0.5 246 63.546 0.186042 -3.52089 63.546000 Cu 0.0121471 0.0780753 0.5 258 63.546 0.0249779 -3.53664 63.546000 Cu 0.0993689 0.0692703 6.62188e-18 260 63.546 0.016272 -3.53806 63.546000 Cu 0.185746 0.060819 0.5 262 63.546 0.018104 -3.53865 63.546000 Cu 0.273319 0.0514725 7.49081e-18 264 63.546 0.0348116 -3.53375 63.546000 Cu 0.306567 0.0732154 0.5 267 63.546 0.00374001 -3.53964 63.546000 Cu 0.392806 0.0644857 1.70791e-18 265 63.546 0.00399872 -3.53921 63.546000 Cu 0.358178 0.0428701 0.5 266 63.546 0.0238954 -3.53727 63.546000 Cu 0.478393 0.0560035 0.5 271 63.546 0.0165832 -3.53783 63.546000 Cu 0.563658 0.0486632 2.1214e-17 269 63.546 0.186042 -3.52089 63.546000 Cu 0.512147 0.0780753 0 292 63.546 0.0249779 -3.53664 63.546000 Cu 0.599369 0.0692703 0.5 294 63.546 0.016272 -3.53806 63.546000 Cu 0.806567 0.0732154 3.86526e-18 238 63.546 0.00374001 -3.53964 63.546000 Cu 0.685746 0.060819 2.33713e-18 296 63.546 0.018104 -3.53865 63.546000 Cu 0.773319 0.0514725 0.5 297 63.546 0.0348116 -3.53375 63.546000 Cu 0.858178 0.0428701 8.86912e-18 239 63.546 0.0238954 -3.53727 63.546000 Cu 0.978393 0.0560035 0 240 63.546 0.0165832 -3.53783 63.546000 Cu 0.892806 0.0644857 0.5 242 63.546 0.00399872 -3.53921 63.546000 Cu 0.0472456 0.0993177 2.58882e-17 257 63.546 0.00151221 -3.53974 63.546000 Cu 0.133584 0.0907255 0.5 263 63.546 0.00136702 -3.53964 63.546000 Cu 0.220388 0.0819119 6.6818e-18 261 63.546 0.00431492 -3.53895 63.546000 Cu 0.168235 0.112104 3.59559e-19 284 63.546 0.000591505 -3.53987 63.546000 Cu 0.254476 0.103451 0.5 286 63.546 0.000578529 -3.53989 63.546000 Cu 0.340649 0.0948014 2.6098e-17 288 63.546 0.000749697 -3.53975 63.546000 Cu 0.460872 0.107957 0 289 63.546 0.00237832 -3.53946 63.546000 Cu 0.426564 0.0862506 0.5 290 63.546 0.00228733 -3.53948 63.546000 Cu 0.374892 0.116432 0.5 291 63.546 0.000231583 -3.53987 63.546000 Cu 0.633584 0.0907255 1.43824e-18 293 63.546 0.00136702 -3.53964 63.546000 Cu 0.547246 0.0993177 0.5 295 63.546 0.00151221 -3.53974 63.546000 Cu 0.720388 0.0819119 0.5 298 63.546 0.00431492 -3.53895 63.546000 Cu 0.668235 0.112104 0.5 319 63.546 0.000591503 -3.53987 63.546000 Cu 0.754476 0.103451 2.84651e-18 321 63.546 0.000578529 -3.53989 63.546000 Cu 0.874892 0.116432 1.78581e-17 253 63.546 0.000231584 -3.53987 63.546000 Cu 0.840649 0.0948014 0.5 254 63.546 0.000749696 -3.53975 63.546000 Cu 0.926564 0.0862506 0 256 63.546 0.00228733 -3.53948 63.546000 Cu 0.960872 0.107957 0.5 259 63.546 0.00237832 -3.53946 63.546000 Cu 0.116431 0.14228 0 281 63.546 8.71043e-05 -3.53994 63.546000 Cu 0.0818662 0.120799 0.5 282 63.546 0.000118456 -3.53991 63.546000 Cu 0.0301641 0.150926 0.5 283 63.546 2.14646e-05 -3.53994 63.546000 Cu 0.28882 0.125014 2.0375e-18 285 63.546 0.000114491 -3.53992 63.546000 Cu 0.202644 0.133642 0.5 287 63.546 9.46699e-05 -3.53994 63.546000 Cu 0.237078 0.155198 1.11164e-17 309 63.546 1.77813e-05 -3.53995 63.546000 Cu 0.32323 0.146593 0.5 311 63.546 3.20199e-05 -3.53994 63.546000 Cu 0.409357 0.138028 0 313 63.546 0.000258656 -3.53988 63.546000 Cu 0.495602 0.129417 0.5 315 63.546 0.000150259 -3.53991 63.546000 Cu 0.443936 0.159542 0.5 316 63.546 2.39058e-05 -3.53994 63.546000 Cu 0.530164 0.150926 0 314 63.546 2.14642e-05 -3.53994 63.546000 Cu 0.581866 0.120799 0 317 63.546 0.000118456 -3.53991 63.546000 Cu 0.616431 0.14228 0.5 320 63.546 8.71007e-05 -3.53994 63.546000 Cu 0.78882 0.125014 0.5 255 63.546 0.00011449 -3.53992 63.546000 Cu 0.82323 0.146593 0 276 63.546 3.20203e-05 -3.53994 63.546000 Cu 0.702644 0.133642 0 318 63.546 9.46695e-05 -3.53994 63.546000 Cu 0.737078 0.155198 0.5 344 63.546 1.77797e-05 -3.53995 63.546000 Cu 0.943936 0.159542 4.4046e-18 277 63.546 2.39066e-05 -3.53994 63.546000 Cu 0.909357 0.138028 0.5 278 63.546 0.000258657 -3.53988 63.546000 Cu 0.995602 0.129417 0 280 63.546 0.000150259 -3.53991 63.546000 Cu 0.0646717 0.172447 1.68094e-17 305 63.546 1.34918e-05 -3.53995 63.546000 Cu 0.150881 0.163821 0.5 307 63.546 1.31542e-05 -3.53995 63.546000 Cu 0.0991423 0.193993 0.5 308 63.546 1.24765e-06 -3.53996 63.546000 Cu 0.185348 0.185372 0 306 63.546 1.7368e-06 -3.53995 63.546000 Cu 0.271538 0.176757 0.5 312 63.546 4.74516e-06 -3.53995 63.546000 Cu 0.306022 0.19831 0 334 63.546 3.47967e-06 -3.53995 63.546000 Cu 0.357716 0.168157 3.89522e-18 310 63.546 3.23251e-05 -3.53994 63.546000 Cu 0.392234 0.189692 0.5 336 63.546 3.98402e-06 -3.53995 63.546000 Cu 0.478444 0.181075 0 338 63.546 3.88239e-06 -3.53995 63.546000 Cu 0.599142 0.193993 0 339 63.546 1.24305e-06 -3.53996 63.546000 Cu 0.564672 0.172447 0.5 340 63.546 1.34812e-05 -3.53995 63.546000 Cu 0.650881 0.163821 2.02552e-17 342 63.546 1.31529e-05 -3.53995 63.546000 Cu 0.806022 0.19831 0.5 300 63.546 3.4805e-06 -3.53995 63.546000 Cu 0.771538 0.176757 0 343 63.546 4.74496e-06 -3.53995 63.546000 Cu 0.685348 0.185372 0.5 345 63.546 1.7348e-06 -3.53995 63.546000 Cu 0.857716 0.168157 0.5 279 63.546 3.23273e-05 -3.53994 63.546000 Cu 0.892234 0.189692 0 301 63.546 3.98532e-06 -3.53995 63.546000 Cu 0.978444 0.181075 0.5 303 63.546 3.88391e-06 -3.53995 63.546000 Cu 0.0129351 0.202614 0 302 63.546 1.54799e-06 -3.53996 63.546000 Cu 0.0474145 0.224163 0.5 328 63.546 7.18765e-08 -3.53996 63.546000 Cu 0.133621 0.215543 0 330 63.546 9.84497e-08 -3.53996 63.546000 Cu 0.254308 0.228475 0 331 63.546 2.78121e-07 -3.53996 63.546000 Cu 0.219824 0.206924 0.5 332 63.546 4.61922e-07 -3.53996 63.546000 Cu 0.168103 0.237093 0.5 333 63.546 3.13922e-08 -3.53996 63.546000 Cu 0.426722 0.211236 3.32592e-18 335 63.546 4.57303e-07 -3.53996 63.546000 Cu 0.340516 0.219855 0.5 337 63.546 4.58082e-07 -3.53996 63.546000 Cu 0.461208 0.232783 0.5 361 63.546 8.35224e-08 -3.53996 63.546000 Cu 0.512935 0.202614 0.5 341 63.546 1.52454e-06 -3.53996 63.546000 Cu 0.547415 0.224163 1.74686e-17 363 63.546 6.42308e-08 -3.53996 63.546000 Cu 0.633621 0.215543 0.5 365 63.546 9.90497e-08 -3.53996 63.546000 Cu 0.668104 0.237093 0 364 63.546 5.35986e-08 -3.53996 63.546000 Cu 0.719825 0.206924 0 367 63.546 4.63331e-07 -3.53996 63.546000 Cu 0.754308 0.228475 0.5 368 63.546 2.75315e-07 -3.53996 63.546000 Cu 0.840516 0.219855 0 299 63.546 4.5916e-07 -3.53996 63.546000 Cu 0.926722 0.211236 0.5 304 63.546 4.61827e-07 -3.53996 63.546000 Cu 0.961208 0.232783 0 326 63.546 1.15921e-07 -3.53996 63.546000 Cu 0.0818966 0.245713 1.83675e-17 327 63.546 1.80188e-09 -3.53996 63.546000 Cu 0.0301718 0.275883 0 351 63.546 1.49864e-08 -3.53996 63.546000 Cu 0.116379 0.267263 0.5 353 63.546 7.10613e-09 -3.53996 63.546000 Cu 0.202586 0.258643 0 355 63.546 2.06875e-08 -3.53996 63.546000 Cu 0.323276 0.271573 2.77759e-17 356 63.546 2.73285e-08 -3.53996 63.546000 Cu 0.288793 0.250023 0.5 357 63.546 3.19994e-08 -3.53996 63.546000 Cu 0.375 0.241404 1.33037e-17 359 63.546 3.00702e-08 -3.53996 63.546000 Cu 0.49569 0.254333 4.91397e-18 360 63.546 1.73508e-08 -3.53996 63.546000 Cu 0.409482 0.262953 0.5 362 63.546 1.98521e-08 -3.53996 63.546000 Cu 0.581897 0.245713 0.5 366 63.546 4.81865e-08 -3.53996 63.546000 Cu 0.530173 0.275882 0.5 386 63.546 7.13107e-07 -3.53996 63.546000 Cu 0.616382 0.267261 3.80533e-18 388 63.546 3.37444e-07 -3.53996 63.546000 Cu 0.788793 0.250023 0 322 63.546 3.34033e-08 -3.53996 63.546000 Cu 0.823276 0.271573 0.5 325 63.546 1.34168e-08 -3.53996 63.546000 Cu 0.702587 0.258643 0.5 390 63.546 5.26541e-08 -3.53996 63.546000 Cu 0.909483 0.262953 0 323 63.546 9.88076e-09 -3.53996 63.546000 Cu 0.875 0.241404 0.5 324 63.546 3.63042e-08 -3.53996 63.546000 Cu 0.99569 0.254333 0.5 329 63.546 2.32894e-09 -3.53996 63.546000 Cu 0.150862 0.288812 0 352 63.546 3.29597e-08 -3.53996 63.546000 Cu 0.0646536 0.297433 0.5 354 63.546 8.39525e-08 -3.53996 63.546000 Cu 0.0991345 0.318981 1.07568e-17 376 63.546 3.16002e-07 -3.53996 63.546000 Cu 0.237069 0.280192 0.5 358 63.546 2.24993e-08 -3.53996 63.546000 Cu 0.185345 0.31036 0.5 378 63.546 2.39698e-07 -3.53996 63.546000 Cu 0.271551 0.301742 0 380 63.546 3.6394e-07 -3.53996 63.546000 Cu 0.392241 0.314665 4.43456e-18 381 63.546 4.20814e-06 -3.53995 63.546000 Cu 0.357756 0.293122 0.5 382 63.546 5.56483e-07 -3.53996 63.546000 Cu 0.443966 0.284501 0 384 63.546 3.96095e-07 -3.53996 63.546000 Cu 0.47845 0.306046 0.5 387 63.546 6.82755e-06 -3.53995 63.546000 Cu 0.564668 0.297424 0 385 63.546 4.13282e-06 -3.53995 63.546000 Cu 0.650867 0.288811 0.5 391 63.546 6.52054e-07 -3.53995 63.546000 Cu 0.599161 0.318973 0.5 410 63.546 5.95146e-06 -3.53995 63.546000 Cu 0.737071 0.280192 0 389 63.546 5.67053e-08 -3.53996 63.546000 Cu 0.685354 0.310359 1.51914e-17 412 63.546 7.07467e-07 -3.53995 63.546000 Cu 0.771554 0.301743 0.5 413 63.546 1.56183e-07 -3.53996 63.546000 Cu 0.857759 0.293123 4.22482e-18 347 63.546 3.68666e-08 -3.53996 63.546000 Cu 0.978445 0.306054 1.00077e-17 348 63.546 3.58732e-07 -3.53996 63.546000 Cu 0.943965 0.284503 0.5 349 63.546 2.86948e-08 -3.53996 63.546000 Cu 0.892239 0.314674 0.5 350 63.546 6.27114e-07 -3.53996 63.546000 Cu 0.0473943 0.349151 0 373 63.546 3.29842e-06 -3.53996 63.546000 Cu 0.0129211 0.327604 0.5 374 63.546 1.39504e-06 -3.53996 63.546000 Cu 0.133614 0.340526 0.5 379 63.546 2.08561e-06 -3.53995 63.546000 Cu 0.219821 0.33191 3.53566e-18 377 63.546 2.61303e-06 -3.53995 63.546000 Cu 0.306025 0.323289 0.5 383 63.546 4.38204e-06 -3.53995 63.546000 Cu 0.25428 0.353452 0.5 402 63.546 1.76436e-05 -3.53994 63.546000 Cu 0.340507 0.344823 9.46839e-18 404 63.546 3.00087e-05 -3.53995 63.546000 Cu 0.461341 0.357684 0 405 63.546 0.000354033 -3.53985 63.546000 Cu 0.426728 0.3362 0.5 406 63.546 4.55434e-05 -3.53994 63.546000 Cu 0.512976 0.327572 1.12662e-17 408 63.546 3.99403e-05 -3.53993 63.546000 Cu 0.633658 0.340521 0 409 63.546 5.70199e-06 -3.53995 63.546000 Cu 0.547493 0.34912 0.5 411 63.546 3.72208e-05 -3.53993 63.546000 Cu 0.806035 0.323294 2.03151e-17 346 63.546 6.44588e-07 -3.53996 63.546000 Cu 0.719838 0.331912 0.5 414 63.546 1.84201e-06 -3.53996 63.546000 Cu 0.754314 0.353471 1.24048e-17 437 63.546 6.4517e-06 -3.53996 63.546000 Cu 0.840509 0.344851 0.5 370 63.546 8.5011e-06 -3.53996 63.546000 Cu 0.926707 0.33623 2.30717e-18 372 63.546 5.24432e-06 -3.53996 63.546000 Cu 0.961162 0.357784 0.5 375 63.546 1.66874e-05 -3.53996 63.546000 Cu 0.116306 0.392241 9.58824e-18 397 63.546 1.10891e-05 -3.53994 63.546000 Cu 0.0818627 0.37069 0.5 398 63.546 1.40403e-05 -3.53995 63.546000 Cu 0.168074 0.362073 0 400 63.546 5.27085e-06 -3.53994 63.546000 Cu 0.288751 0.374976 1.76184e-17 401 63.546 0.000230549 -3.53994 63.546000 Cu 0.202502 0.383607 0.5 403 63.546 2.04403e-05 -3.53993 63.546000 Cu 0.323173 0.396487 0.5 427 63.546 0.00403871 -3.53945 63.546000 Cu 0.375001 0.366339 0.5 407 63.546 0.000351301 -3.5399 63.546000 Cu 0.409853 0.387719 1.53412e-17 429 63.546 0.00328934 -3.53927 63.546000 Cu 0.495909 0.379245 0.5 431 63.546 0.000241698 -3.53987 63.546000 Cu 0.582013 0.370674 0 433 63.546 3.0287e-05 -3.53993 63.546000 Cu 0.616506 0.392263 0.5 436 63.546 5.62787e-05 -3.53993 63.546000 Cu 0.788774 0.375046 0.5 371 63.546 8.41465e-05 -3.53995 63.546000 Cu 0.823097 0.39669 2.9364e-18 392 63.546 0.000465453 -3.53975 63.546000 Cu 0.702608 0.383663 6.29228e-19 434 63.546 4.49331e-05 -3.53995 63.546000 Cu 0.668142 0.362084 0.5 435 63.546 1.32687e-05 -3.53995 63.546000 Cu 0.874939 0.366427 0 369 63.546 5.53715e-05 -3.53994 63.546000 Cu 0.909333 0.388001 0.5 394 63.546 0.000148525 -3.5399 63.546000 Cu 0.995611 0.379333 0 396 63.546 3.61721e-05 -3.53995 63.546000 Cu 0.0300681 0.400862 0.5 399 63.546 0.000150094 -3.53997 63.546000 Cu 0.0645759 0.422421 1.71989e-17 421 63.546 0.000455255 -3.53997 63.546000 Cu 0.150791 0.413793 0.5 423 63.546 0.000620561 -3.53975 63.546000 Cu 0.185437 0.43549 0 422 63.546 0.029273 -3.53774 63.546000 Cu 0.23691 0.405132 2.69669e-19 425 63.546 0.00256998 -3.53983 63.546000 Cu 0.270681 0.426721 0.5 428 63.546 0.0461634 -3.53228 63.546000 Cu 0.358614 0.417537 1.55809e-18 426 63.546 0.034863 -3.53517 63.546000 Cu 0.444452 0.409346 0.5 432 63.546 0.0021323 -3.53965 63.546000 Cu 0.392597 0.439446 0.5 449 63.546 0.0241183 -3.53868 63.546000 Cu 0.479009 0.430921 0 451 63.546 0.000797527 -3.53975 63.546000 Cu 0.530498 0.400819 0 430 63.546 0.000111187 -3.53988 63.546000 Cu 0.56499 0.422468 0.5 453 63.546 0.000377612 -3.53989 63.546000 Cu 0.651012 0.413888 1.83675e-17 455 63.546 0.00026803 -3.53992 63.546000 Cu 0.771184 0.427115 2.99633e-20 456 63.546 0.00485584 -3.53804 63.546000 Cu 0.737063 0.405278 0.5 457 63.546 0.000791206 -3.53983 63.546000 Cu 0.685723 0.435532 0.5 458 63.546 0.0128159 -3.53831 63.546000 Cu 0.943705 0.409569 0 393 63.546 0.000354884 -3.53979 63.546000 Cu 0.857337 0.418321 0.5 395 63.546 0.00116727 -3.53946 63.546000 Cu 0.891559 0.439956 0 417 63.546 0.00391109 -3.53846 63.546000 Cu 0.978154 0.431033 0.5 419 63.546 0.00189869 -3.53988 63.546000 Cu 0.0128768 0.452568 0 418 63.546 0.0163691 -3.53736 63.546000 Cu 0.0993965 0.443914 0.5 424 63.546 0.0164561 -3.53899 63.546000 Cu 0.0450049 0.473609 0.5 442 63.546 0.282722 -3.51853 63.546000 Cu 0.135725 0.465806 0 443 63.546 0.344379 -3.52646 63.546000 Cu 0.261871 0.475456 3.95515e-18 444 63.546 4.05655 -3.23952 63.546000 Cu 0.218196 0.457722 0.5 445 63.546 0.544352 -3.51081 63.546000 Cu 0.306609 0.446747 1 447 63.546 0.327958 -3.51586 63.546000 Cu 0.427514 0.46093 0 448 63.546 0.026207 -3.53797 63.546000 Cu 0.3424 0.46943 0.5 450 63.546 0.740704 -3.43743 63.546000 Cu 0.63421 0.465594 0.5 219 63.546 0.141957 -3.51524 63.546000 Cu 0.547289 0.474095 0 232 63.546 0.0755729 -3.53135 63.546000 Cu 0.599668 0.444109 2.09743e-17 452 63.546 0.00544671 -3.53972 63.546000 Cu 0.513063 0.452581 0.5 454 63.546 0.00371774 -3.53892 63.546000 Cu 0.751612 0.479965 0.5 1 63.546 4.75259 -3.44493 63.546000 Cu 0.718954 0.458036 3.68548e-18 6 63.546 0.0528559 -3.52949 63.546000 Cu 0.804863 0.448841 0.5 416 63.546 0.0114393 -3.53591 63.546000 Cu 0.83938 0.470732 6.92151e-18 415 63.546 0.0429041 -3.5309 63.546000 Cu 0.925317 0.461171 0.5 420 63.546 0.0413007 -3.53547 63.546000 Cu 0.0824022 0.497138 0 441 63.546 4.10149 -3.05482 63.546000 Cu 0.155871 0.487799 0.5 446 63.546 8.77439 -3.34557 63.546000 Cu 0.21457 0.502677 0 18 63.546 9.45955 -3.42089 63.546000 Cu 0.30589 0.508312 0.5 20 63.546 7.06045 -3.21545 63.546000 Cu 0.459751 0.483176 0.5 233 63.546 2.5865 -3.41178 63.546000 Cu 0.372056 0.490637 0 459 63.546 10.6975 -3.4207 63.546000 Cu 0.496835 0.504273 0 4 63.546 11.068 -3.44065 63.546000 Cu 0.582862 0.494134 0.5 7 63.546 8.14429 -3.0026 63.546000 Cu 0.667322 0.489879 0 230 63.546 9.45146 -3.36296 63.546000 Cu 0.784391 0.501887 0 438 63.546 11.0592 -3.20991 63.546000 Cu 0.998928 0.5042 0.5 2 63.546 11.4958 -3.46922 63.546000 Cu 0.875106 0.491067 0.5 439 63.546 5.3281 -3.37957 63.546000 Cu 0.963284 0.483357 1.49816e-19 440 63.546 2.2041 -3.43031 63.546000 Cu 0.0217115 0.55548 0 12 63.546 0.0527407 -3.53538 63.546000 Cu 0.0560224 0.533404 0.5 13 63.546 6.15779 -3.33693 63.546000 Cu 0.141341 0.542183 0 15 63.546 5.02429 -3.44432 63.546000 Cu 0.173591 0.520734 0.5 3 63.546 3.02952 -3.28022 63.546000 Cu 0.263561 0.53075 4.82109e-17 19 63.546 0.152903 -3.50797 63.546000 Cu 0.226533 0.551247 0.5 41 63.546 0.0489543 -3.53513 63.546000 Cu 0.38709 0.520864 0 21 63.546 8.9877 -3.47327 63.546000 Cu 0.437367 0.548733 0 22 63.546 0.270826 -3.50927 63.546000 Cu 0.472393 0.525346 0.5 23 63.546 3.57489 -3.33716 63.546000 Cu 0.347603 0.539614 0.5 24 63.546 0.255372 -3.52259 63.546000 Cu 0.557502 0.533218 0 25 63.546 6.51249 -3.32211 63.546000 Cu 0.643541 0.541575 0.5 27 63.546 6.14326 -3.43524 63.546000 Cu 0.523312 0.555302 0.5 28 63.546 0.0594879 -3.53526 63.546000 Cu 0.678629 0.520968 2.99633e-20 5 63.546 14.8758 -3.15731 63.546000 Cu 0.766515 0.526219 0.5 10 63.546 4.05388 -3.37401 63.546000 Cu 0.728812 0.550405 1.82776e-17 29 63.546 0.105909 -3.51278 63.546000 Cu 0.813316 0.559732 0.5 31 63.546 0.100446 -3.51778 63.546000 Cu 0.88941 0.520708 0.5 9 63.546 10.2091 -3.24751 63.546000 Cu 0.846458 0.538822 0 8 63.546 0.694241 -3.43993 63.546000 Cu 0.971661 0.525669 2.12739e-17 11 63.546 3.29441 -3.34399 63.546000 Cu 0.936827 0.54868 0.5 14 63.546 0.367263 -3.50719 63.546000 Cu 0.106946 0.564197 0.5 17 63.546 0.0068927 -3.5383 63.546000 Cu 0.0732677 0.586034 1.70791e-17 37 63.546 0.0047062 -3.53893 63.546000 Cu 0.159175 0.594635 0.5 39 63.546 0.00153023 -3.5396 63.546000 Cu 0.193092 0.572951 0 16 63.546 0.00901282 -3.53859 63.546000 Cu 0.314467 0.560909 0 42 63.546 0.0275808 -3.53749 63.546000 Cu 0.27959 0.581837 0.5 45 63.546 0.00702276 -3.53829 63.546000 Cu 0.366723 0.590689 0 43 63.546 0.00265377 -3.53927 63.546000 Cu 0.401543 0.569273 0.5 44 63.546 0.0257291 -3.53685 63.546000 Cu 0.488898 0.577909 0 46 63.546 0.0458914 -3.53335 63.546000 Cu 0.453138 0.599236 0.5 49 63.546 0.00294825 -3.53973 63.546000 Cu 0.608263 0.563927 0 26 63.546 0.00454984 -3.53747 63.546000 Cu 0.573913 0.58592 0.5 48 63.546 0.00503534 -3.53848 63.546000 Cu 0.659478 0.594467 0 50 63.546 0.00186785 -3.5391 63.546000 Cu 0.779316 0.581436 0 30 63.546 0.00570125 -3.5384 63.546000 Cu 0.693597 0.57244 0.5 32 63.546 0.00870162 -3.53722 63.546000 Cu 0.900046 0.568867 0 33 63.546 0.0286967 -3.53614 63.546000 Cu 0.952385 0.599089 2.07945e-17 34 63.546 0.00296177 -3.53961 63.546000 Cu 0.987875 0.577955 0.5 35 63.546 0.0593977 -3.5337 63.546000 Cu 0.865748 0.590268 0.5 36 63.546 0.00367297 -3.53931 63.546000 Cu 0.124989 0.616298 0 38 63.546 0.000482473 -3.53985 63.546000 Cu 0.0390345 0.607853 0.5 40 63.546 0.0057551 -3.53934 63.546000 Cu 0.00423664 0.629289 1.02175e-17 58 63.546 0.000310875 -3.53995 63.546000 Cu 0.0905919 0.637947 0.5 60 63.546 0.000581148 -3.53991 63.546000 Cu 0.245401 0.603331 0 64 63.546 0.00127908 -3.53976 63.546000 Cu 0.297317 0.633565 3.33791e-17 65 63.546 0.000170525 -3.53995 63.546000 Cu 0.331791 0.612033 0.5 66 63.546 0.000866512 -3.53989 63.546000 Cu 0.211102 0.624917 0.5 67 63.546 0.000198635 -3.53992 63.546000 Cu 0.418228 0.620744 0 68 63.546 0.000311572 -3.5399 63.546000 Cu 0.539375 0.607845 1.49816e-17 47 63.546 0.00508879 -3.53917 63.546000 Cu 0.625148 0.616261 0.5 53 63.546 0.000811101 -3.53973 63.546000 Cu 0.504464 0.629353 0.5 70 63.546 0.0004213 -3.53993 63.546000 Cu 0.590682 0.637951 2.23825e-17 72 63.546 0.00061234 -3.53988 63.546000 Cu 0.711139 0.624859 0 51 63.546 0.000317832 -3.5398 63.546000 Cu 0.74531 0.603125 0.5 52 63.546 0.00137134 -3.53919 63.546000 Cu 0.831536 0.611855 0 54 63.546 0.000571486 -3.53971 63.546000 Cu 0.797267 0.633489 0.5 57 63.546 0.000193425 -3.53984 63.546000 Cu 0.917876 0.620585 0.5 56 63.546 0.00044893 -3.53988 63.546000 Cu 0.0560148 0.659466 0 59 63.546 2.88675e-05 -3.53997 63.546000 Cu 0.142265 0.668096 0.5 63 63.546 5.67912e-05 -3.53996 63.546000 Cu 0.176722 0.646513 0 62 63.546 5.29297e-05 -3.53995 63.546000 Cu 0.228447 0.6767 0 88 63.546 6.33691e-06 -3.53996 63.546000 Cu 0.262896 0.655133 0.5 89 63.546 2.67262e-05 -3.53995 63.546000 Cu 0.469851 0.650876 0 69 63.546 4.37209e-05 -3.53995 63.546000 Cu 0.383568 0.642223 0.5 71 63.546 0.000108742 -3.53996 63.546000 Cu 0.349105 0.663765 2.72366e-17 90 63.546 2.129e-05 -3.53996 63.546000 Cu 0.435325 0.672397 0.5 92 63.546 1.33902e-05 -3.53996 63.546000 Cu 0.64229 0.6681 0 73 63.546 6.85337e-05 -3.53995 63.546000 Cu 0.556075 0.659488 0.5 75 63.546 4.50399e-05 -3.53995 63.546000 Cu 0.676762 0.646505 0.5 74 63.546 0.000118151 -3.53994 63.546000 Cu 0.762908 0.655115 0 76 63.546 5.61038e-05 -3.53994 63.546000 Cu 0.728459 0.676698 0.5 79 63.546 1.47348e-05 -3.53996 63.546000 Cu 0.88349 0.642157 0 55 63.546 0.000109967 -3.53992 63.546000 Cu 0.969754 0.650821 0.5 61 63.546 5.39663e-05 -3.53996 63.546000 Cu 0.849093 0.663741 0.5 78 63.546 3.34876e-05 -3.53995 63.546000 Cu 0.935306 0.672378 2.88246e-17 80 63.546 1.51081e-05 -3.53996 63.546000 Cu 0.0215338 0.681011 0.5 82 63.546 5.04829e-06 -3.53996 63.546000 Cu 0.107754 0.689637 0 84 63.546 2.46775e-06 -3.53996 63.546000 Cu 0.159482 0.719807 8.65938e-18 85 63.546 1.72651e-07 -3.53996 63.546000 Cu 0.0732722 0.711186 0.5 87 63.546 3.43274e-07 -3.53996 63.546000 Cu 0.193972 0.69826 0.5 86 63.546 4.44963e-06 -3.53996 63.546000 Cu 0.314645 0.685321 0.5 93 63.546 2.93602e-06 -3.53996 63.546000 Cu 0.280172 0.706875 8.50956e-18 111 63.546 5.61119e-07 -3.53996 63.546000 Cu 0.400854 0.693944 3.26599e-18 91 63.546 1.92677e-06 -3.53996 63.546000 Cu 0.487064 0.702567 0.5 97 63.546 1.30891e-06 -3.53996 63.546000 Cu 0.366377 0.715496 0.5 113 63.546 2.17212e-07 -3.53996 63.546000 Cu 0.521559 0.681026 0 94 63.546 4.39803e-06 -3.53996 63.546000 Cu 0.573278 0.71119 0 95 63.546 4.03288e-07 -3.53996 63.546000 Cu 0.607768 0.689643 0.5 96 63.546 4.41617e-06 -3.53996 63.546000 Cu 0.659484 0.719808 0.5 101 63.546 3.57047e-07 -3.53996 63.546000 Cu 0.814649 0.685316 0 77 63.546 7.54511e-06 -3.53996 63.546000 Cu 0.693978 0.698261 0 98 63.546 6.082e-06 -3.53996 63.546000 Cu 0.780174 0.706875 0.5 100 63.546 1.29033e-06 -3.53996 63.546000 Cu 0.98706 0.702563 7.85037e-18 81 63.546 1.33724e-06 -3.53996 63.546000 Cu 0.90085 0.693938 0.5 83 63.546 3.7778e-06 -3.53996 63.546000 Cu 0.866378 0.715495 0 102 63.546 6.96569e-07 -3.53996 63.546000 Cu 0.0387914 0.732736 0 106 63.546 7.81205e-08 -3.53996 63.546000 Cu 0.124999 0.741357 0.5 108 63.546 1.34621e-08 -3.53996 63.546000 Cu 0.00430987 0.754286 0.5 109 63.546 4.98135e-08 -3.53996 63.546000 Cu 0.331896 0.737046 0 112 63.546 7.7157e-08 -3.53996 63.546000 Cu 0.245691 0.728428 0.5 114 63.546 2.69599e-07 -3.53996 63.546000 Cu 0.211206 0.749977 8.62942e-18 134 63.546 2.13651e-08 -3.53996 63.546000 Cu 0.297413 0.758597 0.5 136 63.546 5.83132e-08 -3.53996 63.546000 Cu 0.452585 0.724116 1.01276e-17 115 63.546 1.05109e-07 -3.53996 63.546000 Cu 0.418103 0.745666 0.5 118 63.546 7.38451e-08 -3.53996 63.546000 Cu 0.50431 0.754286 0 116 63.546 1.78474e-08 -3.53996 63.546000 Cu 0.538792 0.732737 0.5 117 63.546 6.89084e-08 -3.53996 63.546000 Cu 0.625001 0.741357 2.01353e-17 119 63.546 3.54047e-08 -3.53996 63.546000 Cu 0.745692 0.728428 0 99 63.546 3.98242e-07 -3.53996 63.546000 Cu 0.831896 0.737046 0.5 105 63.546 1.09781e-07 -3.53996 63.546000 Cu 0.711207 0.749977 0.5 121 63.546 3.11108e-08 -3.53996 63.546000 Cu 0.797414 0.758597 1.16557e-17 123 63.546 5.84085e-08 -3.53996 63.546000 Cu 0.918103 0.745666 2.13338e-17 103 63.546 1.51206e-07 -3.53996 63.546000 Cu 0.952584 0.724115 0.5 104 63.546 2.94972e-07 -3.53996 63.546000 Cu 0.0905177 0.762906 0 107 63.546 3.17292e-08 -3.53996 63.546000 Cu 0.0560351 0.784455 0.5 129 63.546 4.74798e-07 -3.53996 63.546000 Cu 0.142245 0.793077 0 131 63.546 6.19695e-07 -3.53996 63.546000 Cu 0.176725 0.771527 0.5 110 63.546 4.17474e-08 -3.53996 63.546000 Cu 0.26293 0.780146 2.29519e-17 135 63.546 7.92881e-08 -3.53996 63.546000 Cu 0.383618 0.767215 4.04504e-18 137 63.546 4.08396e-07 -3.53996 63.546000 Cu 0.435332 0.797378 1.90566e-17 138 63.546 5.27476e-06 -3.53995 63.546000 Cu 0.469828 0.775835 0.5 139 63.546 7.08528e-07 -3.53996 63.546000 Cu 0.349133 0.788765 0.5 140 63.546 6.79703e-07 -3.53996 63.546000 Cu 0.590518 0.762907 0.5 122 63.546 1.91046e-08 -3.53996 63.546000 Cu 0.556035 0.784455 2.96636e-18 141 63.546 4.58887e-07 -3.53996 63.546000 Cu 0.642245 0.793077 0.5 143 63.546 6.12376e-07 -3.53996 63.546000 Cu 0.676725 0.771527 7.341e-18 120 63.546 5.51309e-08 -3.53996 63.546000 Cu 0.76293 0.780146 0.5 126 63.546 7.9198e-08 -3.53996 63.546000 Cu 0.849134 0.788765 1.09965e-17 124 63.546 6.7466e-07 -3.53996 63.546000 Cu 0.883618 0.767215 0.5 125 63.546 4.03149e-07 -3.53996 63.546000 Cu 0.969828 0.775835 0 127 63.546 7.49205e-07 -3.53996 63.546000 Cu 0.935332 0.797378 0.5 130 63.546 5.27145e-06 -3.53995 63.546000 Cu 0.0215516 0.806 2.84651e-18 128 63.546 6.94616e-06 -3.53995 63.546000 Cu 0.107765 0.814622 0.5 133 63.546 5.96355e-06 -3.53995 63.546000 Cu 0.0732783 0.836155 8.77923e-18 153 63.546 5.24887e-05 -3.53994 63.546000 Cu 0.193982 0.823248 0 132 63.546 7.50906e-06 -3.53995 63.546000 Cu 0.228451 0.801697 0.5 157 63.546 7.83322e-07 -3.53996 63.546000 Cu 0.31465 0.810315 0 158 63.546 1.15154e-06 -3.53995 63.546000 Cu 0.280183 0.831872 0.5 161 63.546 8.75743e-06 -3.53995 63.546000 Cu 0.400842 0.818929 0.5 160 63.546 7.20145e-06 -3.53995 63.546000 Cu 0.487023 0.827526 0 162 63.546 5.60793e-05 -3.53993 63.546000 Cu 0.607765 0.814622 0 142 63.546 5.95732e-06 -3.53995 63.546000 Cu 0.521552 0.806 0.5 144 63.546 6.92542e-06 -3.53995 63.546000 Cu 0.573278 0.836155 0.5 164 63.546 5.24809e-05 -3.53994 63.546000 Cu 0.728451 0.801698 3.73342e-17 145 63.546 7.92086e-07 -3.53996 63.546000 Cu 0.780183 0.831872 1.03074e-17 146 63.546 8.76132e-06 -3.53995 63.546000 Cu 0.81465 0.810315 0.5 147 63.546 1.1513e-06 -3.53995 63.546000 Cu 0.693983 0.823248 0.5 148 63.546 7.50632e-06 -3.53995 63.546000 Cu 0.900842 0.818929 2.3671e-18 149 63.546 7.19875e-06 -3.53995 63.546000 Cu 0.987023 0.827526 0.5 151 63.546 5.60783e-05 -3.53993 63.546000 Cu 0.125016 0.866297 0 154 63.546 0.000453538 -3.53989 63.546000 Cu 0.159514 0.844787 0.5 155 63.546 5.36529e-05 -3.53995 63.546000 Cu 0.0386555 0.857635 0.5 156 63.546 0.000529671 -3.53982 63.546000 Cu 0.00409286 0.879207 4.9739e-18 174 63.546 0.00044311 -3.53982 63.546000 Cu 0.24575 0.853429 1.44423e-17 180 63.546 5.9826e-05 -3.53994 63.546000 Cu 0.331932 0.862056 0.5 182 63.546 6.49729e-05 -3.53993 63.546000 Cu 0.211307 0.874959 0.5 183 63.546 0.000437879 -3.53994 63.546000 Cu 0.366361 0.840482 0 159 63.546 1.12565e-05 -3.53995 63.546000 Cu 0.452515 0.84908 0.5 165 63.546 6.01367e-05 -3.53992 63.546000 Cu 0.418037 0.870647 0 184 63.546 9.23471e-05 -3.53991 63.546000 Cu 0.538655 0.857635 7.37096e-18 163 63.546 0.000529671 -3.53982 63.546000 Cu 0.659514 0.844787 0 166 63.546 5.36514e-05 -3.53995 63.546000 Cu 0.625016 0.866297 0.5 169 63.546 0.000453535 -3.53989 63.546000 Cu 0.504093 0.879207 0.5 186 63.546 0.000443111 -3.53982 63.546000 Cu 0.711307 0.874959 2.15735e-18 167 63.546 0.000437879 -3.53994 63.546000 Cu 0.74575 0.853429 0.5 168 63.546 5.98249e-05 -3.53994 63.546000 Cu 0.831932 0.862056 0 170 63.546 6.49743e-05 -3.53993 63.546000 Cu 0.952515 0.84908 3.86526e-18 150 63.546 6.01358e-05 -3.53992 63.546000 Cu 0.866361 0.840482 0.5 152 63.546 1.12565e-05 -3.53995 63.546000 Cu 0.918037 0.870647 0.5 172 63.546 9.23471e-05 -3.53991 63.546000 Cu 0.0553967 0.9093 5.78291e-18 175 63.546 0.00356386 -3.53943 63.546000 Cu 0.090094 0.887654 0.5 176 63.546 0.00481907 -3.53894 63.546000 Cu 0.141123 0.9174 0.5 179 63.546 0.048303 -3.53336 63.546000 Cu 0.176842 0.896441 0 178 63.546 0.00508081 -3.53934 63.546000 Cu 0.297588 0.883632 0 181 63.546 0.000353698 -3.53988 63.546000 Cu 0.263241 0.905148 0.5 205 63.546 0.00412626 -3.53968 63.546000 Cu 0.469554 0.900803 1.62401e-17 185 63.546 0.000480756 -3.53977 63.546000 Cu 0.383665 0.892274 0.5 187 63.546 0.000482612 -3.53983 63.546000 Cu 0.349434 0.913925 0 206 63.546 0.00167719 -3.53954 63.546000 Cu 0.590094 0.887654 2.98434e-17 188 63.546 0.00481907 -3.53894 63.546000 Cu 0.641123 0.9174 1.51015e-17 189 63.546 0.048303 -3.53336 63.546000 Cu 0.555397 0.9093 0.5 191 63.546 0.00356386 -3.53943 63.546000 Cu 0.797588 0.883632 0.5 173 63.546 0.000353698 -3.53988 63.546000 Cu 0.676842 0.896441 0.5 190 63.546 0.00508081 -3.53934 63.546000 Cu 0.763241 0.905148 4.43456e-18 192 63.546 0.00412626 -3.53968 63.546000 Cu 0.883665 0.892274 0 171 63.546 0.000482612 -3.53983 63.546000 Cu 0.969554 0.900803 0.5 177 63.546 0.000480756 -3.53977 63.546000 Cu 0.849434 0.913925 0.5 194 63.546 0.00167719 -3.53954 63.546000 Cu 0.0207519 0.930939 0.5 198 63.546 0.00360807 -3.53898 63.546000 Cu 0.10702 0.93933 3.30495e-17 200 63.546 0.0308359 -3.5377 63.546000 Cu 0.193193 0.946442 0.5 202 63.546 0.387668 -3.51368 63.546000 Cu 0.229394 0.926624 0 204 63.546 0.0489974 -3.53192 63.546000 Cu 0.314923 0.935582 0.5 209 63.546 0.032545 -3.53726 63.546000 Cu 0.281225 0.957452 2.47197e-17 224 63.546 0.409687 -3.52015 63.546000 Cu 0.40071 0.944291 7.55074e-18 207 63.546 0.00402085 -3.53889 63.546000 Cu 0.435189 0.922564 0.5 208 63.546 0.00156417 -3.53957 63.546000 Cu 0.486002 0.952984 0.5 213 63.546 0.0230933 -3.53863 63.546000 Cu 0.520752 0.930939 7.79045e-18 210 63.546 0.00360807 -3.53898 63.546000 Cu 0.60702 0.93933 0.5 212 63.546 0.0308359 -3.5377 63.546000 Cu 0.814923 0.935582 1.93263e-17 193 63.546 0.032545 -3.53726 63.546000 Cu 0.729394 0.926624 0.5 195 63.546 0.0489974 -3.53192 63.546000 Cu 0.693193 0.946442 9.35453e-17 214 63.546 0.387668 -3.51368 63.546000 Cu 0.781225 0.957452 0.5 216 63.546 0.409687 -3.52015 63.546000 Cu 0.935189 0.922564 0 196 63.546 0.00156417 -3.53957 63.546000 Cu 0.986002 0.952984 1.68693e-17 197 63.546 0.0230933 -3.53863 63.546000 Cu 0.90071 0.944291 0.5 199 63.546 0.00402085 -3.53889 63.546000 Cu 0.157027 0.969162 4.9739e-18 201 63.546 0.728719 -3.43894 63.546000 Cu 0.0726916 0.960722 0.5 203 63.546 0.0314758 -3.53715 63.546000 Cu 0.0392176 0.983179 0 222 63.546 4.02735 -3.32452 63.546000 Cu 0.128124 0.990404 0.5 223 63.546 7.36901 -3.41692 63.546000 Cu 0.237138 0.975092 0.5 227 63.546 4.06886 -3.2419 63.546000 Cu 0.340167 0.987422 4.13493e-18 225 63.546 6.97404 -3.1537 63.546000 Cu 0.365196 0.966375 0.5 226 63.546 3.87017 -3.43733 63.546000 Cu 0.453598 0.974498 0 228 63.546 3.61582 -3.37652 63.546000 Cu 0.572692 0.960722 3.66151e-17 211 63.546 0.0314758 -3.53715 63.546000 Cu 0.657027 0.969162 0.5 217 63.546 0.728719 -3.43894 63.546000 Cu 0.539218 0.983179 0.5 229 63.546 4.02735 -3.32452 63.546000 Cu 0.628124 0.990404 5.5432e-18 231 63.546 7.36901 -3.41692 63.546000 Cu 0.737138 0.975092 2.39706e-19 215 63.546 4.06886 -3.2419 63.546000 Cu 0.840167 0.987422 0.5 221 63.546 6.97404 -3.1537 63.546000 Cu 0.865196 0.966375 0 218 63.546 3.87017 -3.43733 63.546000 Cu 0.953598 0.974498 0.5 220 63.546 3.61582 -3.37652