Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.288 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 73.114 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.59379 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 0.0807629 0.0461229 1 225 63.546 0.58358 -3.41749 63.546000 Cu 0.0527655 0.0163922 0.5 226 63.546 7.77884 -3.37944 63.546000 Cu 0.15293 0.0144187 1.51085e-16 228 63.546 2.25619 -3.48211 63.546000 Cu 0.168119 0.0408515 0.5 231 63.546 0.399361 -3.45664 63.546000 Cu 0.262524 0.0389799 3.74093e-16 229 63.546 0.534391 -3.48358 63.546000 Cu 0.253828 0.0144559 0.5 230 63.546 1.09924 -3.49155 63.546000 Cu 0.349969 0.0144611 1.31862e-15 232 63.546 6.59575 -3.21816 63.546000 Cu 0.46553 0.0308924 1 233 63.546 8.75245 -3.26568 63.546000 Cu 0.366836 0.0356304 0.5 235 63.546 3.55765 -3.41988 63.546000 Cu 0.65293 0.0144187 1 210 63.546 2.25619 -3.48211 63.546000 Cu 0.552766 0.0163922 0.5 211 63.546 7.77884 -3.37944 63.546000 Cu 0.580763 0.0461229 1 216 63.546 0.58358 -3.41749 63.546000 Cu 0.668119 0.0408515 0.5 218 63.546 0.399361 -3.45664 63.546000 Cu 0.753828 0.0144559 0.5 213 63.546 1.09924 -3.49155 63.546000 Cu 0.762524 0.0389799 1 220 63.546 0.534391 -3.48358 63.546000 Cu 0.849969 0.0144611 1 212 63.546 6.59575 -3.21816 63.546000 Cu 0.866836 0.0356304 0.5 222 63.546 3.55765 -3.41988 63.546000 Cu 0.96553 0.0308924 1 224 63.546 8.75245 -3.26568 63.546000 Cu 0.114625 0.0961303 1 246 63.546 0.00784575 -3.51242 63.546000 Cu 0.097505 0.071567 0.5 247 63.546 0.070251 -3.49754 63.546000 Cu 0.189698 0.0671938 1.21399e-16 249 63.546 0.0815431 -3.48751 63.546000 Cu 0.21017 0.0915653 0.5 252 63.546 0.0176403 -3.50881 63.546000 Cu 0.00128986 0.0763742 1.24416e-16 245 63.546 0.0453724 -3.52027 63.546000 Cu 0.0188891 0.100548 0.5 248 63.546 0.00666793 -3.52015 63.546000 Cu 0.305707 0.0866134 4.92837e-16 250 63.546 0.00808617 -3.51523 63.546000 Cu 0.28398 0.0626072 0.5 251 63.546 0.111095 -3.51307 63.546000 Cu 0.382612 0.0583037 1.20313e-16 253 63.546 0.0613963 -3.50724 63.546000 Cu 0.484867 0.053037 0.5 255 63.546 0.517352 -3.44536 63.546000 Cu 0.403035 0.0814867 0.5 256 63.546 0.0205489 -3.52144 63.546000 Cu 0.50129 0.0763742 1 254 63.546 0.0453724 -3.52027 63.546000 Cu 0.518889 0.100548 0.5 276 63.546 0.00666793 -3.52015 63.546000 Cu 0.689698 0.0671938 1 217 63.546 0.0815431 -3.48751 63.546000 Cu 0.597505 0.071567 0.5 219 63.546 0.070251 -3.49754 63.546000 Cu 0.614625 0.0961303 5.11663e-17 237 63.546 0.00784575 -3.51242 63.546000 Cu 0.71017 0.0915653 0.5 239 63.546 0.0176403 -3.50881 63.546000 Cu 0.882612 0.0583037 1 221 63.546 0.0613963 -3.50724 63.546000 Cu 0.78398 0.0626072 0.5 223 63.546 0.111095 -3.51307 63.546000 Cu 0.984867 0.053037 0.5 227 63.546 0.517352 -3.44536 63.546000 Cu 0.805707 0.0866134 1 241 63.546 0.00808617 -3.51523 63.546000 Cu 0.903035 0.0814867 0.5 243 63.546 0.0205489 -3.52144 63.546000 Cu 0.0375835 0.124866 1.56878e-18 267 63.546 0.000939839 -3.51638 63.546000 Cu 0.152982 0.144271 3.69869e-16 268 63.546 0.00050881 -3.5167 63.546000 Cu 0.133471 0.12025 0.5 269 63.546 0.00290751 -3.51536 63.546000 Cu 0.0568569 0.14904 0.5 270 63.546 0.00055393 -3.51605 63.546000 Cu 0.22982 0.115493 1 271 63.546 0.00194208 -3.51516 63.546000 Cu 0.24936 0.139421 0.5 274 63.546 0.000220577 -3.51751 63.546000 Cu 0.345772 0.134492 5.11663e-17 272 63.546 0.000943602 -3.51782 63.546000 Cu 0.326344 0.110489 0.5 273 63.546 0.00163839 -3.51676 63.546000 Cu 0.422715 0.105389 1.15124e-16 275 63.546 0.00699023 -3.5203 63.546000 Cu 0.441855 0.12959 0.5 277 63.546 0.00119128 -3.51755 63.546000 Cu 0.460968 0.153779 1 296 63.546 0.000147928 -3.51652 63.546000 Cu 0.537584 0.124866 1 236 63.546 0.000939839 -3.51638 63.546000 Cu 0.72982 0.115493 2.46057e-16 238 63.546 0.00194208 -3.51516 63.546000 Cu 0.633471 0.12025 0.5 240 63.546 0.00290751 -3.51536 63.546000 Cu 0.556857 0.14904 0.5 258 63.546 0.00055393 -3.51605 63.546000 Cu 0.652982 0.144271 1.22123e-16 259 63.546 0.00050881 -3.5167 63.546000 Cu 0.74936 0.139421 0.5 261 63.546 0.000220577 -3.51751 63.546000 Cu 0.922715 0.105389 1 242 63.546 0.00699023 -3.5203 63.546000 Cu 0.826344 0.110489 0.5 244 63.546 0.00163839 -3.51676 63.546000 Cu 0.845772 0.134492 1 263 63.546 0.000943602 -3.51782 63.546000 Cu 0.960968 0.153779 1 264 63.546 0.000147928 -3.51652 63.546000 Cu 0.941855 0.12959 0.5 265 63.546 0.00119128 -3.51755 63.546000 Cu 0.0763756 0.17313 1 288 63.546 0.000114751 -3.51669 63.546000 Cu 0.192036 0.192375 1 289 63.546 3.07765e-05 -3.51727 63.546000 Cu 0.172545 0.168301 0.5 290 63.546 5.08124e-05 -3.51724 63.546000 Cu 0.0958694 0.197196 0.5 291 63.546 2.03214e-05 -3.51698 63.546000 Cu 0.268784 0.163444 1 292 63.546 0.000136733 -3.51769 63.546000 Cu 0.384233 0.182699 1 293 63.546 4.22158e-05 -3.51704 63.546000 Cu 0.364995 0.15858 0.5 294 63.546 0.000305595 -3.51749 63.546000 Cu 0.288177 0.187526 0.5 295 63.546 5.40634e-05 -3.51732 63.546000 Cu 0.4803 0.177916 0.5 297 63.546 8.18801e-05 -3.51665 63.546000 Cu 0.40358 0.206807 0.5 316 63.546 2.53803e-05 -3.51686 63.546000 Cu 0.499682 0.202001 3.16772e-16 318 63.546 2.18917e-05 -3.51684 63.546000 Cu 0.576376 0.17313 1 257 63.546 0.000114751 -3.51669 63.546000 Cu 0.672545 0.168301 0.5 262 63.546 5.08124e-05 -3.51724 63.546000 Cu 0.595869 0.197196 0.5 279 63.546 2.03214e-05 -3.51698 63.546000 Cu 0.692036 0.192375 1 280 63.546 3.07765e-05 -3.51727 63.546000 Cu 0.768784 0.163444 5.11663e-17 260 63.546 0.000136733 -3.51769 63.546000 Cu 0.864995 0.15858 0.5 266 63.546 0.000305595 -3.51749 63.546000 Cu 0.788177 0.187526 0.5 282 63.546 5.40634e-05 -3.51732 63.546000 Cu 0.884233 0.182699 3.67697e-16 284 63.546 4.22158e-05 -3.51704 63.546000 Cu 0.999682 0.202001 1 285 63.546 2.18917e-05 -3.51684 63.546000 Cu 0.9803 0.177916 0.5 286 63.546 8.18801e-05 -3.51665 63.546000 Cu 0.90358 0.206807 0.5 287 63.546 2.53803e-05 -3.51686 63.546000 Cu 0.038548 0.250173 5.11663e-17 307 63.546 1.47045e-05 -3.51714 63.546000 Cu 0.115237 0.221267 1 310 63.546 1.38606e-05 -3.51713 63.546000 Cu 0.230767 0.240531 1 311 63.546 1.59544e-05 -3.51702 63.546000 Cu 0.211428 0.216448 0.5 312 63.546 1.31847e-05 -3.51713 63.546000 Cu 0.134683 0.245347 0.5 313 63.546 3.977e-06 -3.51713 63.546000 Cu 0.0191229 0.226086 0.5 308 63.546 3.66515e-06 -3.51705 63.546000 Cu 0.307552 0.211627 6.16288e-16 314 63.546 1.75359e-05 -3.51704 63.546000 Cu 0.423039 0.230898 6.0229e-16 315 63.546 1.08999e-05 -3.51693 63.546000 Cu 0.326888 0.235715 0.5 317 63.546 1.35999e-05 -3.51694 63.546000 Cu 0.346326 0.259786 1 336 63.546 2.59428e-05 -3.5171 63.546000 Cu 0.442414 0.254983 0.5 338 63.546 3.27791e-06 -3.51709 63.546000 Cu 0.519123 0.226086 0.5 319 63.546 3.66515e-06 -3.51705 63.546000 Cu 0.615237 0.221267 1 278 63.546 1.38606e-05 -3.51713 63.546000 Cu 0.711428 0.216448 0.5 283 63.546 1.31847e-05 -3.51713 63.546000 Cu 0.538548 0.250173 1.0016e-17 298 63.546 1.47045e-05 -3.51714 63.546000 Cu 0.634683 0.245347 0.5 300 63.546 3.977e-06 -3.51713 63.546000 Cu 0.730767 0.240531 1 302 63.546 1.59544e-05 -3.51702 63.546000 Cu 0.807552 0.211627 1 281 63.546 1.75359e-05 -3.51704 63.546000 Cu 0.846326 0.259786 1 303 63.546 2.59428e-05 -3.5171 63.546000 Cu 0.826888 0.235715 0.5 304 63.546 1.35999e-05 -3.51694 63.546000 Cu 0.923039 0.230898 1 306 63.546 1.08999e-05 -3.51693 63.546000 Cu 0.942414 0.254983 0.5 309 63.546 3.27791e-06 -3.51709 63.546000 Cu 0.0772429 0.298301 7.65081e-17 329 63.546 4.42527e-05 -3.51691 63.546000 Cu 0.0579336 0.274238 0.5 330 63.546 1.32292e-05 -3.51702 63.546000 Cu 0.154092 0.269427 6.28838e-16 332 63.546 2.65925e-05 -3.51704 63.546000 Cu 0.17338 0.2935 0.5 335 63.546 3.15844e-05 -3.51701 63.546000 Cu 0.269553 0.288691 1 333 63.546 6.50017e-05 -3.51713 63.546000 Cu 0.250227 0.264611 0.5 334 63.546 2.92937e-05 -3.51709 63.546000 Cu 0.461795 0.279063 1.14279e-16 337 63.546 3.54608e-05 -3.51709 63.546000 Cu 0.36567 0.283883 0.5 339 63.546 6.51251e-05 -3.51713 63.546000 Cu 0.288661 0.312769 0.5 355 63.546 3.6431e-05 -3.5171 63.546000 Cu 0.38486 0.307943 1 357 63.546 2.04258e-05 -3.51699 63.546000 Cu 0.481071 0.303116 0.5 359 63.546 2.8987e-05 -3.51692 63.546000 Cu 0.654092 0.269427 1 299 63.546 2.65925e-05 -3.51704 63.546000 Cu 0.557934 0.274238 0.5 301 63.546 1.32292e-05 -3.51702 63.546000 Cu 0.577243 0.298301 1.20675e-19 320 63.546 4.42527e-05 -3.51691 63.546000 Cu 0.67338 0.2935 0.5 322 63.546 3.15844e-05 -3.51701 63.546000 Cu 0.750227 0.264611 0.5 305 63.546 2.92937e-05 -3.51709 63.546000 Cu 0.769553 0.288691 1.21158e-16 324 63.546 6.50017e-05 -3.51713 63.546000 Cu 0.88486 0.307943 3.66249e-16 325 63.546 2.04258e-05 -3.51699 63.546000 Cu 0.86567 0.283883 0.5 326 63.546 6.51251e-05 -3.51713 63.546000 Cu 0.788661 0.312769 0.5 327 63.546 3.6431e-05 -3.5171 63.546000 Cu 0.961795 0.279063 1.93563e-16 328 63.546 3.54608e-05 -3.51709 63.546000 Cu 0.981071 0.303116 0.5 331 63.546 2.8987e-05 -3.51692 63.546000 Cu 0.115419 0.346437 1 350 63.546 1.78213e-05 -3.5169 63.546000 Cu 0.096405 0.322364 0.5 351 63.546 4.5121e-05 -3.51686 63.546000 Cu 0.192536 0.317577 1 353 63.546 2.96305e-05 -3.51697 63.546000 Cu 0.211553 0.341649 0.5 356 63.546 8.089e-05 -3.51715 63.546000 Cu 0.23055 0.365702 1.23209e-16 375 63.546 0.000167295 -3.51749 63.546000 Cu 0.000218646 0.32716 2.18181e-16 349 63.546 4.06506e-05 -3.51685 63.546000 Cu 0.0192961 0.351211 0.5 352 63.546 9.35472e-05 -3.51664 63.546000 Cu 0.307774 0.336822 1 354 63.546 3.92345e-05 -3.51717 63.546000 Cu 0.404023 0.331981 0.5 360 63.546 1.85417e-05 -3.51697 63.546000 Cu 0.326865 0.360847 0.5 377 63.546 1.97084e-05 -3.51713 63.546000 Cu 0.42312 0.356012 1 379 63.546 8.43156e-05 -3.51669 63.546000 Cu 0.500219 0.32716 7.33705e-17 358 63.546 4.06506e-05 -3.51685 63.546000 Cu 0.519296 0.351211 0.5 380 63.546 9.35472e-05 -3.51664 63.546000 Cu 0.692536 0.317577 6.84832e-16 321 63.546 2.96305e-05 -3.51697 63.546000 Cu 0.596405 0.322364 0.5 323 63.546 4.5121e-05 -3.51686 63.546000 Cu 0.615419 0.346437 2.41833e-16 341 63.546 1.78213e-05 -3.5169 63.546000 Cu 0.73055 0.365702 3.01447e-16 342 63.546 0.000167295 -3.51749 63.546000 Cu 0.711553 0.341649 0.5 343 63.546 8.089e-05 -3.51715 63.546000 Cu 0.807774 0.336822 2.41954e-16 345 63.546 3.92345e-05 -3.51717 63.546000 Cu 0.92312 0.356012 6.13151e-16 346 63.546 8.43156e-05 -3.51669 63.546000 Cu 0.904023 0.331981 0.5 347 63.546 1.85417e-05 -3.51697 63.546000 Cu 0.826865 0.360847 0.5 348 63.546 1.97084e-05 -3.51713 63.546000 Cu 0.0382537 0.375297 1 371 63.546 9.99654e-05 -3.51652 63.546000 Cu 0.153177 0.394598 1.23089e-16 372 63.546 0.00084186 -3.51738 63.546000 Cu 0.134318 0.370528 0.5 373 63.546 0.000212818 -3.51722 63.546000 Cu 0.0570861 0.399456 0.5 374 63.546 0.000690513 -3.51708 63.546000 Cu 0.249602 0.389699 0.5 378 63.546 0.000152462 -3.51747 63.546000 Cu 0.172221 0.418601 0.5 394 63.546 0.00169588 -3.51677 63.546000 Cu 0.268746 0.41362 2.44005e-16 396 63.546 0.00118586 -3.51577 63.546000 Cu 0.346009 0.384848 3.00481e-17 376 63.546 0.000271051 -3.51687 63.546000 Cu 0.442195 0.380054 0.5 381 63.546 0.000372627 -3.51625 63.546000 Cu 0.365207 0.408831 0.5 398 63.546 0.00188041 -3.51584 63.546000 Cu 0.461283 0.404165 1 400 63.546 0.000895301 -3.51641 63.546000 Cu 0.538254 0.375297 5.11663e-17 340 63.546 9.99654e-05 -3.51652 63.546000 Cu 0.634318 0.370528 0.5 344 63.546 0.000212818 -3.51722 63.546000 Cu 0.557086 0.399456 0.5 362 63.546 0.000690513 -3.51708 63.546000 Cu 0.653177 0.394598 3.67335e-16 363 63.546 0.00084186 -3.51738 63.546000 Cu 0.749602 0.389699 0.5 365 63.546 0.000152462 -3.51747 63.546000 Cu 0.672221 0.418601 0.5 366 63.546 0.00169588 -3.51677 63.546000 Cu 0.768746 0.41362 1 364 63.546 0.00118586 -3.51577 63.546000 Cu 0.846009 0.384848 4.22363e-17 367 63.546 0.000271051 -3.51687 63.546000 Cu 0.961283 0.404165 6.69747e-17 368 63.546 0.000895301 -3.51641 63.546000 Cu 0.942195 0.380054 0.5 369 63.546 0.000372627 -3.51625 63.546000 Cu 0.865207 0.408831 0.5 370 63.546 0.00188041 -3.51584 63.546000 Cu 0.0759555 0.423642 2.14802e-16 392 63.546 0.00466843 -3.51963 63.546000 Cu 0.192414 0.442557 1 393 63.546 0.00454161 -3.51669 63.546000 Cu 0.0954296 0.447639 0.5 395 63.546 0.0180396 -3.52223 63.546000 Cu 0.115284 0.471014 1 409 63.546 0.0475295 -3.51096 63.546000 Cu 0.214166 0.466544 0.5 411 63.546 0.100246 -3.51396 63.546000 Cu 0.497476 0.452605 1.0897e-16 3 63.546 0.0292156 -3.51961 63.546000 Cu 0.40133 0.457306 0.5 9 63.546 0.0638417 -3.49692 63.546000 Cu 0.308766 0.461731 6.75781e-17 208 63.546 0.0878656 -3.48645 63.546000 Cu 0.384022 0.43287 1.13435e-17 397 63.546 0.00747277 -3.51291 63.546000 Cu 0.288123 0.43751 0.5 399 63.546 0.0146011 -3.50963 63.546000 Cu 0.479892 0.428427 0.5 401 63.546 0.00376346 -3.51962 63.546000 Cu 0.575955 0.423642 1 361 63.546 0.00466843 -3.51963 63.546000 Cu 0.615284 0.471014 1 382 63.546 0.0475295 -3.51096 63.546000 Cu 0.59543 0.447639 0.5 383 63.546 0.0180396 -3.52223 63.546000 Cu 0.692414 0.442557 1.30571e-16 384 63.546 0.00454161 -3.51669 63.546000 Cu 0.714166 0.466544 0.5 387 63.546 0.100246 -3.51396 63.546000 Cu 0.808766 0.461731 2.4123e-16 385 63.546 0.0878656 -3.48645 63.546000 Cu 0.788123 0.43751 0.5 386 63.546 0.0146011 -3.50963 63.546000 Cu 0.884022 0.43287 3.85437e-16 388 63.546 0.00747277 -3.51291 63.546000 Cu 0.997476 0.452605 1 389 63.546 0.0292156 -3.51961 63.546000 Cu 0.979892 0.428427 0.5 390 63.546 0.00376346 -3.51962 63.546000 Cu 0.90133 0.457306 0.5 391 63.546 0.0638417 -3.49692 63.546000 Cu 0.150399 0.514525 1 2 63.546 6.61612 -3.21676 63.546000 Cu 0.0314977 0.498756 1 407 63.546 9.43486 -3.27414 63.546000 Cu 0.236713 0.489985 1 410 63.546 0.56756 -3.47559 63.546000 Cu 0.131247 0.49366 0.5 412 63.546 3.76035 -3.41178 63.546000 Cu 0.246585 0.514476 0.5 5 63.546 1.10901 -3.4916 63.546000 Cu 0.0139526 0.476101 0.5 408 63.546 0.887163 -3.43248 63.546000 Cu 0.34749 0.514392 1.24416e-16 4 63.546 2.2642 -3.48208 63.546000 Cu 0.447748 0.516373 0.5 6 63.546 7.8241 -3.3795 63.546000 Cu 0.331332 0.488035 0.5 7 63.546 0.626763 -3.43567 63.546000 Cu 0.418278 0.482493 1 204 63.546 1.12952 -3.37284 63.546000 Cu 0.513953 0.476101 0.5 1 63.546 0.887163 -3.43248 63.546000 Cu 0.650399 0.514525 1 10 63.546 6.61612 -3.21676 63.546000 Cu 0.531498 0.498756 7.41428e-16 402 63.546 9.43486 -3.27414 63.546000 Cu 0.631247 0.49366 0.5 403 63.546 3.76035 -3.41178 63.546000 Cu 0.736713 0.489985 1 404 63.546 0.56756 -3.47559 63.546000 Cu 0.746585 0.514476 0.5 12 63.546 1.10901 -3.4916 63.546000 Cu 0.84749 0.514392 2.75381e-16 14 63.546 2.2642 -3.48208 63.546000 Cu 0.947748 0.516373 0.5 16 63.546 7.8241 -3.3795 63.546000 Cu 0.831332 0.488035 0.5 405 63.546 0.626763 -3.43567 63.546000 Cu 0.918278 0.482493 2.29283e-18 406 63.546 1.12952 -3.37284 63.546000 Cu 0.0349724 0.530931 6.91469e-16 18 63.546 8.76367 -3.26504 63.546000 Cu 0.118024 0.558337 1.22123e-16 19 63.546 0.0623355 -3.50759 63.546000 Cu 0.133659 0.535651 0.5 20 63.546 3.53075 -3.41884 63.546000 Cu 0.0157372 0.553089 0.5 21 63.546 0.524825 -3.44478 63.546000 Cu 0.216666 0.56262 0.5 25 63.546 0.113436 -3.51306 63.546000 Cu 0.238016 0.538988 9.84468e-16 22 63.546 0.539143 -3.48367 63.546000 Cu 0.310876 0.56722 5.11663e-17 23 63.546 0.082992 -3.48727 63.546000 Cu 0.332533 0.540831 0.5 24 63.546 0.417001 -3.45643 63.546000 Cu 0.419803 0.546167 6.17857e-16 26 63.546 0.589333 -3.41608 63.546000 Cu 0.403117 0.5716 0.5 27 63.546 0.0720468 -3.4975 63.546000 Cu 0.499409 0.576417 5.57519e-16 28 63.546 0.0445712 -3.52007 63.546000 Cu 0.534972 0.530931 1.54464e-17 8 63.546 8.76367 -3.26504 63.546000 Cu 0.633659 0.535651 0.5 13 63.546 3.53075 -3.41884 63.546000 Cu 0.515737 0.553089 0.5 29 63.546 0.524825 -3.44478 63.546000 Cu 0.618024 0.558337 5.06836e-18 30 63.546 0.0623355 -3.50759 63.546000 Cu 0.716666 0.56262 0.5 32 63.546 0.113436 -3.51306 63.546000 Cu 0.738016 0.538988 1 11 63.546 0.539143 -3.48367 63.546000 Cu 0.999409 0.576417 5.58364e-16 38 63.546 0.0445712 -3.52007 63.546000 Cu 0.919803 0.546167 8.63069e-16 15 63.546 0.589333 -3.41608 63.546000 Cu 0.832533 0.540831 0.5 17 63.546 0.417001 -3.45643 63.546000 Cu 0.810876 0.56722 1 34 63.546 0.082992 -3.48727 63.546000 Cu 0.903117 0.5716 0.5 36 63.546 0.0720468 -3.4975 63.546000 Cu 0.0779963 0.605427 3.7361e-16 39 63.546 0.00652184 -3.52029 63.546000 Cu 0.0976958 0.581522 0.5 40 63.546 0.0210632 -3.52144 63.546000 Cu 0.194947 0.586638 1 42 63.546 0.00805069 -3.51513 63.546000 Cu 0.174346 0.61053 0.5 45 63.546 0.00119157 -3.51675 63.546000 Cu 0.0587197 0.629609 0.5 60 63.546 0.00128601 -3.51758 63.546000 Cu 0.270813 0.615524 8.62104e-16 43 63.546 0.00199787 -3.51528 63.546000 Cu 0.290448 0.591584 0.5 44 63.546 0.0168085 -3.5087 63.546000 Cu 0.386044 0.596153 1 46 63.546 0.00776664 -3.51253 63.546000 Cu 0.367129 0.620265 0.5 47 63.546 0.00253368 -3.51554 63.546000 Cu 0.463022 0.624887 6.15081e-16 48 63.546 0.000949891 -3.51644 63.546000 Cu 0.481817 0.600584 0.5 49 63.546 0.0067097 -3.52018 63.546000 Cu 0.694947 0.586638 8.12144e-17 31 63.546 0.00805069 -3.51513 63.546000 Cu 0.597696 0.581522 0.5 33 63.546 0.0210632 -3.52144 63.546000 Cu 0.577996 0.605427 2.8069e-16 50 63.546 0.00652184 -3.52029 63.546000 Cu 0.674346 0.61053 0.5 52 63.546 0.00119157 -3.51675 63.546000 Cu 0.55872 0.629609 0.5 53 63.546 0.00128601 -3.51758 63.546000 Cu 0.981817 0.600584 0.5 41 63.546 0.0067097 -3.52018 63.546000 Cu 0.886044 0.596153 1 35 63.546 0.00776664 -3.51253 63.546000 Cu 0.790448 0.591584 0.5 37 63.546 0.0168085 -3.5087 63.546000 Cu 0.770813 0.615524 1 54 63.546 0.00199787 -3.51528 63.546000 Cu 0.867129 0.620265 0.5 56 63.546 0.00253368 -3.51554 63.546000 Cu 0.963022 0.624887 2.22163e-16 58 63.546 0.000949891 -3.51644 63.546000 Cu 0.0394539 0.653793 3.2884e-16 59 63.546 0.000135782 -3.51649 63.546000 Cu 0.154793 0.634518 3.68783e-16 62 63.546 0.000878509 -3.51788 63.546000 Cu 0.135407 0.658592 0.5 65 63.546 0.000392397 -3.51754 63.546000 Cu 0.0201084 0.677909 0.5 80 63.546 7.64989e-05 -3.51652 63.546000 Cu 0.116133 0.68269 1 82 63.546 4.43701e-05 -3.517 63.546000 Cu 0.231645 0.663456 5.14197e-16 63 63.546 0.00014189 -3.51762 63.546000 Cu 0.25119 0.639453 0.5 64 63.546 0.00021246 -3.51757 63.546000 Cu 0.34755 0.644295 3.10859e-16 66 63.546 0.000575536 -3.51674 63.546000 Cu 0.42405 0.673123 2.4135e-19 67 63.546 0.000145077 -3.51657 63.546000 Cu 0.443603 0.649053 0.5 68 63.546 0.000484957 -3.51605 63.546000 Cu 0.327881 0.668304 0.5 69 63.546 4.91292e-05 -3.51699 63.546000 Cu 0.654793 0.634518 1 51 63.546 0.000878509 -3.51788 63.546000 Cu 0.539454 0.653793 1.10297e-16 70 63.546 0.000135782 -3.51649 63.546000 Cu 0.616133 0.68269 2.55831e-16 71 63.546 4.43701e-05 -3.517 63.546000 Cu 0.635407 0.658592 0.5 72 63.546 0.000392397 -3.51754 63.546000 Cu 0.520108 0.677909 0.5 73 63.546 7.64989e-05 -3.51652 63.546000 Cu 0.731645 0.663456 2.45695e-16 74 63.546 0.00014189 -3.51762 63.546000 Cu 0.84755 0.644295 1.47586e-16 55 63.546 0.000575536 -3.51674 63.546000 Cu 0.75119 0.639453 0.5 57 63.546 0.00021246 -3.51757 63.546000 Cu 0.943603 0.649053 0.5 61 63.546 0.000484957 -3.51605 63.546000 Cu 0.827881 0.668304 0.5 76 63.546 4.91292e-05 -3.51699 63.546000 Cu 0.92405 0.673123 1 78 63.546 0.000145077 -3.51657 63.546000 Cu 0.000745022 0.701984 5.75379e-16 79 63.546 5.50131e-05 -3.51694 63.546000 Cu 0.192868 0.711588 1 83 63.546 1.12015e-05 -3.51706 63.546000 Cu 0.21223 0.687508 0.5 84 63.546 7.38824e-05 -3.5172 63.546000 Cu 0.096856 0.706785 0.5 85 63.546 6.08481e-05 -3.51696 63.546000 Cu 0.0773709 0.730863 4.20553e-16 102 63.546 2.35742e-05 -3.517 63.546000 Cu 0.173492 0.735674 0.5 104 63.546 1.58992e-05 -3.51706 63.546000 Cu 0.30836 0.692338 2.4135e-18 86 63.546 4.28178e-05 -3.51714 63.546000 Cu 0.385127 0.721217 2.3592e-16 87 63.546 7.63728e-06 -3.51713 63.546000 Cu 0.404573 0.69717 0.5 88 63.546 1.32455e-05 -3.51706 63.546000 Cu 0.288969 0.716398 0.5 89 63.546 2.56137e-05 -3.51714 63.546000 Cu 0.481266 0.726047 0.5 93 63.546 1.65414e-05 -3.51706 63.546000 Cu 0.71223 0.687508 0.5 77 63.546 7.38824e-05 -3.5172 63.546000 Cu 0.500745 0.701984 2.45333e-16 90 63.546 5.50131e-05 -3.51694 63.546000 Cu 0.577371 0.730863 1 91 63.546 2.35742e-05 -3.517 63.546000 Cu 0.596856 0.706785 0.5 92 63.546 6.08481e-05 -3.51696 63.546000 Cu 0.692868 0.711588 1 94 63.546 1.12015e-05 -3.51706 63.546000 Cu 0.673492 0.735674 0.5 97 63.546 1.58992e-05 -3.51706 63.546000 Cu 0.981266 0.726047 0.5 100 63.546 1.65414e-05 -3.51706 63.546000 Cu 0.80836 0.692338 3.22444e-16 75 63.546 4.28178e-05 -3.51714 63.546000 Cu 0.904573 0.69717 0.5 81 63.546 1.32455e-05 -3.51706 63.546000 Cu 0.788969 0.716398 0.5 96 63.546 2.56137e-05 -3.51714 63.546000 Cu 0.885127 0.721217 4.01728e-16 98 63.546 7.63728e-06 -3.51713 63.546000 Cu 0.154096 0.75974 4.47343e-16 103 63.546 1.57908e-05 -3.51708 63.546000 Cu 0.0579586 0.754922 0.5 105 63.546 1.64041e-05 -3.51698 63.546000 Cu 0.0385908 0.77897 3.37891e-17 122 63.546 5.86355e-06 -3.51702 63.546000 Cu 0.134775 0.783805 0.5 124 63.546 2.82445e-05 -3.51721 63.546000 Cu 0.230934 0.788624 1 126 63.546 3.31139e-05 -3.51715 63.546000 Cu 0.269573 0.740473 1 106 63.546 7.86164e-06 -3.51701 63.546000 Cu 0.346321 0.769337 3.13755e-18 107 63.546 2.0665e-05 -3.5169 63.546000 Cu 0.365663 0.745268 0.5 108 63.546 5.9303e-05 -3.51696 63.546000 Cu 0.250231 0.764552 0.5 109 63.546 1.84365e-05 -3.51696 63.546000 Cu 0.44243 0.774133 0.5 110 63.546 7.19821e-05 -3.51696 63.546000 Cu 0.461815 0.750093 6.03376e-18 111 63.546 8.28777e-06 -3.51694 63.546000 Cu 0.538591 0.77897 2.44609e-16 112 63.546 5.86355e-06 -3.51702 63.546000 Cu 0.557959 0.754922 0.5 113 63.546 1.64041e-05 -3.51698 63.546000 Cu 0.654096 0.75974 6.12306e-16 114 63.546 1.57908e-05 -3.51708 63.546000 Cu 0.634775 0.783805 0.5 117 63.546 2.82445e-05 -3.51721 63.546000 Cu 0.730934 0.788624 1 115 63.546 3.31139e-05 -3.51715 63.546000 Cu 0.769573 0.740473 1.25019e-16 95 63.546 7.86164e-06 -3.51701 63.546000 Cu 0.961815 0.750093 5.88895e-16 99 63.546 8.28777e-06 -3.51694 63.546000 Cu 0.865663 0.745268 0.5 101 63.546 5.9303e-05 -3.51696 63.546000 Cu 0.750231 0.764552 0.5 116 63.546 1.84365e-05 -3.51696 63.546000 Cu 0.846321 0.769337 1 118 63.546 2.0665e-05 -3.5169 63.546000 Cu 0.94243 0.774133 0.5 120 63.546 7.19821e-05 -3.51696 63.546000 Cu 0.115455 0.80785 3.77713e-16 123 63.546 2.68086e-05 -3.51721 63.546000 Cu 0.0192214 0.803005 0.5 125 63.546 0.000147067 -3.51698 63.546000 Cu 0.211682 0.812702 0.5 129 63.546 0.000113533 -3.51721 63.546000 Cu 7.32909e-05 0.827068 7.24051e-19 142 63.546 7.81223e-05 -3.5168 63.546000 Cu 0.0962129 0.831885 0.5 144 63.546 0.00010846 -3.51707 63.546000 Cu 0.192539 0.836745 1 146 63.546 3.277e-05 -3.51733 63.546000 Cu 0.307817 0.817515 1 127 63.546 9.71011e-05 -3.517 63.546000 Cu 0.327028 0.793423 0.5 128 63.546 1.43996e-05 -3.51704 63.546000 Cu 0.423125 0.798205 1 130 63.546 6.00142e-05 -3.51697 63.546000 Cu 0.403939 0.822284 0.5 131 63.546 3.61349e-05 -3.51687 63.546000 Cu 0.288796 0.841596 0.5 148 63.546 0.000192562 -3.51714 63.546000 Cu 0.500073 0.827068 3.12911e-16 132 63.546 7.81223e-05 -3.5168 63.546000 Cu 0.519221 0.803005 0.5 133 63.546 0.000147067 -3.51698 63.546000 Cu 0.615455 0.80785 1 134 63.546 2.68086e-05 -3.51721 63.546000 Cu 0.692539 0.836745 1 135 63.546 3.277e-05 -3.51733 63.546000 Cu 0.711682 0.812702 0.5 136 63.546 0.000113533 -3.51721 63.546000 Cu 0.596213 0.831885 0.5 137 63.546 0.00010846 -3.51707 63.546000 Cu 0.923125 0.798205 1 119 63.546 6.00142e-05 -3.51697 63.546000 Cu 0.827028 0.793423 0.5 121 63.546 1.43996e-05 -3.51704 63.546000 Cu 0.807817 0.817515 1 138 63.546 9.71011e-05 -3.517 63.546000 Cu 0.903939 0.822284 0.5 140 63.546 3.61349e-05 -3.51687 63.546000 Cu 0.788796 0.841596 0.5 141 63.546 0.000192562 -3.51714 63.546000 Cu 0.0771132 0.855926 1 143 63.546 0.000165818 -3.51671 63.546000 Cu 0.173409 0.860774 0.5 149 63.546 3.59687e-05 -3.51734 63.546000 Cu 0.0579663 0.87998 0.5 164 63.546 0.000569289 -3.51616 63.546000 Cu 0.154168 0.884772 1 166 63.546 0.000409831 -3.51695 63.546000 Cu 0.269761 0.865647 1 147 63.546 0.000249911 -3.51754 63.546000 Cu 0.384897 0.846379 1 150 63.546 3.34201e-05 -3.51677 63.546000 Cu 0.365981 0.870482 0.5 151 63.546 0.000367188 -3.51708 63.546000 Cu 0.461984 0.875234 2.6983e-16 152 63.546 0.000145989 -3.51629 63.546000 Cu 0.250649 0.88964 0.5 168 63.546 0.000224687 -3.51767 63.546000 Cu 0.34711 0.894565 6.11099e-16 170 63.546 0.00134228 -3.5175 63.546000 Cu 0.480962 0.851133 0.5 153 63.546 0.000128246 -3.51643 63.546000 Cu 0.577113 0.855926 3.13514e-16 154 63.546 0.000165818 -3.51671 63.546000 Cu 0.654168 0.884772 1 155 63.546 0.000409831 -3.51695 63.546000 Cu 0.673409 0.860774 0.5 156 63.546 3.59687e-05 -3.51734 63.546000 Cu 0.557966 0.87998 0.5 157 63.546 0.000569289 -3.51616 63.546000 Cu 0.980962 0.851133 0.5 145 63.546 0.000128246 -3.51643 63.546000 Cu 0.884897 0.846379 2.46781e-16 139 63.546 3.34201e-05 -3.51677 63.546000 Cu 0.769761 0.865647 1.23571e-16 158 63.546 0.000249911 -3.51754 63.546000 Cu 0.84711 0.894565 1 159 63.546 0.00134228 -3.5175 63.546000 Cu 0.865981 0.870482 0.5 160 63.546 0.000367188 -3.51708 63.546000 Cu 0.750649 0.88964 0.5 161 63.546 0.000224687 -3.51767 63.546000 Cu 0.961984 0.875234 5.36643e-16 162 63.546 0.000145989 -3.51629 63.546000 Cu 0.0388018 0.904112 1 163 63.546 0.00121717 -3.51643 63.546000 Cu 0.13487 0.908757 0.5 169 63.546 0.00260449 -3.51586 63.546000 Cu 0.0202365 0.928407 0.5 184 63.546 0.00433626 -3.51969 63.546000 Cu 0.116055 0.932815 6.19064e-17 186 63.546 0.00850684 -3.51289 63.546000 Cu 0.211913 0.937444 0.5 188 63.546 0.016309 -3.50942 63.546000 Cu 0.231371 0.913556 1 167 63.546 0.00148928 -3.51593 63.546000 Cu 0.424156 0.92364 1 171 63.546 0.00581598 -3.51971 63.546000 Cu 0.443092 0.899426 0.5 172 63.546 0.000870457 -3.51706 63.546000 Cu 0.327923 0.918582 0.5 173 63.546 0.00172815 -3.51693 63.546000 Cu 0.307661 0.942525 1 190 63.546 0.00497037 -3.51655 63.546000 Cu 0.538802 0.904112 2.43643e-16 174 63.546 0.00121717 -3.51643 63.546000 Cu 0.616055 0.932815 4.47705e-17 175 63.546 0.00850684 -3.51289 63.546000 Cu 0.63487 0.908757 0.5 176 63.546 0.00260449 -3.51586 63.546000 Cu 0.520237 0.928407 0.5 177 63.546 0.00433626 -3.51969 63.546000 Cu 0.711913 0.937444 0.5 181 63.546 0.016309 -3.50942 63.546000 Cu 0.731371 0.913556 1 178 63.546 0.00148928 -3.51593 63.546000 Cu 0.943092 0.899426 0.5 165 63.546 0.000870457 -3.51706 63.546000 Cu 0.807661 0.942525 1 179 63.546 0.00497037 -3.51655 63.546000 Cu 0.827923 0.918582 0.5 180 63.546 0.00172815 -3.51693 63.546000 Cu 0.924156 0.92364 1 182 63.546 0.00581598 -3.51971 63.546000 Cu 0.00275221 0.9526 1.20675e-19 183 63.546 0.0317122 -3.51945 63.546000 Cu 0.191346 0.961689 2.47746e-16 187 63.546 0.0905614 -3.4859 63.546000 Cu 0.0988888 0.957293 0.5 189 63.546 0.0653636 -3.49665 63.546000 Cu 0.0819964 0.982489 1.24054e-16 205 63.546 1.13559 -3.37221 63.546000 Cu 0.168902 0.988051 0.5 206 63.546 0.631731 -3.43541 63.546000 Cu 0.368725 0.993583 0.5 234 63.546 3.73329 -3.41091 63.546000 Cu 0.468698 0.998707 5.11663e-17 209 63.546 9.44178 -3.27279 63.546000 Cu 0.404778 0.947628 0.5 192 63.546 0.0190932 -3.52194 63.546000 Cu 0.384885 0.970965 4.89941e-16 191 63.546 0.0458306 -3.51053 63.546000 Cu 0.285902 0.966467 0.5 193 63.546 0.103515 -3.51375 63.546000 Cu 0.263515 0.989943 1 207 63.546 0.570461 -3.47638 63.546000 Cu 0.486235 0.976075 0.5 197 63.546 0.891704 -3.43162 63.546000 Cu 0.502752 0.9526 1.03781e-17 194 63.546 0.0317122 -3.51945 63.546000 Cu 0.581996 0.982489 1 195 63.546 1.13559 -3.37221 63.546000 Cu 0.598889 0.957293 0.5 196 63.546 0.0653636 -3.49665 63.546000 Cu 0.691346 0.961689 8.44726e-19 198 63.546 0.0905614 -3.4859 63.546000 Cu 0.668902 0.988051 0.5 201 63.546 0.631731 -3.43541 63.546000 Cu 0.968698 0.998707 1 214 63.546 9.44178 -3.27279 63.546000 Cu 0.868725 0.993583 0.5 215 63.546 3.73329 -3.41091 63.546000 Cu 0.904778 0.947628 0.5 185 63.546 0.0190932 -3.52194 63.546000 Cu 0.986235 0.976075 0.5 203 63.546 0.891704 -3.43162 63.546000 Cu 0.763515 0.989943 1 199 63.546 0.570461 -3.47638 63.546000 Cu 0.785902 0.966467 0.5 200 63.546 0.103515 -3.51375 63.546000 Cu 0.884885 0.970965 1.85236e-16 202 63.546 0.0458306 -3.51053