Number of particles = 412 A = 1 Angstrom (basic length-scale) H0(1,1) = 18.1263 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 72.6151 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 3.53645 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 55.845000 Fe 0.0801699 0.0459063 1 225 55.845 0.556851 -3.92428 55.845000 Fe 0.0594633 0.0140689 0.5 226 55.845 6.72 -4.15387 55.845000 Fe 0.152297 0.0140623 1 228 55.845 2.12926 -4.05501 55.845000 Fe 0.165318 0.0410478 0.5 231 55.845 0.565624 -3.99235 55.845000 Fe 0.256358 0.039755 1 229 55.845 1.19508 -3.99383 55.845000 Fe 0.252081 0.0142507 0.5 230 55.845 1.42399 -4.00706 55.845000 Fe 0.347115 0.0154753 2.03372e-15 232 55.845 7.27105 -3.63808 55.845000 Fe 0.46645 0.0297002 1.5844e-16 233 55.845 6.91542 -3.82809 55.845000 Fe 0.363465 0.0361988 0.5 235 55.845 3.01822 -3.89491 55.845000 Fe 0.489843 0.0515813 0.5 255 55.845 1.155 -3.94741 55.845000 Fe 0.652297 0.0140623 3.04126e-17 210 55.845 2.12926 -4.05501 55.845000 Fe 0.559463 0.0140689 0.5 211 55.845 6.72 -4.15387 55.845000 Fe 0.58017 0.0459063 4.90527e-19 216 55.845 0.556851 -3.92428 55.845000 Fe 0.665318 0.0410478 0.5 218 55.845 0.565624 -3.99235 55.845000 Fe 0.752081 0.0142507 0.5 213 55.845 1.42399 -4.00706 55.845000 Fe 0.756358 0.039755 1 220 55.845 1.19508 -3.99383 55.845000 Fe 0.847115 0.0154753 1 212 55.845 7.27105 -3.63808 55.845000 Fe 0.863465 0.0361988 0.5 222 55.845 3.01822 -3.89491 55.845000 Fe 0.96645 0.0297002 1 224 55.845 6.91542 -3.82809 55.845000 Fe 0.989843 0.0515813 0.5 227 55.845 1.155 -3.94741 55.845000 Fe 0.112081 0.0970774 1 246 55.845 0.0462813 -4.01188 55.845000 Fe 0.0950197 0.0728242 0.5 247 55.845 0.208187 -4.05905 55.845000 Fe 0.187467 0.0682846 1 249 55.845 0.225428 -4.0028 55.845000 Fe 0.20802 0.0929214 0.5 252 55.845 0.16655 -4.013 55.845000 Fe 0.0163619 0.101402 0.5 248 55.845 0.0295732 -4.04597 55.845000 Fe 0.305199 0.0862776 5.61653e-17 250 55.845 0.0749232 -4.02371 55.845000 Fe 0.27949 0.0634437 0.5 251 55.845 0.343255 -4.01223 55.845000 Fe 0.382689 0.0580596 3.78196e-16 253 55.845 0.0778581 -4.03404 55.845000 Fe 0.499612 0.0759736 1 254 55.845 0.138966 -4.03407 55.845000 Fe 0.404146 0.0808323 0.5 256 55.845 0.182546 -4.07331 55.845000 Fe 0.3261 0.110664 0.5 273 55.845 0.036055 -4.05671 55.845000 Fe 0.419917 0.105129 4.04684e-17 275 55.845 0.0746437 -4.06331 55.845000 Fe 0.516362 0.101402 0.5 276 55.845 0.0295732 -4.04597 55.845000 Fe 0.687467 0.0682846 4.90527e-19 217 55.845 0.225428 -4.0028 55.845000 Fe 0.59502 0.0728242 0.5 219 55.845 0.208187 -4.05905 55.845000 Fe 0.612081 0.0970774 0 237 55.845 0.0462813 -4.01188 55.845000 Fe 0.70802 0.0929214 0.5 239 55.845 0.16655 -4.013 55.845000 Fe 0.882689 0.0580596 1 221 55.845 0.0778581 -4.03404 55.845000 Fe 0.77949 0.0634437 0.5 223 55.845 0.343255 -4.01223 55.845000 Fe 0.805199 0.0862776 0 241 55.845 0.0749232 -4.02371 55.845000 Fe 0.919917 0.105129 1 242 55.845 0.0746437 -4.06331 55.845000 Fe 0.904146 0.0808323 0.5 243 55.845 0.182546 -4.07331 55.845000 Fe 0.8261 0.110664 0.5 244 55.845 0.036055 -4.05671 55.845000 Fe 0.999612 0.0759736 1 245 55.845 0.138966 -4.03407 55.845000 Fe 0.0341531 0.125697 0 267 55.845 0.0362953 -4.0282 55.845000 Fe 0.151266 0.1448 1.17726e-17 268 55.845 0.0280762 -4.05633 55.845000 Fe 0.130126 0.120684 0.5 269 55.845 0.0261121 -4.03375 55.845000 Fe 0.0538863 0.149137 0.5 270 55.845 0.0231201 -4.04026 55.845000 Fe 0.229696 0.115799 0 271 55.845 0.0344214 -4.03749 55.845000 Fe 0.246788 0.139318 0.5 274 55.845 0.0327561 -4.05727 55.845000 Fe 0.266402 0.163672 3.77705e-17 292 55.845 0.00388153 -4.05363 55.845000 Fe 0.344028 0.135007 2.30547e-17 272 55.845 0.0263516 -4.04585 55.845000 Fe 0.439811 0.129786 0.5 277 55.845 0.0186718 -4.03998 55.845000 Fe 0.362381 0.158565 0.5 294 55.845 0.0208101 -4.04196 55.845000 Fe 0.457904 0.154591 1.23858e-16 296 55.845 0.0457935 -4.03882 55.845000 Fe 0.534153 0.125697 7.84842e-18 236 55.845 0.0362953 -4.0282 55.845000 Fe 0.729696 0.115799 2.45263e-19 238 55.845 0.0344214 -4.03749 55.845000 Fe 0.630126 0.120684 0.5 240 55.845 0.0261121 -4.03375 55.845000 Fe 0.553886 0.149137 0.5 258 55.845 0.0231201 -4.04026 55.845000 Fe 0.651266 0.1448 1 259 55.845 0.0280762 -4.05633 55.845000 Fe 0.746788 0.139318 0.5 261 55.845 0.0327561 -4.05727 55.845000 Fe 0.766402 0.163672 0 260 55.845 0.00388153 -4.05363 55.845000 Fe 0.844028 0.135007 0 263 55.845 0.0263516 -4.04585 55.845000 Fe 0.957904 0.154591 0 264 55.845 0.0457935 -4.03882 55.845000 Fe 0.939811 0.129786 0.5 265 55.845 0.0186718 -4.03998 55.845000 Fe 0.862381 0.158565 0.5 266 55.845 0.0208101 -4.04196 55.845000 Fe 0.0734995 0.173268 0 288 55.845 0.00249075 -4.04742 55.845000 Fe 0.189149 0.192046 1.83947e-17 289 55.845 0.0475386 -4.0477 55.845000 Fe 0.169151 0.168506 0.5 290 55.845 0.00549579 -4.04645 55.845000 Fe 0.0926515 0.197702 0.5 291 55.845 0.0382843 -4.05173 55.845000 Fe 0.111448 0.221317 0 310 55.845 0.000230592 -4.04407 55.845000 Fe 0.207083 0.216595 0.5 312 55.845 0.00778846 -4.05031 55.845000 Fe 0.38031 0.182682 1 293 55.845 0.021522 -4.04903 55.845000 Fe 0.284823 0.187981 0.5 295 55.845 0.0269622 -4.04668 55.845000 Fe 0.477765 0.178365 0.5 297 55.845 0.0156696 -4.04349 55.845000 Fe 0.303906 0.211482 8.58421e-18 314 55.845 0.0131019 -4.04569 55.845000 Fe 0.400465 0.207237 0.5 316 55.845 0.0279074 -4.04662 55.845000 Fe 0.495174 0.201825 7.84842e-18 318 55.845 0.03932 -4.04692 55.845000 Fe 0.573499 0.173268 0 257 55.845 0.00249075 -4.04742 55.845000 Fe 0.669151 0.168506 0.5 262 55.845 0.00549579 -4.04645 55.845000 Fe 0.611448 0.221317 0 278 55.845 0.000230592 -4.04407 55.845000 Fe 0.592651 0.197702 0.5 279 55.845 0.0382843 -4.05173 55.845000 Fe 0.689149 0.192046 1 280 55.845 0.0475386 -4.0477 55.845000 Fe 0.707083 0.216595 0.5 283 55.845 0.00778846 -4.05031 55.845000 Fe 0.803906 0.211482 1 281 55.845 0.0131019 -4.04569 55.845000 Fe 0.784823 0.187981 0.5 282 55.845 0.0269622 -4.04668 55.845000 Fe 0.88031 0.182682 1 284 55.845 0.021522 -4.04903 55.845000 Fe 0.995174 0.201825 0 285 55.845 0.03932 -4.04692 55.845000 Fe 0.977765 0.178365 0.5 286 55.845 0.0156696 -4.04349 55.845000 Fe 0.900465 0.207237 0.5 287 55.845 0.0279074 -4.04662 55.845000 Fe 0.0337282 0.250588 1 307 55.845 0.0551435 -4.05045 55.845000 Fe 0.227405 0.240898 1.44705e-17 311 55.845 0.0491879 -4.04784 55.845000 Fe 0.130005 0.244859 0.5 313 55.845 0.0524441 -4.04955 55.845000 Fe 0.0536743 0.274171 0.5 330 55.845 0.0064055 -4.04598 55.845000 Fe 0.14927 0.26937 1.03011e-17 332 55.845 0.000499516 -4.04742 55.845000 Fe 0.244616 0.264427 0.5 334 55.845 0.0138473 -4.04462 55.845000 Fe 0.0156444 0.225975 0.5 308 55.845 0.0112037 -4.05077 55.845000 Fe 0.418515 0.231176 1 315 55.845 0.0165017 -4.04547 55.845000 Fe 0.321982 0.235428 0.5 317 55.845 0.0296471 -4.04631 55.845000 Fe 0.342203 0.259986 2.62432e-17 336 55.845 0.0212772 -4.05022 55.845000 Fe 0.437872 0.254535 0.5 338 55.845 0.0395289 -4.0457 55.845000 Fe 0.515644 0.225975 0.5 319 55.845 0.0112037 -4.05077 55.845000 Fe 0.533728 0.250588 1 298 55.845 0.0551435 -4.05045 55.845000 Fe 0.64927 0.26937 0 299 55.845 0.000499516 -4.04742 55.845000 Fe 0.630005 0.244859 0.5 300 55.845 0.0524441 -4.04955 55.845000 Fe 0.553674 0.274171 0.5 301 55.845 0.0064055 -4.04598 55.845000 Fe 0.727405 0.240898 7.89748e-17 302 55.845 0.0491879 -4.04784 55.845000 Fe 0.744616 0.264427 0.5 305 55.845 0.0138473 -4.04462 55.845000 Fe 0.842203 0.259986 0 303 55.845 0.0212772 -4.05022 55.845000 Fe 0.821982 0.235428 0.5 304 55.845 0.0296471 -4.04631 55.845000 Fe 0.918515 0.231176 1 306 55.845 0.0165017 -4.04547 55.845000 Fe 0.937872 0.254535 0.5 309 55.845 0.0395289 -4.0457 55.845000 Fe 0.0712294 0.29766 0 329 55.845 0.0727687 -4.04769 55.845000 Fe 0.168753 0.293829 0.5 335 55.845 0.0597588 -4.04987 55.845000 Fe 0.0917778 0.322103 0.5 351 55.845 0.00505125 -4.04872 55.845000 Fe 0.187173 0.317304 0 353 55.845 0.00262755 -4.04337 55.845000 Fe 0.264698 0.288114 0 333 55.845 0.0491178 -4.04816 55.845000 Fe 0.456415 0.278799 1 337 55.845 0.00987051 -4.05078 55.845000 Fe 0.360557 0.284071 0.5 339 55.845 0.0260798 -4.04563 55.845000 Fe 0.283398 0.312806 0.5 355 55.845 0.0145261 -4.04995 55.845000 Fe 0.379816 0.307417 0 357 55.845 0.0340657 -4.04717 55.845000 Fe 0.495081 0.327129 1.00558e-16 358 55.845 0.00639165 -4.04464 55.845000 Fe 0.476506 0.303435 0.5 359 55.845 0.0573359 -4.04936 55.845000 Fe 0.398218 0.331558 0.5 360 55.845 0.0232219 -4.04899 55.845000 Fe 0.571229 0.29766 0 320 55.845 0.0727687 -4.04769 55.845000 Fe 0.687173 0.317304 0 321 55.845 0.00262755 -4.04337 55.845000 Fe 0.668753 0.293829 0.5 322 55.845 0.0597588 -4.04987 55.845000 Fe 0.591778 0.322103 0.5 323 55.845 0.00505125 -4.04872 55.845000 Fe 0.764698 0.288114 0 324 55.845 0.0491178 -4.04816 55.845000 Fe 0.879816 0.307417 4.07137e-17 325 55.845 0.0340657 -4.04717 55.845000 Fe 0.860557 0.284071 0.5 326 55.845 0.0260798 -4.04563 55.845000 Fe 0.783398 0.312806 0.5 327 55.845 0.0145261 -4.04995 55.845000 Fe 0.956415 0.278799 1 328 55.845 0.00987051 -4.05078 55.845000 Fe 0.976506 0.303435 0.5 331 55.845 0.0573359 -4.04936 55.845000 Fe 0.898218 0.331558 0.5 347 55.845 0.0232219 -4.04899 55.845000 Fe 0.995081 0.327129 4.66e-17 349 55.845 0.00639165 -4.04464 55.845000 Fe 0.110448 0.346792 1 350 55.845 0.0856097 -4.05102 55.845000 Fe 0.206375 0.34088 0.5 356 55.845 0.0704331 -4.04775 55.845000 Fe 0.0333224 0.374908 0 371 55.845 0.00478136 -4.04664 55.845000 Fe 0.13012 0.370224 0.5 373 55.845 0.00508735 -4.04459 55.845000 Fe 0.225658 0.365603 1 375 55.845 0.00650171 -4.04809 55.845000 Fe 0.0139848 0.350434 0.5 352 55.845 0.0753042 -4.04641 55.845000 Fe 0.303373 0.337013 0 354 55.845 0.0473634 -4.04728 55.845000 Fe 0.341263 0.38427 6.91642e-17 376 55.845 0.0403492 -4.05492 55.845000 Fe 0.321127 0.360411 0.5 377 55.845 0.0242405 -4.04624 55.845000 Fe 0.418904 0.356174 0 379 55.845 0.0456308 -4.04862 55.845000 Fe 0.437118 0.380024 0.5 381 55.845 0.0177155 -4.03996 55.845000 Fe 0.513985 0.350434 0.5 380 55.845 0.0753042 -4.04641 55.845000 Fe 0.533322 0.374908 0 340 55.845 0.00478136 -4.04664 55.845000 Fe 0.610448 0.346792 1 341 55.845 0.0856097 -4.05102 55.845000 Fe 0.725658 0.365603 0 342 55.845 0.00650171 -4.04809 55.845000 Fe 0.706375 0.34088 0.5 343 55.845 0.0704331 -4.04775 55.845000 Fe 0.63012 0.370224 0.5 344 55.845 0.00508735 -4.04459 55.845000 Fe 0.803373 0.337013 0 345 55.845 0.0473634 -4.04728 55.845000 Fe 0.918904 0.356174 0 346 55.845 0.0456308 -4.04862 55.845000 Fe 0.821127 0.360411 0.5 348 55.845 0.0242405 -4.04624 55.845000 Fe 0.841263 0.38427 0 367 55.845 0.0403492 -4.05492 55.845000 Fe 0.937118 0.380024 0.5 369 55.845 0.0177155 -4.03996 55.845000 Fe 0.147501 0.393649 3.31105e-17 372 55.845 0.125758 -4.0442 55.845000 Fe 0.0529187 0.399759 0.5 374 55.845 0.10108 -4.04393 55.845000 Fe 0.245903 0.390076 0.5 378 55.845 0.0985877 -4.05779 55.845000 Fe 0.0730777 0.423392 0 392 55.845 0.0110601 -4.04048 55.845000 Fe 0.186698 0.443617 1.06199e-16 393 55.845 0.271347 -4.04 55.845000 Fe 0.167873 0.418326 0.5 394 55.845 0.0097183 -4.03945 55.845000 Fe 0.262468 0.413444 1 396 55.845 0.0416556 -4.04625 55.845000 Fe 0.380631 0.432582 0 397 55.845 0.022344 -4.01325 55.845000 Fe 0.361486 0.408951 0.5 398 55.845 0.0461294 -4.04759 55.845000 Fe 0.283275 0.43644 0.5 399 55.845 0.223865 -4.02827 55.845000 Fe 0.457581 0.403302 1.32442e-17 400 55.845 0.0848034 -4.0446 55.845000 Fe 0.475731 0.428068 0.5 401 55.845 0.0140373 -4.04546 55.845000 Fe 0.573078 0.423392 0 361 55.845 0.0110601 -4.04048 55.845000 Fe 0.552919 0.399759 0.5 362 55.845 0.10108 -4.04393 55.845000 Fe 0.647501 0.393649 1 363 55.845 0.125758 -4.0442 55.845000 Fe 0.745903 0.390076 0.5 365 55.845 0.0985877 -4.05779 55.845000 Fe 0.667873 0.418326 0.5 366 55.845 0.0097183 -4.03945 55.845000 Fe 0.686698 0.443617 0 384 55.845 0.271347 -4.04 55.845000 Fe 0.762468 0.413444 1.71684e-17 364 55.845 0.0416556 -4.04625 55.845000 Fe 0.957581 0.403302 0 368 55.845 0.0848034 -4.0446 55.845000 Fe 0.861486 0.408951 0.5 370 55.845 0.0461294 -4.04759 55.845000 Fe 0.783275 0.43644 0.5 386 55.845 0.223865 -4.02827 55.845000 Fe 0.880631 0.432582 1 388 55.845 0.022344 -4.01325 55.845000 Fe 0.975731 0.428068 0.5 390 55.845 0.0140373 -4.04546 55.845000 Fe 0.0914761 0.447153 0.5 395 55.845 0.0944226 -4.05812 55.845000 Fe 0.112817 0.471881 3.21295e-17 409 55.845 0.189952 -4.04112 55.845000 Fe 0.235393 0.489901 4.34116e-17 410 55.845 0.728456 -3.97804 55.845000 Fe 0.212212 0.46696 0.5 411 55.845 0.177654 -4.03141 55.845000 Fe 0.124253 0.495663 0.5 412 55.845 4.71757 -3.93458 55.845000 Fe 0.00638435 0.476238 0.5 408 55.845 0.884449 -3.95645 55.845000 Fe 0.0287984 0.498056 2.59979e-17 407 55.845 9.64703 -3.74695 55.845000 Fe 0.49724 0.452688 2.86958e-17 3 55.845 0.210679 -4.04544 55.845000 Fe 0.331575 0.487703 0.5 7 55.845 0.778222 -3.99014 55.845000 Fe 0.397066 0.455873 0.5 9 55.845 0.310173 -4.05221 55.845000 Fe 0.415331 0.481964 2.21473e-16 204 55.845 0.688367 -3.92135 55.845000 Fe 0.303078 0.461161 8.41253e-17 208 55.845 0.18747 -3.99912 55.845000 Fe 0.506384 0.476238 0.5 1 55.845 0.884449 -3.95645 55.845000 Fe 0.612817 0.471881 1.31461e-16 382 55.845 0.189952 -4.04112 55.845000 Fe 0.591476 0.447153 0.5 383 55.845 0.0944226 -4.05812 55.845000 Fe 0.712212 0.46696 0.5 387 55.845 0.177654 -4.03141 55.845000 Fe 0.624253 0.495663 0.5 403 55.845 4.71757 -3.93458 55.845000 Fe 0.735393 0.489901 2.90637e-16 404 55.845 0.728456 -3.97804 55.845000 Fe 0.528798 0.498056 0 402 55.845 9.64703 -3.74695 55.845000 Fe 0.803078 0.461161 2.40358e-17 385 55.845 0.18747 -3.99912 55.845000 Fe 0.99724 0.452688 1 389 55.845 0.210679 -4.04544 55.845000 Fe 0.897066 0.455873 0.5 391 55.845 0.310173 -4.05221 55.845000 Fe 0.831575 0.487703 0.5 405 55.845 0.778222 -3.99014 55.845000 Fe 0.915331 0.481964 1 406 55.845 0.688367 -3.92135 55.845000 Fe 0.153203 0.515471 5.08185e-16 2 55.845 7.25656 -3.63911 55.845000 Fe 0.0338467 0.529762 2.45263e-19 18 55.845 6.94435 -3.82728 55.845000 Fe 0.136768 0.536214 0.5 20 55.845 3.02868 -3.89602 55.845000 Fe 0.010484 0.551615 0.5 21 55.845 1.15382 -3.94635 55.845000 Fe 0.248328 0.514298 0.5 5 55.845 1.42128 -4.00761 55.845000 Fe 0.243944 0.539781 4.57906e-16 22 55.845 1.191 -3.99374 55.845000 Fe 0.348107 0.514112 3.41652e-16 4 55.845 2.12901 -4.05478 55.845000 Fe 0.440897 0.514108 0.5 6 55.845 6.72322 -4.15408 55.845000 Fe 0.335014 0.541071 0.5 24 55.845 0.567269 -3.99241 55.845000 Fe 0.420228 0.545936 1.08259e-15 26 55.845 0.554365 -3.92462 55.845000 Fe 0.533847 0.529762 9.786e-17 8 55.845 6.94435 -3.82728 55.845000 Fe 0.653203 0.515471 2.44944e-15 10 55.845 7.25656 -3.63911 55.845000 Fe 0.636768 0.536214 0.5 13 55.845 3.02868 -3.89602 55.845000 Fe 0.510484 0.551615 0.5 29 55.845 1.15382 -3.94635 55.845000 Fe 0.743944 0.539781 1 11 55.845 1.191 -3.99374 55.845000 Fe 0.748328 0.514298 0.5 12 55.845 1.42128 -4.00761 55.845000 Fe 0.848107 0.514112 1 14 55.845 2.12901 -4.05478 55.845000 Fe 0.920228 0.545936 1 15 55.845 0.554365 -3.92462 55.845000 Fe 0.940897 0.514108 0.5 16 55.845 6.72322 -4.15408 55.845000 Fe 0.835014 0.541071 0.5 17 55.845 0.567269 -3.99241 55.845000 Fe 0.117586 0.558077 2.1436e-16 19 55.845 0.0778626 -4.03347 55.845000 Fe 0.220818 0.563455 0.5 25 55.845 0.344003 -4.01225 55.845000 Fe 0.00073051 0.576011 1.64326e-17 38 55.845 0.136049 -4.03374 55.845000 Fe 0.0803243 0.60518 2.94316e-17 39 55.845 0.0673663 -4.06303 55.845000 Fe 0.0961688 0.580859 0.5 40 55.845 0.180033 -4.07361 55.845000 Fe 0.195034 0.586292 0 42 55.845 0.07608 -4.02396 55.845000 Fe 0.174221 0.610673 0.5 45 55.845 0.0341987 -4.0566 55.845000 Fe 0.312752 0.568312 4.53737e-16 23 55.845 0.227385 -4.00303 55.845000 Fe 0.405302 0.57285 0.5 27 55.845 0.20917 -4.05963 55.845000 Fe 0.292254 0.592928 0.5 44 55.845 0.163908 -4.01299 55.845000 Fe 0.38825 0.597091 2.86958e-17 46 55.845 0.045189 -4.0116 55.845000 Fe 0.483937 0.601399 0.5 49 55.845 0.0267409 -4.04483 55.845000 Fe 0.500731 0.576011 0 28 55.845 0.136049 -4.03374 55.845000 Fe 0.617586 0.558077 4.02477e-16 30 55.845 0.0778626 -4.03347 55.845000 Fe 0.695034 0.586292 3.01674e-17 31 55.845 0.07608 -4.02396 55.845000 Fe 0.720818 0.563455 0.5 32 55.845 0.344003 -4.01225 55.845000 Fe 0.596169 0.580859 0.5 33 55.845 0.180033 -4.07361 55.845000 Fe 0.580324 0.60518 0 50 55.845 0.0673663 -4.06303 55.845000 Fe 0.674221 0.610673 0.5 52 55.845 0.0341987 -4.0566 55.845000 Fe 0.983937 0.601399 0.5 41 55.845 0.0267409 -4.04483 55.845000 Fe 0.812752 0.568312 1 34 55.845 0.227385 -4.00303 55.845000 Fe 0.88825 0.597091 2.45263e-19 35 55.845 0.045189 -4.0116 55.845000 Fe 0.905302 0.57285 0.5 36 55.845 0.20917 -4.05963 55.845000 Fe 0.792254 0.592928 0.5 37 55.845 0.163908 -4.01299 55.845000 Fe 0.042356 0.654578 5.69011e-17 59 55.845 0.0408079 -4.03878 55.845000 Fe 0.0604952 0.629802 0.5 60 55.845 0.0179204 -4.03945 55.845000 Fe 0.156263 0.635015 3.43369e-18 62 55.845 0.0246938 -4.04592 55.845000 Fe 0.137864 0.658593 0.5 65 55.845 0.0192213 -4.04255 55.845000 Fe 0.233968 0.663692 1.23613e-16 63 55.845 0.00305644 -4.05367 55.845000 Fe 0.270607 0.615821 0 43 55.845 0.0340848 -4.03837 55.845000 Fe 0.370176 0.620691 0.5 47 55.845 0.0264107 -4.03455 55.845000 Fe 0.466123 0.625706 6.47495e-17 48 55.845 0.0349168 -4.02834 55.845000 Fe 0.253474 0.639349 0.5 64 55.845 0.0302685 -4.05781 55.845000 Fe 0.349055 0.644811 9.44264e-17 66 55.845 0.026357 -4.05643 55.845000 Fe 0.44642 0.649171 0.5 68 55.845 0.0205514 -4.04061 55.845000 Fe 0.656263 0.635015 3.01674e-17 51 55.845 0.0246938 -4.04592 55.845000 Fe 0.560495 0.629802 0.5 53 55.845 0.0179204 -4.03945 55.845000 Fe 0.542356 0.654578 5.81274e-17 70 55.845 0.0408079 -4.03878 55.845000 Fe 0.637864 0.658593 0.5 72 55.845 0.0192213 -4.04255 55.845000 Fe 0.733968 0.663692 8.31442e-17 74 55.845 0.00305644 -4.05367 55.845000 Fe 0.770607 0.615821 0 54 55.845 0.0340848 -4.03837 55.845000 Fe 0.849055 0.644811 5.71463e-17 55 55.845 0.026357 -4.05643 55.845000 Fe 0.870176 0.620691 0.5 56 55.845 0.0264107 -4.03455 55.845000 Fe 0.753474 0.639349 0.5 57 55.845 0.0302685 -4.05781 55.845000 Fe 0.966123 0.625706 0 58 55.845 0.0349168 -4.02834 55.845000 Fe 0.94642 0.649171 0.5 61 55.845 0.0205514 -4.04061 55.845000 Fe 0.00508691 0.701845 5.17505e-17 79 55.845 0.0360591 -4.04643 55.845000 Fe 0.0225864 0.678376 0.5 80 55.845 0.0145655 -4.04376 55.845000 Fe 0.119971 0.682702 0 82 55.845 0.0204258 -4.04887 55.845000 Fe 0.196472 0.711493 1.98663e-17 83 55.845 0.0122073 -4.04599 55.845000 Fe 0.215412 0.687978 0.5 84 55.845 0.0241899 -4.04682 55.845000 Fe 0.099792 0.707235 0.5 85 55.845 0.0274615 -4.04656 55.845000 Fe 0.426734 0.673279 0 67 55.845 0.00277908 -4.04781 55.845000 Fe 0.331094 0.668528 0.5 69 55.845 0.00490097 -4.04566 55.845000 Fe 0.311126 0.69208 1 86 55.845 0.0435243 -4.0472 55.845000 Fe 0.388811 0.721307 3.06579e-17 87 55.845 0.000392193 -4.04448 55.845000 Fe 0.407682 0.697689 0.5 88 55.845 0.0343352 -4.05126 55.845000 Fe 0.293287 0.716608 0.5 89 55.845 0.00884447 -4.04985 55.845000 Fe 0.619971 0.682702 5.00337e-17 71 55.845 0.0204258 -4.04887 55.845000 Fe 0.522586 0.678376 0.5 73 55.845 0.0145655 -4.04376 55.845000 Fe 0.715412 0.687978 0.5 77 55.845 0.0241899 -4.04682 55.845000 Fe 0.505087 0.701845 9.56527e-18 90 55.845 0.0360591 -4.04643 55.845000 Fe 0.599792 0.707235 0.5 92 55.845 0.0274615 -4.04656 55.845000 Fe 0.696472 0.711493 3.18842e-18 94 55.845 0.0122073 -4.04599 55.845000 Fe 0.811126 0.69208 1.16255e-16 75 55.845 0.0435243 -4.0472 55.845000 Fe 0.831094 0.668528 0.5 76 55.845 0.00490097 -4.04566 55.845000 Fe 0.926734 0.673279 7.30884e-17 78 55.845 0.00277908 -4.04781 55.845000 Fe 0.907682 0.697689 0.5 81 55.845 0.0343352 -4.05126 55.845000 Fe 0.793287 0.716608 0.5 96 55.845 0.00884447 -4.04985 55.845000 Fe 0.888811 0.721307 4.194e-17 98 55.845 0.000392193 -4.04448 55.845000 Fe 0.0818733 0.731173 4.80716e-17 102 55.845 0.0167833 -4.04515 55.845000 Fe 0.158201 0.759974 6.99e-17 103 55.845 0.0200433 -4.05046 55.845000 Fe 0.178288 0.735436 0.5 104 55.845 0.0266976 -4.04597 55.845000 Fe 0.0624016 0.754533 0.5 105 55.845 0.0391072 -4.04573 55.845000 Fe 0.272924 0.740863 1.69232e-17 106 55.845 0.0446026 -4.04785 55.845000 Fe 0.351036 0.769353 6.86737e-18 107 55.845 0.000460235 -4.04712 55.845000 Fe 0.370449 0.744893 0.5 108 55.845 0.0461473 -4.04995 55.845000 Fe 0.255784 0.764416 0.5 109 55.845 0.0146058 -4.04467 55.845000 Fe 0.44669 0.774165 0.5 110 55.845 0.00709639 -4.04576 55.845000 Fe 0.466697 0.750577 5.54295e-17 111 55.845 0.0531755 -4.05009 55.845000 Fe 0.484686 0.725975 0.5 93 55.845 0.0112222 -4.05104 55.845000 Fe 0.581873 0.731173 6.27874e-17 91 55.845 0.0167833 -4.04515 55.845000 Fe 0.678288 0.735436 0.5 97 55.845 0.0266976 -4.04597 55.845000 Fe 0.562402 0.754533 0.5 113 55.845 0.0391072 -4.04573 55.845000 Fe 0.658201 0.759974 0 114 55.845 0.0200433 -4.05046 55.845000 Fe 0.984686 0.725975 0.5 100 55.845 0.0112222 -4.05104 55.845000 Fe 0.772924 0.740863 6.10706e-17 95 55.845 0.0446026 -4.04785 55.845000 Fe 0.966697 0.750577 0 99 55.845 0.0531755 -4.05009 55.845000 Fe 0.870449 0.744893 0.5 101 55.845 0.0461473 -4.04995 55.845000 Fe 0.755784 0.764416 0.5 116 55.845 0.0146058 -4.04467 55.845000 Fe 0.851036 0.769353 7.30884e-17 118 55.845 0.000460235 -4.04712 55.845000 Fe 0.94669 0.774165 0.5 120 55.845 0.00709639 -4.04576 55.845000 Fe 0.0440673 0.778796 2.796e-17 122 55.845 0.0106455 -4.05112 55.845000 Fe 0.12061 0.807423 0 123 55.845 0.0308506 -4.04735 55.845000 Fe 0.139884 0.784058 0.5 124 55.845 0.0252312 -4.04563 55.845000 Fe 0.0238415 0.803395 0.5 125 55.845 0.0529078 -4.04912 55.845000 Fe 0.217113 0.81279 0.5 129 55.845 0.0147127 -4.04977 55.845000 Fe 0.00539026 0.827108 9.56527e-18 142 55.845 0.00659955 -4.04464 55.845000 Fe 0.102229 0.831539 0.5 144 55.845 0.0232635 -4.04901 55.845000 Fe 0.235601 0.788116 6.62211e-18 126 55.845 0.0465699 -4.04778 55.845000 Fe 0.313227 0.817291 4.36569e-17 127 55.845 0.00226698 -4.04434 55.845000 Fe 0.331718 0.793781 0.5 128 55.845 0.0521737 -4.05056 55.845000 Fe 0.429229 0.797672 0 130 55.845 0.0673112 -4.04716 55.845000 Fe 0.408628 0.822079 0.5 131 55.845 0.00582177 -4.04871 55.845000 Fe 0.544067 0.778796 0 112 55.845 0.0106455 -4.05112 55.845000 Fe 0.639884 0.784058 0.5 117 55.845 0.0252312 -4.04563 55.845000 Fe 0.50539 0.827108 2.82053e-17 132 55.845 0.00659955 -4.04464 55.845000 Fe 0.523842 0.803395 0.5 133 55.845 0.0529078 -4.04912 55.845000 Fe 0.62061 0.807423 0 134 55.845 0.0308506 -4.04735 55.845000 Fe 0.717113 0.81279 0.5 136 55.845 0.0147127 -4.04977 55.845000 Fe 0.602229 0.831539 0.5 137 55.845 0.0232635 -4.04901 55.845000 Fe 0.735601 0.788116 7.77485e-17 115 55.845 0.0465699 -4.04778 55.845000 Fe 0.929229 0.797672 8.68232e-17 119 55.845 0.0673112 -4.04716 55.845000 Fe 0.831718 0.793781 0.5 121 55.845 0.0521737 -4.05056 55.845000 Fe 0.813227 0.817291 1.79042e-17 138 55.845 0.00226698 -4.04434 55.845000 Fe 0.908628 0.822079 0.5 140 55.845 0.00582177 -4.04871 55.845000 Fe 0.0815657 0.856132 1.56968e-17 143 55.845 0.042183 -4.04861 55.845000 Fe 0.197004 0.836988 3.38463e-17 146 55.845 0.0468351 -4.04727 55.845000 Fe 0.179353 0.86041 0.5 149 55.845 0.0227562 -4.04583 55.845000 Fe 0.0633807 0.879985 0.5 164 55.845 0.0172461 -4.03983 55.845000 Fe 0.159144 0.884247 0 166 55.845 0.0393692 -4.05471 55.845000 Fe 0.274758 0.865572 6.69569e-17 147 55.845 0.00578367 -4.04765 55.845000 Fe 0.294093 0.840883 0.5 148 55.845 0.0657816 -4.04799 55.845000 Fe 0.390067 0.84676 2.94316e-18 150 55.845 0.0825741 -4.05079 55.845000 Fe 0.37031 0.870194 0.5 151 55.845 0.00583525 -4.04436 55.845000 Fe 0.467199 0.874881 0 152 55.845 0.00495145 -4.04685 55.845000 Fe 0.486395 0.850419 0.5 153 55.845 0.0718081 -4.04607 55.845000 Fe 0.697004 0.836988 0 135 55.845 0.0468351 -4.04727 55.845000 Fe 0.581566 0.856132 0 154 55.845 0.042183 -4.04861 55.845000 Fe 0.659144 0.884247 5.61653e-17 155 55.845 0.0393692 -4.05471 55.845000 Fe 0.679353 0.86041 0.5 156 55.845 0.0227562 -4.04583 55.845000 Fe 0.563381 0.879985 0.5 157 55.845 0.0172461 -4.03983 55.845000 Fe 0.986395 0.850419 0.5 145 55.845 0.0718081 -4.04607 55.845000 Fe 0.890067 0.84676 3.33558e-17 139 55.845 0.0825741 -4.05079 55.845000 Fe 0.794093 0.840883 0.5 141 55.845 0.0657816 -4.04799 55.845000 Fe 0.774758 0.865572 2.94316e-17 158 55.845 0.00578367 -4.04765 55.845000 Fe 0.87031 0.870194 0.5 160 55.845 0.00583525 -4.04436 55.845000 Fe 0.967199 0.874881 4.97884e-17 162 55.845 0.00495145 -4.04685 55.845000 Fe 0.0428865 0.903281 1.03011e-16 163 55.845 0.0823353 -4.04488 55.845000 Fe 0.13905 0.908912 0.5 169 55.845 0.0432283 -4.04835 55.845000 Fe 0.0247437 0.928034 0.5 184 55.845 0.0141313 -4.04576 55.845000 Fe 0.119855 0.932555 1 186 55.845 0.0225677 -4.01342 55.845000 Fe 0.217224 0.936426 0.5 188 55.845 0.217124 -4.02757 55.845000 Fe 0.237989 0.913427 0 167 55.845 0.0401358 -4.04638 55.845000 Fe 0.254626 0.890042 0.5 168 55.845 0.0956421 -4.05791 55.845000 Fe 0.353009 0.893613 0 170 55.845 0.127363 -4.04408 55.845000 Fe 0.42744 0.923357 3.18842e-18 171 55.845 0.0101123 -4.04064 55.845000 Fe 0.44752 0.899723 0.5 172 55.845 0.100096 -4.04406 55.845000 Fe 0.332556 0.918283 0.5 173 55.845 0.0101622 -4.03954 55.845000 Fe 0.313802 0.943569 1 190 55.845 0.265677 -4.03949 55.845000 Fe 0.542886 0.903281 0 174 55.845 0.0823353 -4.04488 55.845000 Fe 0.619855 0.932555 6.59758e-17 175 55.845 0.0225677 -4.01342 55.845000 Fe 0.63905 0.908912 0.5 176 55.845 0.0432283 -4.04835 55.845000 Fe 0.524744 0.928034 0.5 177 55.845 0.0141313 -4.04576 55.845000 Fe 0.717224 0.936426 0.5 181 55.845 0.217124 -4.02757 55.845000 Fe 0.737989 0.913427 0 178 55.845 0.0401358 -4.04638 55.845000 Fe 0.853009 0.893613 1.26801e-16 159 55.845 0.127363 -4.04408 55.845000 Fe 0.754626 0.890042 0.5 161 55.845 0.0956421 -4.05791 55.845000 Fe 0.94752 0.899723 0.5 165 55.845 0.100096 -4.04406 55.845000 Fe 0.813802 0.943569 1.42253e-17 179 55.845 0.265677 -4.03949 55.845000 Fe 0.832556 0.918283 0.5 180 55.845 0.0101622 -4.03954 55.845000 Fe 0.92744 0.923357 7.87295e-17 182 55.845 0.0101123 -4.04064 55.845000 Fe 0.00318086 0.952651 4.16948e-18 183 55.845 0.210822 -4.04556 55.845000 Fe 0.197372 0.961117 4.90527e-19 187 55.845 0.188523 -3.99935 55.845000 Fe 0.103406 0.955833 0.5 189 55.845 0.311635 -4.05153 55.845000 Fe 0.0851576 0.981905 1 205 55.845 0.697459 -3.92155 55.845000 Fe 0.168776 0.987666 0.5 206 55.845 0.789457 -3.98945 55.845000 Fe 0.37632 0.995648 0.5 234 55.845 4.71985 -3.93647 55.845000 Fe 0.471625 0.998036 1 209 55.845 9.65595 -3.74593 55.845000 Fe 0.387621 0.971849 1.50592e-16 191 55.845 0.190829 -4.04012 55.845000 Fe 0.408917 0.947124 0.5 192 55.845 0.0914048 -4.05768 55.845000 Fe 0.288312 0.966933 0.5 193 55.845 0.175536 -4.03264 55.845000 Fe 0.265085 0.989887 3.01674e-17 207 55.845 0.718655 -3.9788 55.845000 Fe 0.493946 0.97619 0.5 197 55.845 0.873479 -3.95749 55.845000 Fe 0.503181 0.952651 0 194 55.845 0.210822 -4.04556 55.845000 Fe 0.585158 0.981905 1 195 55.845 0.697459 -3.92155 55.845000 Fe 0.603406 0.955833 0.5 196 55.845 0.311635 -4.05153 55.845000 Fe 0.697372 0.961117 1.54271e-16 198 55.845 0.188523 -3.99935 55.845000 Fe 0.668776 0.987666 0.5 201 55.845 0.789457 -3.98945 55.845000 Fe 0.971625 0.998036 1 214 55.845 9.65595 -3.74593 55.845000 Fe 0.87632 0.995648 0.5 215 55.845 4.71985 -3.93647 55.845000 Fe 0.993946 0.97619 0.5 203 55.845 0.873479 -3.95749 55.845000 Fe 0.908917 0.947124 0.5 185 55.845 0.0914048 -4.05768 55.845000 Fe 0.765085 0.989887 1 199 55.845 0.718655 -3.9788 55.845000 Fe 0.788312 0.966933 0.5 200 55.845 0.175536 -4.03264 55.845000 Fe 0.887621 0.971849 6.00895e-17 202 55.845 0.190829 -4.04012