Number of particles = 408 A = 1 Angstrom (basic length-scale) H0(1,1) = 20.3818 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 58.0865 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 4.03268 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 0.0929229 0.0507159 6.77513e-18 222 55.845 4.79769 -4.14686 55.845000 Fe 0.0693043 0.0026084 2.26913e-17 226 55.845 7.28106 -4.04757 55.845000 Fe 0.106505 0.0211307 0.5 227 55.845 5.9478 -3.70463 55.845000 Fe 0.0234094 0.0485742 0.5 228 55.845 0.624 -3.82943 55.845000 Fe 0.164047 0.0566039 0.5 257 55.845 0.13082 -4.0952 55.845000 Fe 0.179257 0.0222196 5.40935e-17 255 55.845 2.62514 -3.99816 55.845000 Fe 0.233995 0.059334 2.17234e-16 251 55.845 0.0923311 -4.11862 55.845000 Fe 0.24823 0.025408 0.5 256 55.845 0.339655 -4.05275 55.845000 Fe 0.320434 0.0257919 1.39482e-16 284 55.845 1.28807 -4.14899 55.845000 Fe 0.301972 0.0632172 0.5 286 55.845 0.0439073 -4.07513 55.845000 Fe 0.389929 0.0329928 0.5 285 55.845 5.11898 -4.16675 55.845000 Fe 0.425202 0.00389273 7.2268e-17 283 55.845 11.309 -3.84387 55.845000 Fe 0.569304 0.0026084 5.6782e-17 312 55.845 7.28106 -4.04757 55.845000 Fe 0.463526 0.0406358 7.2268e-17 313 55.845 5.3353 -3.97615 55.845000 Fe 0.523409 0.0485742 0.5 314 55.845 0.624 -3.82943 55.845000 Fe 0.49458 0.00681369 0.5 316 55.845 3.34158 -4.00705 55.845000 Fe 0.592923 0.0507159 7.2268e-17 343 55.845 4.79769 -4.14686 55.845000 Fe 0.679257 0.0222196 1.03132e-16 342 55.845 2.62514 -3.99816 55.845000 Fe 0.664047 0.0566039 0.5 344 55.845 0.13082 -4.0952 55.845000 Fe 0.606505 0.0211307 0.5 346 55.845 5.9478 -3.70463 55.845000 Fe 0.733995 0.059334 7.2268e-17 371 55.845 0.0923311 -4.11862 55.845000 Fe 0.74823 0.025408 0.5 374 55.845 0.339655 -4.05275 55.845000 Fe 0.963526 0.0406358 0 206 55.845 5.3353 -3.97615 55.845000 Fe 0.925202 0.00389273 4.34468e-17 208 55.845 11.309 -3.84387 55.845000 Fe 0.99458 0.00681369 0.5 209 55.845 3.34158 -4.00705 55.845000 Fe 0.820434 0.0257919 1.07542e-19 370 55.845 1.28807 -4.14899 55.845000 Fe 0.801972 0.0632172 0.5 372 55.845 0.0439073 -4.07513 55.845000 Fe 0.889929 0.0329928 0.5 399 55.845 5.11898 -4.16675 55.845000 Fe 0.0556691 0.118673 0 218 55.845 0.00361527 -4.12442 55.845000 Fe 0.00558477 0.0803761 1.09693e-17 223 55.845 0.0510782 -4.11848 55.845000 Fe 0.0753854 0.0855381 0.5 224 55.845 0.0241998 -4.09627 55.845000 Fe 0.144781 0.0892172 1.1507e-17 252 55.845 0.0156111 -4.1443 55.845000 Fe 0.12491 0.123582 0.5 254 55.845 0.00522823 -4.11437 55.845000 Fe 0.193396 0.128097 7.2268e-17 247 55.845 0.00245686 -4.12569 55.845000 Fe 0.214201 0.0941219 0.5 253 55.845 0.0242521 -4.10839 55.845000 Fe 0.368764 0.0676557 1.43891e-16 279 55.845 0.115902 -4.12673 55.845000 Fe 0.281851 0.0983405 2.16912e-16 280 55.845 0.00882388 -4.10857 55.845000 Fe 0.348428 0.103273 0.5 281 55.845 0.0107576 -4.09788 55.845000 Fe 0.261493 0.133087 0.5 282 55.845 0.00325025 -4.11223 55.845000 Fe 0.505585 0.0803761 1.86692e-16 308 55.845 0.0510782 -4.11848 55.845000 Fe 0.41644 0.108175 7.2268e-17 309 55.845 0.0239797 -4.12544 55.845000 Fe 0.485675 0.11364 0.5 310 55.845 0.00605031 -4.13054 55.845000 Fe 0.434935 0.0744791 0.5 315 55.845 0.0841232 -4.08272 55.845000 Fe 0.555669 0.118673 1.12919e-16 339 55.845 0.00361527 -4.12442 55.845000 Fe 0.575385 0.0855381 0.5 345 55.845 0.0241998 -4.09627 55.845000 Fe 0.644781 0.0892172 7.62471e-17 338 55.845 0.0156111 -4.1443 55.845000 Fe 0.62491 0.123582 0.5 340 55.845 0.00522823 -4.11437 55.845000 Fe 0.693396 0.128097 4.30167e-19 367 55.845 0.00245686 -4.12569 55.845000 Fe 0.761493 0.133087 0.5 368 55.845 0.00325025 -4.11223 55.845000 Fe 0.714201 0.0941219 0.5 373 55.845 0.0242521 -4.10839 55.845000 Fe 0.781851 0.0983405 1.20447e-17 366 55.845 0.00882388 -4.10857 55.845000 Fe 0.985675 0.11364 0.5 225 55.845 0.00605031 -4.13054 55.845000 Fe 0.91644 0.108175 3.32304e-17 205 55.845 0.0239797 -4.12544 55.845000 Fe 0.934935 0.0744791 0.5 207 55.845 0.0841232 -4.08272 55.845000 Fe 0.868764 0.0676557 2.09706e-17 397 55.845 0.115902 -4.12673 55.845000 Fe 0.848428 0.103273 0.5 398 55.845 0.0107576 -4.09788 55.845000 Fe 0.0159092 0.186491 2.15083e-19 214 55.845 0.000433294 -4.12474 55.845000 Fe 0.0356075 0.152472 0.5 220 55.845 0.00111859 -4.126 55.845000 Fe 0.153367 0.196413 3.46284e-17 243 55.845 0.000112001 -4.12222 55.845000 Fe 0.104614 0.157434 2.18202e-16 248 55.845 0.000594064 -4.12275 55.845000 Fe 0.173195 0.162391 0.5 249 55.845 0.000573921 -4.11784 55.845000 Fe 0.0846225 0.191484 0.5 250 55.845 9.95146e-05 -4.12289 55.845000 Fe 0.329514 0.137736 1.10015e-16 275 55.845 0.00205494 -4.1183 55.845000 Fe 0.241669 0.167169 6.17289e-17 276 55.845 0.000514248 -4.12255 55.845000 Fe 0.310185 0.172037 0.5 277 55.845 0.000412754 -4.12004 55.845000 Fe 0.378696 0.176781 3.75321e-17 305 55.845 8.50575e-05 -4.1222 55.845000 Fe 0.397786 0.142567 0.5 311 55.845 0.00143822 -4.121 55.845000 Fe 0.466547 0.147404 0 304 55.845 0.00281386 -4.12896 55.845000 Fe 0.447251 0.181613 0.5 306 55.845 0.000267486 -4.12281 55.845000 Fe 0.515909 0.186491 7.47415e-17 335 55.845 0.000433294 -4.12474 55.845000 Fe 0.535608 0.152472 0.5 341 55.845 0.00111859 -4.126 55.845000 Fe 0.584623 0.191484 0.5 336 55.845 9.95146e-05 -4.12289 55.845000 Fe 0.604614 0.157434 2.1874e-16 334 55.845 0.000594064 -4.12275 55.845000 Fe 0.741669 0.167169 6.56004e-18 362 55.845 0.000514248 -4.12255 55.845000 Fe 0.653367 0.196413 6.77513e-17 363 55.845 0.000112001 -4.12222 55.845000 Fe 0.673195 0.162391 0.5 369 55.845 0.000573921 -4.11784 55.845000 Fe 0.966547 0.147404 7.2268e-17 219 55.845 0.00281386 -4.12896 55.845000 Fe 0.947251 0.181613 0.5 221 55.845 0.000267486 -4.12281 55.845000 Fe 0.878696 0.176781 7.52792e-19 390 55.845 8.50575e-05 -4.1222 55.845000 Fe 0.829514 0.137736 5.37709e-19 394 55.845 0.00205494 -4.1183 55.845000 Fe 0.897786 0.142567 0.5 395 55.845 0.00143822 -4.121 55.845000 Fe 0.810185 0.172037 0.5 396 55.845 0.000412754 -4.12004 55.845000 Fe 0.114265 0.264548 1 239 55.845 1.26716e-05 -4.12302 55.845000 Fe 0.0650743 0.225536 5.37709e-19 244 55.845 5.7369e-05 -4.12325 55.845000 Fe 0.133772 0.230481 0.5 245 55.845 1.89326e-05 -4.12296 55.845000 Fe 0.0455519 0.259644 0.5 246 55.845 3.14904e-05 -4.12263 55.845000 Fe 0.290649 0.206125 7.29133e-17 271 55.845 4.5219e-05 -4.12244 55.845000 Fe 0.202468 0.235376 3.22625e-19 272 55.845 3.05074e-05 -4.1225 55.845000 Fe 0.271103 0.240254 0.5 273 55.845 3.82227e-05 -4.12194 55.845000 Fe 0.222027 0.201316 0.5 278 55.845 0.000132272 -4.12132 55.845000 Fe 0.339702 0.245077 6.17289e-17 301 55.845 8.89954e-06 -4.12183 55.845000 Fe 0.359247 0.210963 0.5 307 55.845 3.35812e-05 -4.12165 55.845000 Fe 0.427815 0.215769 8.88294e-17 300 55.845 3.03444e-05 -4.12201 55.845000 Fe 0.408299 0.249931 0.5 302 55.845 7.7992e-06 -4.12208 55.845000 Fe 0.565074 0.225536 2.15083e-19 330 55.845 5.7369e-05 -4.12325 55.845000 Fe 0.476914 0.254756 1.07542e-19 331 55.845 4.34072e-05 -4.12194 55.845000 Fe 0.545552 0.259644 0.5 332 55.845 3.14904e-05 -4.12263 55.845000 Fe 0.4964 0.220637 0.5 337 55.845 8.63262e-05 -4.12244 55.845000 Fe 0.702468 0.235376 3.22625e-19 358 55.845 3.05074e-05 -4.1225 55.845000 Fe 0.614265 0.264548 1 359 55.845 1.26716e-05 -4.12302 55.845000 Fe 0.722027 0.201316 0.5 364 55.845 0.000132272 -4.12132 55.845000 Fe 0.633772 0.230481 0.5 365 55.845 1.89326e-05 -4.12296 55.845000 Fe 0.771103 0.240254 0.5 393 55.845 3.82227e-05 -4.12194 55.845000 Fe 0.790649 0.206125 9.67875e-19 391 55.845 4.5219e-05 -4.12244 55.845000 Fe 0.9964 0.220637 0.5 216 55.845 8.63262e-05 -4.12244 55.845000 Fe 0.976914 0.254756 7.52792e-19 212 55.845 4.34072e-05 -4.12194 55.845000 Fe 0.927815 0.215769 9.67875e-19 215 55.845 3.03444e-05 -4.12201 55.845000 Fe 0.908299 0.249931 0.5 217 55.845 7.7992e-06 -4.12208 55.845000 Fe 0.839702 0.245077 5.37709e-19 386 55.845 8.89954e-06 -4.12183 55.845000 Fe 0.859247 0.210963 0.5 392 55.845 3.35812e-05 -4.12165 55.845000 Fe 0.0260273 0.293695 2.00028e-17 240 55.845 0.000125186 -4.12111 55.845000 Fe 0.094695 0.298605 0.5 241 55.845 7.56753e-05 -4.12243 55.845000 Fe 0.0064537 0.327827 0.5 242 55.845 0.000540771 -4.12246 55.845000 Fe 0.163452 0.303538 2.15083e-19 268 55.845 0.000102369 -4.12281 55.845000 Fe 0.182986 0.269487 0.5 274 55.845 9.20797e-05 -4.12327 55.845000 Fe 0.0749534 0.332609 1.07542e-19 235 55.845 0.000601142 -4.11807 55.845000 Fe 0.251639 0.274366 4.30167e-19 267 55.845 6.40465e-05 -4.12222 55.845000 Fe 0.23218 0.308534 0.5 269 55.845 0.000520607 -4.12467 55.845000 Fe 0.300857 0.313394 4.9039e-17 297 55.845 0.00032362 -4.12289 55.845000 Fe 0.369407 0.318233 0.5 298 55.845 0.000135924 -4.12235 55.845000 Fe 0.320215 0.279231 0.5 303 55.845 4.0342e-05 -4.12216 55.845000 Fe 0.388789 0.284025 3.74245e-17 296 55.845 7.66446e-05 -4.12148 55.845000 Fe 0.526027 0.293695 1 326 55.845 0.000125186 -4.12111 55.845000 Fe 0.437945 0.322951 8.40976e-17 327 55.845 0.000546802 -4.11988 55.845000 Fe 0.506454 0.327827 0.5 328 55.845 0.000540771 -4.12246 55.845000 Fe 0.457388 0.288877 0.5 333 55.845 7.4094e-05 -4.12258 55.845000 Fe 0.594695 0.298605 0.5 361 55.845 7.56753e-05 -4.12243 55.845000 Fe 0.574953 0.332609 4.08658e-18 355 55.845 0.000601142 -4.11807 55.845000 Fe 0.663452 0.303538 1 354 55.845 0.000102369 -4.12281 55.845000 Fe 0.682986 0.269487 0.5 360 55.845 9.20797e-05 -4.12327 55.845000 Fe 0.751639 0.274366 5.37709e-19 387 55.845 6.40465e-05 -4.12222 55.845000 Fe 0.73218 0.308534 0.5 389 55.845 0.000520607 -4.12467 55.845000 Fe 0.869407 0.318233 0.5 6 55.845 0.000135924 -4.12235 55.845000 Fe 0.888789 0.284025 2.77458e-17 80 55.845 7.66446e-05 -4.12148 55.845000 Fe 0.937945 0.322951 1 210 55.845 0.000546802 -4.11988 55.845000 Fe 0.957388 0.288877 0.5 213 55.845 7.4094e-05 -4.12258 55.845000 Fe 0.800857 0.313394 4.30167e-19 382 55.845 0.00032362 -4.12289 55.845000 Fe 0.820215 0.279231 0.5 388 55.845 4.0342e-05 -4.12216 55.845000 Fe 0.054871 0.36689 0.5 237 55.845 0.00259465 -4.12571 55.845000 Fe 0.123381 0.371413 0 264 55.845 0.00568689 -4.11473 55.845000 Fe 0.143586 0.337579 0.5 270 55.845 0.000551845 -4.12281 55.845000 Fe 0.192662 0.376332 0.5 265 55.845 0.00384303 -4.12481 55.845000 Fe 0.212603 0.342528 7.2268e-17 263 55.845 0.00124405 -4.12577 55.845000 Fe 0.350508 0.352421 9.68951e-17 292 55.845 0.00161293 -4.12086 55.845000 Fe 0.262764 0.381336 6.4525e-17 293 55.845 0.00642659 -4.12995 55.845000 Fe 0.332011 0.386816 0.5 294 55.845 0.023664 -4.1247 55.845000 Fe 0.281674 0.347603 0.5 299 55.845 0.00293417 -4.12907 55.845000 Fe 0.486752 0.361902 1.07542e-19 322 55.845 0.00336935 -4.11215 55.845000 Fe 0.400088 0.391712 2.1874e-16 323 55.845 0.0108166 -4.09743 55.845000 Fe 0.466666 0.396654 0.5 324 55.845 0.0087764 -4.10899 55.845000 Fe 0.418744 0.357258 0.5 329 55.845 0.00204284 -4.118 55.845000 Fe 0.554871 0.36689 0.5 357 55.845 0.00259465 -4.12571 55.845000 Fe 0.623381 0.371413 1 350 55.845 0.00568689 -4.11473 55.845000 Fe 0.643586 0.337579 0.5 356 55.845 0.000551845 -4.12281 55.845000 Fe 0.762764 0.381336 1 378 55.845 0.00642659 -4.12995 55.845000 Fe 0.712603 0.342528 1 383 55.845 0.00124405 -4.12577 55.845000 Fe 0.692662 0.376332 0.5 385 55.845 0.00384303 -4.12481 55.845000 Fe 0.781674 0.347603 0.5 384 55.845 0.00293417 -4.12907 55.845000 Fe 0.986752 0.361902 6.32345e-17 236 55.845 0.00336935 -4.11215 55.845000 Fe 0.918744 0.357258 0.5 211 55.845 0.00204284 -4.118 55.845000 Fe 0.966666 0.396654 0.5 238 55.845 0.0087764 -4.10899 55.845000 Fe 0.900088 0.391712 1.27114e-16 403 55.845 0.0108166 -4.09743 55.845000 Fe 0.850508 0.352421 3.22625e-19 407 55.845 0.00161293 -4.12086 55.845000 Fe 0.832011 0.386816 0.5 408 55.845 0.023664 -4.1247 55.845000 Fe 0.0342804 0.400861 2.15083e-19 231 55.845 0.0259199 -4.10836 55.845000 Fe 0.0148731 0.435687 0.5 233 55.845 0.0951213 -4.11918 55.845000 Fe 0.173295 0.40942 4.05432e-17 259 55.845 0.0250035 -4.09704 55.845000 Fe 0.084926 0.438344 4.30167e-19 260 55.845 0.135422 -4.09579 55.845000 Fe 0.156145 0.44421 0.5 261 55.845 4.82013 -4.14461 55.845000 Fe 0.103722 0.405757 0.5 266 55.845 0.0170141 -4.145 55.845000 Fe 0.313838 0.420477 1.07542e-19 288 55.845 0.0845765 -4.08004 55.845000 Fe 0.225765 0.446373 1.59162e-17 289 55.845 0.628237 -3.82604 55.845000 Fe 0.28566 0.454367 0.5 290 55.845 5.37816 -3.98095 55.845000 Fe 0.243138 0.414603 0.5 295 55.845 0.0502468 -4.11741 55.845000 Fe 0.359299 0.462018 6.49552e-17 319 55.845 5.11796 -4.16604 55.845000 Fe 0.380059 0.427312 0.5 325 55.845 0.113531 -4.12649 55.845000 Fe 0.446917 0.431781 7.2268e-17 318 55.845 0.0460136 -4.07749 55.845000 Fe 0.53428 0.400861 4.1296e-17 351 55.845 0.0259199 -4.10836 55.845000 Fe 0.514873 0.435687 0.5 353 55.845 0.0951213 -4.11918 55.845000 Fe 0.584926 0.438344 7.2268e-17 347 55.845 0.135422 -4.09579 55.845000 Fe 0.603722 0.405757 0.5 352 55.845 0.0170141 -4.145 55.845000 Fe 0.725765 0.446373 0 375 55.845 0.628237 -3.82604 55.845000 Fe 0.673295 0.40942 1.07542e-19 379 55.845 0.0250035 -4.09704 55.845000 Fe 0.743138 0.414603 0.5 380 55.845 0.0502468 -4.11741 55.845000 Fe 0.656145 0.44421 0.5 381 55.845 4.82013 -4.14461 55.845000 Fe 0.78566 0.454367 0.5 406 55.845 5.37816 -3.98095 55.845000 Fe 0.946917 0.431781 2.05835e-16 232 55.845 0.0460136 -4.07749 55.845000 Fe 0.859299 0.462018 0 400 55.845 5.11796 -4.16604 55.845000 Fe 0.813838 0.420477 5.09748e-17 404 55.845 0.0845765 -4.08004 55.845000 Fe 0.880059 0.427312 0.5 405 55.845 0.113531 -4.12649 55.845000 Fe 0.00535931 0.506803 0.5 2 55.845 3.33976 -4.00681 55.845000 Fe 0.179529 0.525809 2.15083e-19 139 55.845 1.28198 -4.14914 55.845000 Fe 0.0747482 0.503884 0 167 55.845 11.3062 -3.84449 55.845000 Fe 0.00130562 0.46957 9.08727e-17 229 55.845 0.330744 -4.05144 55.845000 Fe 0.143043 0.473763 0 258 55.845 5.92098 -3.70272 55.845000 Fe 0.0703144 0.47272 0.5 262 55.845 2.59516 -3.99656 55.845000 Fe 0.180546 0.492359 0.5 291 55.845 7.24544 -4.0546 55.845000 Fe 0.110029 0.532992 0.5 169 55.845 5.11623 -4.16655 55.845000 Fe 0.320697 0.522217 1.82821e-18 110 55.845 2.62841 -3.99847 55.845000 Fe 0.393465 0.521134 0.5 114 55.845 5.95144 -3.70536 55.845000 Fe 0.251738 0.525417 0.5 143 55.845 0.337911 -4.05238 55.845000 Fe 0.25515 0.48818 3.37681e-17 287 55.845 3.30773 -4.01023 55.845000 Fe 0.324652 0.491098 0.5 321 55.845 11.2988 -3.84625 55.845000 Fe 0.429086 0.469137 0.5 320 55.845 1.26319 -4.15055 55.845000 Fe 0.574748 0.503884 0 51 55.845 11.3062 -3.84449 55.845000 Fe 0.505359 0.506803 0.5 84 55.845 3.33976 -4.00681 55.845000 Fe 0.430649 0.502597 7.2268e-17 317 55.845 7.28323 -4.04717 55.845000 Fe 0.501306 0.46957 7.79677e-17 348 55.845 0.330744 -4.05144 55.845000 Fe 0.570314 0.47272 0.5 349 55.845 2.59516 -3.99656 55.845000 Fe 0.751738 0.525417 0.5 25 55.845 0.337911 -4.05238 55.845000 Fe 0.679529 0.525809 9.59272e-17 53 55.845 1.28198 -4.14914 55.845000 Fe 0.643043 0.473763 0 376 55.845 5.92098 -3.70272 55.845000 Fe 0.680546 0.492359 0.5 377 55.845 7.24544 -4.0546 55.845000 Fe 0.75515 0.48818 7.2268e-17 401 55.845 3.30773 -4.01023 55.845000 Fe 0.610029 0.532992 0.5 54 55.845 5.11623 -4.16655 55.845000 Fe 0.929086 0.469137 0.5 234 55.845 1.26319 -4.15055 55.845000 Fe 0.820697 0.522217 7.2268e-17 24 55.845 2.62841 -3.99847 55.845000 Fe 0.893465 0.521134 0.5 7 55.845 5.95144 -3.70536 55.845000 Fe 0.930649 0.502597 7.2268e-17 230 55.845 7.28323 -4.04717 55.845000 Fe 0.824652 0.491098 0.5 402 55.845 11.2988 -3.84625 55.845000 Fe 0.0364758 0.540638 1.07542e-19 1 55.845 5.33674 -3.97625 55.845000 Fe 0.0650499 0.574485 0.5 4 55.845 0.0837797 -4.08306 55.845000 Fe 0.198005 0.563224 0.5 142 55.845 0.0441314 -4.07528 55.845000 Fe 0.131233 0.567668 1.47332e-17 168 55.845 0.115186 -4.12649 55.845000 Fe 0.218144 0.598351 3.22625e-19 140 55.845 0.00876262 -4.10854 55.845000 Fe 0.355227 0.589235 7.2268e-17 111 55.845 0.0152946 -4.1444 55.845000 Fe 0.335937 0.556609 0.5 113 55.845 0.130746 -4.09509 55.845000 Fe 0.266006 0.559344 6.4525e-19 141 55.845 0.0912058 -4.11867 55.845000 Fe 0.285799 0.594135 0.5 147 55.845 0.0241354 -4.10841 55.845000 Fe 0.407061 0.550718 9.58197e-17 112 55.845 4.79755 -4.14692 55.845000 Fe 0.494393 0.580387 7.2268e-17 81 55.845 0.0509628 -4.11856 55.845000 Fe 0.536476 0.540638 7.2268e-17 82 55.845 5.33674 -3.97625 55.845000 Fe 0.476557 0.54857 0.5 83 55.845 0.621592 -3.82964 55.845000 Fe 0.56505 0.574485 0.5 88 55.845 0.0837797 -4.08306 55.845000 Fe 0.424614 0.585547 0.5 118 55.845 0.0238867 -4.0963 55.845000 Fe 0.766006 0.559344 7.2268e-17 23 55.845 0.0912058 -4.11867 55.845000 Fe 0.785799 0.594135 0.5 28 55.845 0.0241354 -4.10841 55.845000 Fe 0.631233 0.567668 1.70669e-16 52 55.845 0.115186 -4.12649 55.845000 Fe 0.718144 0.598351 2.36592e-17 56 55.845 0.00876262 -4.10854 55.845000 Fe 0.698005 0.563224 0.5 58 55.845 0.0441314 -4.07528 55.845000 Fe 0.907061 0.550718 7.6032e-17 5 55.845 4.79755 -4.14692 55.845000 Fe 0.994393 0.580387 7.2268e-17 9 55.845 0.0509628 -4.11856 55.845000 Fe 0.924614 0.585547 0.5 10 55.845 0.0238867 -4.0963 55.845000 Fe 0.976557 0.54857 0.5 11 55.845 0.621592 -3.82964 55.845000 Fe 0.855227 0.589235 0 27 55.845 0.0152946 -4.1444 55.845000 Fe 0.835937 0.556609 0.5 29 55.845 0.130746 -4.09509 55.845000 Fe 0.083563 0.60818 1.07542e-19 3 55.845 0.0239791 -4.12547 55.845000 Fe 0.0334904 0.647417 1.07219e-16 13 55.845 0.00282533 -4.12895 55.845000 Fe 0.170502 0.637748 1.18941e-16 171 55.845 0.00204532 -4.11822 55.845000 Fe 0.102251 0.642576 0.5 172 55.845 0.00149756 -4.12096 55.845000 Fe 0.15157 0.603278 0.5 173 55.845 0.0107119 -4.09784 55.845000 Fe 0.0143412 0.613649 0.5 15 55.845 0.00599971 -4.13057 55.845000 Fe 0.39541 0.657451 1 115 55.845 0.000590559 -4.12266 55.845000 Fe 0.375099 0.623595 0.5 117 55.845 0.00516491 -4.11455 55.845000 Fe 0.306606 0.628115 1.07542e-19 145 55.845 0.00240883 -4.12569 55.845000 Fe 0.238511 0.633096 0.5 146 55.845 0.00316852 -4.1122 55.845000 Fe 0.326814 0.662408 0.5 151 55.845 0.000588111 -4.11798 55.845000 Fe 0.53349 0.647417 2.15083e-19 85 55.845 0.00282533 -4.12895 55.845000 Fe 0.583563 0.60818 7.2268e-17 86 55.845 0.0239791 -4.12547 55.845000 Fe 0.514341 0.613649 0.5 87 55.845 0.00599971 -4.13057 55.845000 Fe 0.444354 0.618691 1 116 55.845 0.00357142 -4.12434 55.845000 Fe 0.464423 0.652489 0.5 122 55.845 0.00108731 -4.1261 55.845000 Fe 0.602251 0.642576 0.5 92 55.845 0.00149756 -4.12096 55.845000 Fe 0.670502 0.637748 4.30167e-19 55 55.845 0.00204532 -4.11822 55.845000 Fe 0.65157 0.603278 0.5 57 55.845 0.0107119 -4.09784 55.845000 Fe 0.738511 0.633096 0.5 62 55.845 0.00316852 -4.1122 55.845000 Fe 0.806606 0.628115 0 26 55.845 0.00240883 -4.12569 55.845000 Fe 0.944354 0.618691 3.22625e-19 8 55.845 0.00357142 -4.12434 55.845000 Fe 0.964423 0.652489 0.5 14 55.845 0.00108731 -4.1261 55.845000 Fe 0.89541 0.657451 1.01519e-16 31 55.845 0.000590559 -4.12266 55.845000 Fe 0.826814 0.662408 0.5 32 55.845 0.000588111 -4.11798 55.845000 Fe 0.875099 0.623595 0.5 33 55.845 0.00516491 -4.11455 55.845000 Fe 0.0721831 0.71578 1 17 55.845 3.53375e-05 -4.12203 55.845000 Fe 0.0527771 0.681623 0.5 19 55.845 0.000286339 -4.12287 55.845000 Fe 0.12133 0.676791 1.6755e-16 170 55.845 8.36777e-05 -4.12207 55.845000 Fe 0.140753 0.710975 0.5 176 55.845 3.25922e-05 -4.12157 55.845000 Fe 0.189835 0.672051 0.5 177 55.845 0.000431736 -4.12001 55.845000 Fe 0.00359502 0.720652 0.5 18 55.845 8.55642e-05 -4.1225 55.845000 Fe 0.258341 0.667186 7.52792e-19 144 55.845 0.000535429 -4.1224 55.845000 Fe 0.209351 0.70614 5.37709e-19 175 55.845 4.69641e-05 -4.12241 55.845000 Fe 0.346637 0.696426 3.22625e-19 149 55.845 0.000104115 -4.12218 55.845000 Fe 0.277977 0.701331 0.5 150 55.845 0.000140886 -4.12132 55.845000 Fe 0.366205 0.7305 0.5 155 55.845 2.1239e-05 -4.12287 55.845000 Fe 0.415382 0.691499 0.5 121 55.845 0.000107445 -4.1229 55.845000 Fe 0.572183 0.71578 1 89 55.845 3.53375e-05 -4.12203 55.845000 Fe 0.552777 0.681623 0.5 91 55.845 0.000286339 -4.12287 55.845000 Fe 0.43491 0.725553 2.15083e-19 119 55.845 5.19638e-05 -4.12332 55.845000 Fe 0.484102 0.686502 1 120 55.845 0.000442315 -4.12479 55.845000 Fe 0.503595 0.720652 0.5 126 55.845 8.55642e-05 -4.1225 55.845000 Fe 0.758341 0.667186 6.4525e-19 60 55.845 0.000535429 -4.1224 55.845000 Fe 0.62133 0.676791 3.22625e-19 90 55.845 8.36777e-05 -4.12207 55.845000 Fe 0.709351 0.70614 6.4525e-19 59 55.845 4.69641e-05 -4.12241 55.845000 Fe 0.689835 0.672051 0.5 61 55.845 0.000431736 -4.12001 55.845000 Fe 0.777977 0.701331 0.5 66 55.845 0.000140886 -4.12132 55.845000 Fe 0.640753 0.710975 0.5 96 55.845 3.25922e-05 -4.12157 55.845000 Fe 0.984102 0.686502 0 12 55.845 0.000442315 -4.12479 55.845000 Fe 0.846637 0.696426 3.05418e-17 30 55.845 0.000104115 -4.12218 55.845000 Fe 0.93491 0.725553 3.95753e-17 35 55.845 5.19638e-05 -4.12332 55.845000 Fe 0.866205 0.7305 0.5 36 55.845 2.1239e-05 -4.12287 55.845000 Fe 0.915382 0.691499 0.5 37 55.845 0.000107445 -4.1229 55.845000 Fe 0.0230622 0.754768 1.07542e-18 16 55.845 4.70342e-05 -4.12203 55.845000 Fe 0.0425814 0.788889 0.5 21 55.845 8.77538e-05 -4.12256 55.845000 Fe 0.160278 0.745092 1.50558e-18 174 55.845 8.59516e-06 -4.12177 55.845000 Fe 0.179744 0.77925 0.5 180 55.845 4.26414e-05 -4.12215 55.845000 Fe 0.111179 0.784042 1.07542e-19 193 55.845 7.62069e-05 -4.12148 55.845000 Fe 0.0916853 0.749942 0.5 194 55.845 7.98849e-06 -4.12201 55.845000 Fe 0.297509 0.735393 2.33365e-17 148 55.845 3.00853e-05 -4.12255 55.845000 Fe 0.385699 0.764565 2.6993e-17 153 55.845 1.19381e-05 -4.12304 55.845000 Fe 0.316975 0.769504 0.5 154 55.845 9.4848e-05 -4.12324 55.845000 Fe 0.248321 0.774384 7.2268e-17 179 55.845 6.78251e-05 -4.1223 55.845000 Fe 0.228869 0.740271 0.5 181 55.845 4.29309e-05 -4.12194 55.845000 Fe 0.405269 0.798621 0.5 159 55.845 7.45625e-05 -4.12237 55.845000 Fe 0.591685 0.749942 0.5 95 55.845 7.98849e-06 -4.12201 55.845000 Fe 0.473942 0.79371 1.46472e-16 123 55.845 0.00013236 -4.12117 55.845000 Fe 0.523062 0.754768 3.22625e-19 124 55.845 4.70342e-05 -4.12203 55.845000 Fe 0.454414 0.759658 0.5 125 55.845 3.08399e-05 -4.12261 55.845000 Fe 0.542581 0.788889 0.5 130 55.845 8.77538e-05 -4.12256 55.845000 Fe 0.611179 0.784042 2.16159e-17 93 55.845 7.62069e-05 -4.12148 55.845000 Fe 0.748321 0.774384 1 63 55.845 6.78251e-05 -4.1223 55.845000 Fe 0.797509 0.735393 1 64 55.845 3.00853e-05 -4.12255 55.845000 Fe 0.728869 0.740271 0.5 65 55.845 4.29309e-05 -4.12194 55.845000 Fe 0.660278 0.745092 4.30167e-19 94 55.845 8.59516e-06 -4.12177 55.845000 Fe 0.679744 0.77925 0.5 100 55.845 4.26414e-05 -4.12215 55.845000 Fe 0.816975 0.769504 0.5 70 55.845 9.4848e-05 -4.12324 55.845000 Fe 0.885699 0.764565 1.2905e-18 34 55.845 1.19381e-05 -4.12304 55.845000 Fe 0.973942 0.79371 5.37709e-19 39 55.845 0.00013236 -4.12117 55.845000 Fe 0.905269 0.798621 0.5 40 55.845 7.45625e-05 -4.12237 55.845000 Fe 0.954414 0.759658 0.5 41 55.845 3.08399e-05 -4.12261 55.845000 Fe 0.0620119 0.822973 4.30167e-19 20 55.845 0.000528686 -4.11981 55.845000 Fe 0.0811974 0.857281 0.5 22 55.845 0.0019852 -4.11796 55.845000 Fe 0.199092 0.813417 2.15083e-19 178 55.845 0.000348935 -4.12299 55.845000 Fe 0.149436 0.852445 3.22625e-19 196 55.845 0.00165895 -4.12091 55.845000 Fe 0.130537 0.818256 0.5 197 55.845 0.00012988 -4.12231 55.845000 Fe 0.0131964 0.861926 7.63546e-18 43 55.845 0.0032738 -4.11215 55.845000 Fe 0.21827 0.847618 0.5 184 55.845 0.00286483 -4.12904 55.845000 Fe 0.336511 0.80356 2.17449e-16 152 55.845 0.000105509 -4.12287 55.845000 Fe 0.356378 0.83759 0.5 158 55.845 0.000561268 -4.12281 55.845000 Fe 0.287353 0.842546 7.2268e-17 183 55.845 0.00120797 -4.12579 55.845000 Fe 0.267775 0.808555 0.5 185 55.845 0.000541452 -4.12462 55.845000 Fe 0.513196 0.861926 2.17664e-16 127 55.845 0.0032738 -4.11215 55.845000 Fe 0.562012 0.822973 2.17879e-16 128 55.845 0.000528686 -4.11981 55.845000 Fe 0.493514 0.82784 0.5 129 55.845 0.000554455 -4.12243 55.845000 Fe 0.581197 0.857281 0.5 134 55.845 0.0019852 -4.11796 55.845000 Fe 0.425019 0.832625 2.86061e-16 157 55.845 0.000605527 -4.1181 55.845000 Fe 0.787353 0.842546 1.64754e-16 67 55.845 0.00120797 -4.12579 55.845000 Fe 0.767775 0.808555 0.5 69 55.845 0.000541452 -4.12462 55.845000 Fe 0.649436 0.852445 2.18417e-16 97 55.845 0.00165895 -4.12091 55.845000 Fe 0.699092 0.813417 1.05929e-16 98 55.845 0.000348935 -4.12299 55.845000 Fe 0.630537 0.818256 0.5 99 55.845 0.00012988 -4.12231 55.845000 Fe 0.71827 0.847618 0.5 104 55.845 0.00286483 -4.12904 55.845000 Fe 0.925019 0.832625 5.9363e-17 38 55.845 0.000605527 -4.1181 55.845000 Fe 0.993514 0.82784 0.5 45 55.845 0.000554455 -4.12243 55.845000 Fe 0.836511 0.80356 6.4525e-19 68 55.845 0.000105509 -4.12287 55.845000 Fe 0.856378 0.83759 0.5 74 55.845 0.000561268 -4.12281 55.845000 Fe 0.0530078 0.931796 2.31322e-16 47 55.845 0.0454746 -4.07782 55.845000 Fe 0.0332681 0.896677 0.5 49 55.845 0.00855684 -4.10915 55.845000 Fe 0.099861 0.891739 1.75938e-16 195 55.845 0.0107851 -4.0976 55.845000 Fe 0.186125 0.920489 7.21605e-17 199 55.845 0.0834406 -4.08026 55.845000 Fe 0.119892 0.92732 0.5 200 55.845 0.112654 -4.1268 55.845000 Fe 0.16795 0.886831 0.5 201 55.845 0.0232892 -4.1247 55.845000 Fe 0.376582 0.871431 3.30045e-16 156 55.845 0.00569349 -4.11469 55.845000 Fe 0.396219 0.905776 0.5 162 55.845 0.0169249 -4.14494 55.845000 Fe 0.237193 0.881353 2.1831e-16 182 55.845 0.00631917 -4.12985 55.845000 Fe 0.326657 0.909439 2.17449e-16 187 55.845 0.0247379 -4.09735 55.845000 Fe 0.256814 0.914616 0.5 188 55.845 0.0503069 -4.11731 55.845000 Fe 0.307299 0.876346 0.5 189 55.845 0.00390069 -4.12495 55.845000 Fe 0.553008 0.931796 7.2268e-17 131 55.845 0.0454746 -4.07782 55.845000 Fe 0.599861 0.891739 9.86157e-17 132 55.845 0.0107851 -4.0976 55.845000 Fe 0.533268 0.896677 0.5 133 55.845 0.00855684 -4.10915 55.845000 Fe 0.465644 0.900883 2.17234e-16 161 55.845 0.0255433 -4.10824 55.845000 Fe 0.445082 0.866906 0.5 163 55.845 0.00253541 -4.12575 55.845000 Fe 0.619892 0.92732 0.5 137 55.845 0.112654 -4.1268 55.845000 Fe 0.686125 0.920489 3.22625e-19 101 55.845 0.0834406 -4.08026 55.845000 Fe 0.737193 0.881353 2.15083e-19 102 55.845 0.00631917 -4.12985 55.845000 Fe 0.66795 0.886831 0.5 103 55.845 0.0232892 -4.1247 55.845000 Fe 0.756814 0.914616 0.5 108 55.845 0.0503069 -4.11731 55.845000 Fe 0.807299 0.876346 0.5 73 55.845 0.00390069 -4.12495 55.845000 Fe 0.965644 0.900883 1.5529e-16 42 55.845 0.0255433 -4.10824 55.845000 Fe 0.945082 0.866906 0.5 44 55.845 0.00253541 -4.12575 55.845000 Fe 0.826657 0.909439 0 71 55.845 0.0247379 -4.09735 55.845000 Fe 0.876582 0.871431 4.30167e-19 72 55.845 0.00569349 -4.11469 55.845000 Fe 0.896219 0.905776 0.5 78 55.845 0.0169249 -4.14494 55.845000 Fe 0.0708429 0.969134 0.5 50 55.845 1.25639 -4.15067 55.845000 Fe 0.140634 0.962021 7.2268e-17 198 55.845 5.11782 -4.1662 55.845000 Fe 0.175253 0.991104 0.5 203 55.845 11.3 -3.84593 55.845000 Fe 0.214285 0.954374 0.5 204 55.845 5.37651 -3.98151 55.845000 Fe 0.274193 0.946404 7.2268e-17 186 55.845 0.622448 -3.82581 55.845000 Fe 0.356904 0.973768 7.05474e-17 190 55.845 5.91336 -3.70232 55.845000 Fe 0.319352 0.992335 0.5 191 55.845 7.23856 -4.05455 55.845000 Fe 0.343797 0.944223 0.5 192 55.845 4.81988 -4.14486 55.845000 Fe 0.244777 0.988188 3.33379e-17 202 55.845 3.30235 -4.01035 55.845000 Fe 0.415022 0.938365 7.2268e-17 160 55.845 0.135503 -4.09559 55.845000 Fe 0.570843 0.969134 0.5 136 55.845 1.25639 -4.15067 55.845000 Fe 0.498639 0.969588 2.75307e-17 164 55.845 0.330231 -4.05142 55.845000 Fe 0.429635 0.972739 0.5 165 55.845 2.60315 -3.99657 55.845000 Fe 0.485062 0.935709 0.5 166 55.845 0.0945235 -4.11912 55.845000 Fe 0.744777 0.988188 3.41983e-17 105 55.845 3.30235 -4.01035 55.845000 Fe 0.774193 0.946404 2.15083e-19 106 55.845 0.622448 -3.82581 55.845000 Fe 0.714285 0.954374 0.5 107 55.845 5.37651 -3.98151 55.845000 Fe 0.640634 0.962021 1.07542e-19 135 55.845 5.11782 -4.1662 55.845000 Fe 0.675253 0.991104 0.5 138 55.845 11.3 -3.84593 55.845000 Fe 0.819352 0.992335 0.5 109 55.845 7.23856 -4.05455 55.845000 Fe 0.998639 0.969588 2.4412e-17 46 55.845 0.330231 -4.05142 55.845000 Fe 0.985062 0.935709 0.5 48 55.845 0.0945235 -4.11912 55.845000 Fe 0.856904 0.973768 1.49268e-16 75 55.845 5.91336 -3.70232 55.845000 Fe 0.915022 0.938365 2.18095e-16 76 55.845 0.135503 -4.09559 55.845000 Fe 0.843797 0.944223 0.5 77 55.845 4.81988 -4.14486 55.845000 Fe 0.929635 0.972739 0.5 79 55.845 2.60315 -3.99657