Number of particles = 482 A = 1 Angstrom (basic length-scale) H0(1,1) = 22.697 A H0(1,2) = 0 A H0(1,3) = 0 A H0(2,1) = 0 A H0(2,2) = 89.4752 A H0(2,3) = 0 A H0(3,1) = 0 A H0(3,2) = 0 A H0(3,3) = 2.7792 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 0.115557 0.000542891 0.5 247 55.845 4.70864 -4.11919 55.845000 Fe 0.091826 0.0469458 0.5 248 55.845 0.0416761 -4.16539 55.845000 Fe 0.104976 0.0240785 4.39423e-16 249 55.845 0.0708486 -4.12265 55.845000 Fe 0.195195 0.021656 0.5 250 55.845 7.946 -4.26873 55.845000 Fe 0.292907 0.00792329 0.5 252 55.845 4.86629 -3.98851 55.845000 Fe 0.079777 0.069626 3.72011e-16 254 55.845 0.0318825 -4.16421 55.845000 Fe 0.182998 0.0457851 6.1669e-16 256 55.845 1.07718 -4.27972 55.845000 Fe 0.27016 0.0527352 0.5 257 55.845 0.345432 -4.0963 55.845000 Fe 0.281389 0.030301 5.01841e-16 258 55.845 0.667574 -4.05122 55.845000 Fe 0.0262713 0.00290111 6.56638e-16 246 55.845 9.66853 -3.60482 55.845000 Fe 0.0132552 0.0246548 0.5 312 55.845 2.03354 -3.90655 55.845000 Fe 0.000471803 0.0465292 3.59528e-16 333 55.845 1.04417 -4.01856 55.845000 Fe 0.170728 0.0692398 0.5 255 55.845 0.648334 -4.25674 55.845000 Fe 0.371465 0.0325652 0.5 259 55.845 0.0336688 -4.14338 55.845000 Fe 0.385505 0.0101583 9.31277e-16 260 55.845 0.0903965 -4.20284 55.845000 Fe 0.477084 0.0109775 0.5 261 55.845 0.0297721 -4.19573 55.845000 Fe 0.360081 0.0550945 5.59266e-16 269 55.845 0.0261847 -4.15594 55.845000 Fe 0.450406 0.0561806 0.5 270 55.845 0.0014112 -4.17078 55.845000 Fe 0.462169 0.0335612 5.74246e-16 271 55.845 0.0112567 -4.17306 55.845000 Fe 0.552892 0.0343084 0.5 272 55.845 0.0112209 -4.1738 55.845000 Fe 0.568199 0.0116486 4.06966e-16 273 55.845 0.0233876 -4.17811 55.845000 Fe 0.659029 0.0121913 0.5 274 55.845 0.0297652 -4.16092 55.845000 Fe 0.54086 0.0569761 6.34167e-16 286 55.845 0.000441063 -4.17021 55.845000 Fe 0.631328 0.057679 0.5 287 55.845 0.000733633 -4.17042 55.845000 Fe 0.643558 0.0349514 3.86992e-16 288 55.845 0.0109023 -4.17221 55.845000 Fe 0.734094 0.0355444 0.5 289 55.845 0.0109564 -4.16744 55.845000 Fe 0.749552 0.0126666 3.1209e-16 290 55.845 0.0573142 -4.13179 55.845000 Fe 0.839626 0.0133464 0.5 291 55.845 0.134435 -4.06365 55.845000 Fe 0.721775 0.0583593 3.14587e-16 307 55.845 0.00165429 -4.17104 55.845000 Fe 0.812073 0.0592282 0.5 308 55.845 0.0377765 -4.15666 55.845000 Fe 0.824424 0.0363456 6.092e-16 309 55.845 0.0251235 -4.1386 55.845000 Fe 0.913838 0.038136 0.5 310 55.845 4.56131 -4.27533 55.845000 Fe 0.928683 0.0141092 4.06966e-16 311 55.845 7.78457 -4.24056 55.845000 Fe 0.901379 0.0615849 4.04469e-16 331 55.845 0.357251 -4.2508 55.845000 Fe 0.988954 0.0686255 0.5 332 55.845 0.595939 -4.07114 55.845000 Fe 0.0687092 0.0922348 0.5 253 55.845 0.0233155 -4.16116 55.845000 Fe 0.0479907 0.13735 0.5 262 55.845 0.0109862 -4.16176 55.845000 Fe 0.0579735 0.114805 3.89489e-16 263 55.845 0.017428 -4.16269 55.845000 Fe 0.148535 0.11542 0.5 264 55.845 0.274102 -4.22677 55.845000 Fe 0.159389 0.0924102 2.02234e-16 265 55.845 0.414213 -4.23816 55.845000 Fe 0.247741 0.0976334 0.5 266 55.845 0.119524 -4.13858 55.845000 Fe 0.258569 0.0751569 3.69515e-16 267 55.845 0.196337 -4.12151 55.845000 Fe 0.138401 0.138325 1.5979e-16 278 55.845 0.185961 -4.21287 55.845000 Fe 0.227343 0.142687 0.5 279 55.845 0.050139 -4.1566 55.845000 Fe 0.237269 0.120141 6.092e-16 280 55.845 0.0757672 -4.15046 55.845000 Fe 0.327144 0.122711 0.5 281 55.845 0.0249462 -4.17152 55.845000 Fe 0.337594 0.100153 2.87123e-16 282 55.845 0.0252547 -4.16684 55.845000 Fe 0.348454 0.0776168 0.5 268 55.845 0.0268114 -4.16598 55.845000 Fe 0.427909 0.101426 0.5 283 55.845 0.00311956 -4.17571 55.845000 Fe 0.438845 0.0788038 5.21815e-16 284 55.845 0.00245737 -4.17932 55.845000 Fe 0.529369 0.0796342 0.5 285 55.845 0.000361381 -4.17664 55.845000 Fe 0.417498 0.124045 3.09593e-16 301 55.845 0.00337726 -4.17709 55.845000 Fe 0.508023 0.124935 0.5 302 55.845 0.000203126 -4.1767 55.845000 Fe 0.51838 0.102281 5.74246e-16 303 55.845 0.000474254 -4.17413 55.845000 Fe 0.608875 0.103074 0.5 304 55.845 0.000549838 -4.17332 55.845000 Fe 0.619934 0.0803864 4.09462e-16 305 55.845 0.000123255 -4.17648 55.845000 Fe 0.59854 0.125759 3.1958e-16 325 55.845 0.000138774 -4.17508 55.845000 Fe 0.710461 0.0811365 0.5 306 55.845 0.000630031 -4.1771 55.845000 Fe 0.689033 0.126619 0.5 326 55.845 0.000894733 -4.17609 55.845000 Fe 0.699332 0.103887 4.54403e-16 327 55.845 0.00131316 -4.17448 55.845000 Fe 0.789691 0.104892 0.5 328 55.845 0.0554167 -4.17826 55.845000 Fe 0.800843 0.0820739 5.49279e-16 329 55.845 0.0495371 -4.17135 55.845000 Fe 0.890169 0.0847493 0.5 330 55.845 0.190885 -4.22788 55.845000 Fe 0.779406 0.127702 6.94089e-16 349 55.845 0.0549024 -4.18236 55.845000 Fe 0.868898 0.130623 0.5 350 55.845 0.0648428 -4.20667 55.845000 Fe 0.879102 0.107729 6.86598e-16 351 55.845 0.110105 -4.21609 55.845000 Fe 0.967585 0.113166 0.5 352 55.845 0.235389 -4.12106 55.845000 Fe 0.978216 0.0908571 4.36926e-16 353 55.845 0.364512 -4.09965 55.845000 Fe 0.9577 0.135547 6.39161e-16 373 55.845 0.158316 -4.13606 55.845000 Fe 0.0282099 0.182421 0.5 275 55.845 0.00422642 -4.16452 55.845000 Fe 0.03788 0.159885 4.54403e-16 276 55.845 0.00730803 -4.16175 55.845000 Fe 0.128197 0.161128 0.5 277 55.845 0.133716 -4.20144 55.845000 Fe 0.018791 0.204946 7.5401e-16 293 55.845 0.00179088 -4.16114 55.845000 Fe 0.108995 0.206588 0.5 294 55.845 0.0786168 -4.18666 55.845000 Fe 0.118542 0.183879 6.092e-16 295 55.845 0.100425 -4.19781 55.845000 Fe 0.207786 0.187826 0.5 296 55.845 0.0257518 -4.1674 55.845000 Fe 0.21727 0.16524 2.77136e-16 297 55.845 0.0353533 -4.16042 55.845000 Fe 0.307078 0.167885 0.5 298 55.845 0.0249048 -4.17319 55.845000 Fe 0.317181 0.145294 5.44285e-16 299 55.845 0.0245293 -4.17226 55.845000 Fe 0.198232 0.21043 4.7188e-16 317 55.845 0.019709 -4.16769 55.845000 Fe 0.287962 0.21317 0.5 318 55.845 0.0282079 -4.17799 55.845000 Fe 0.297613 0.190513 1.89751e-16 319 55.845 0.0256861 -4.17821 55.845000 Fe 0.40752 0.14667 0.5 300 55.845 0.00341901 -4.17653 55.845000 Fe 0.387923 0.191941 0.5 320 55.845 0.00373169 -4.17527 55.845000 Fe 0.397378 0.169301 6.2418e-16 321 55.845 0.00423035 -4.17549 55.845000 Fe 0.487887 0.170236 0.5 322 55.845 0.000535238 -4.1753 55.845000 Fe 0.498026 0.147589 2.17215e-16 323 55.845 0.000101101 -4.17554 55.845000 Fe 0.588543 0.148436 0.5 324 55.845 7.47782e-05 -4.17427 55.845000 Fe 0.478423 0.192892 3.17084e-16 343 55.845 0.0001429 -4.17696 55.845000 Fe 0.568964 0.193782 0.5 344 55.845 0.000169647 -4.1756 55.845000 Fe 0.578407 0.171108 3.17084e-16 345 55.845 0.000551868 -4.17582 55.845000 Fe 0.659471 0.19473 3.17084e-16 367 55.845 0.00178503 -4.17516 55.845000 Fe 0.668918 0.172039 0.5 346 55.845 0.00164884 -4.1746 55.845000 Fe 0.679 0.14934 4.69384e-16 347 55.845 0.000947801 -4.17387 55.845000 Fe 0.769319 0.150483 0.5 348 55.845 0.0534189 -4.18024 55.845000 Fe 0.749833 0.195998 0.5 368 55.845 0.0458449 -4.18328 55.845000 Fe 0.759263 0.173244 5.99213e-16 369 55.845 0.0501407 -4.18319 55.845000 Fe 0.848848 0.176202 0.5 370 55.845 0.0273568 -4.19237 55.845000 Fe 0.858785 0.15344 4.84364e-16 371 55.845 0.0403151 -4.19476 55.845000 Fe 0.947707 0.157976 0.5 372 55.845 0.112289 -4.14418 55.845000 Fe 0.839434 0.198943 3.14587e-16 391 55.845 0.0195407 -4.18522 55.845000 Fe 0.928649 0.202983 0.5 392 55.845 0.0700843 -4.16261 55.845000 Fe 0.938006 0.180455 5.56769e-16 393 55.845 0.0850026 -4.15697 55.845000 Fe 0.00902276 0.227469 0.5 292 55.845 0.00104141 -4.16181 55.845000 Fe 0.0902119 0.251863 0.5 314 55.845 0.0630635 -4.17786 55.845000 Fe 0.0992131 0.229234 6.91592e-16 315 55.845 0.0684091 -4.18053 55.845000 Fe 0.188542 0.233046 0.5 316 55.845 0.0171081 -4.17259 55.845000 Fe 0.0811149 0.274466 6.21684e-16 335 55.845 0.0633943 -4.1687 55.845000 Fe 0.170377 0.27837 0.5 336 55.845 0.0164524 -4.17886 55.845000 Fe 0.179617 0.255699 7.7648e-16 337 55.845 0.0156466 -4.1784 55.845000 Fe 0.26938 0.258555 0.5 338 55.845 0.0364241 -4.18375 55.845000 Fe 0.278295 0.235848 4.51907e-16 339 55.845 0.0327224 -4.18172 55.845000 Fe 0.260014 0.281275 4.74377e-17 359 55.845 0.0412834 -4.18171 55.845000 Fe 4.97641e-06 0.25 4.7188e-16 313 55.845 3.1918e-09 -4.16368 55.845000 Fe 0.378214 0.21459 4.24443e-16 341 55.845 0.00328957 -4.17265 55.845000 Fe 0.368634 0.237242 0.5 340 55.845 0.00327927 -4.17499 55.845000 Fe 0.468686 0.215561 0.5 342 55.845 0.000166403 -4.17539 55.845000 Fe 0.350332 0.282589 0.5 360 55.845 0.00210892 -4.17354 55.845000 Fe 0.359748 0.259914 4.99344e-18 361 55.845 0.00272091 -4.17584 55.845000 Fe 0.450292 0.260886 0.5 362 55.845 0.000484224 -4.17622 55.845000 Fe 0.459159 0.238222 2.8213e-16 363 55.845 0.000571599 -4.17564 55.845000 Fe 0.549718 0.239115 0.5 364 55.845 0.000483049 -4.1762 55.845000 Fe 0.559191 0.216446 4.74377e-16 365 55.845 0.000201018 -4.174 55.845000 Fe 0.649674 0.217413 0.5 366 55.845 0.00210342 -4.17356 55.845000 Fe 0.440816 0.283555 4.79371e-16 383 55.845 0.000202157 -4.17403 55.845000 Fe 0.53132 0.28444 0.5 384 55.845 0.000169144 -4.17535 55.845000 Fe 0.54085 0.261779 5.04338e-16 385 55.845 0.00057808 -4.17566 55.845000 Fe 0.631376 0.26276 0.5 386 55.845 0.00327366 -4.17498 55.845000 Fe 0.640262 0.240088 6.092e-16 387 55.845 0.00270138 -4.17586 55.845000 Fe 0.621792 0.285412 3.57031e-16 407 55.845 0.00328329 -4.17264 55.845000 Fe 0.730629 0.241447 0.5 388 55.845 0.0364303 -4.18377 55.845000 Fe 0.739992 0.218726 6.19187e-16 389 55.845 0.0412888 -4.18174 55.845000 Fe 0.829629 0.221632 0.5 390 55.845 0.0164098 -4.17893 55.845000 Fe 0.721715 0.264154 5.11828e-16 409 55.845 0.0327131 -4.18175 55.845000 Fe 0.811468 0.266956 0.5 410 55.845 0.0170951 -4.17252 55.845000 Fe 0.820393 0.244303 6.19187e-16 411 55.845 0.0155976 -4.17839 55.845000 Fe 0.909798 0.248138 0.5 412 55.845 0.0629808 -4.1779 55.845000 Fe 0.918893 0.225534 4.69384e-16 413 55.845 0.0632951 -4.1687 55.845000 Fe 0.900796 0.270767 6.66625e-16 433 55.845 0.0683939 -4.18058 55.845000 Fe 0.990986 0.272532 0.5 434 55.845 0.00104753 -4.16183 55.845000 Fe 0.0713534 0.297018 0.5 334 55.845 0.0701522 -4.16267 55.845000 Fe 0.0522923 0.342025 0.5 354 55.845 0.112153 -4.14417 55.845000 Fe 0.0619936 0.319546 7.7648e-16 355 55.845 0.0849488 -4.15703 55.845000 Fe 0.151151 0.323798 0.5 356 55.845 0.0272921 -4.19231 55.845000 Fe 0.160568 0.301058 3.81998e-16 357 55.845 0.0195594 -4.18513 55.845000 Fe 0.250169 0.304004 0.5 358 55.845 0.0458316 -4.18328 55.845000 Fe 0.141214 0.34656 9.78715e-16 377 55.845 0.0402001 -4.19475 55.845000 Fe 0.230679 0.349518 0.5 378 55.845 0.0534863 -4.18024 55.845000 Fe 0.240736 0.326756 8.9882e-17 379 55.845 0.0501528 -4.18326 55.845000 Fe 0.320998 0.350661 8.23918e-17 401 55.845 0.00094954 -4.17383 55.845000 Fe 0.331082 0.327963 0.5 380 55.845 0.00165947 -4.17458 55.845000 Fe 0.340531 0.305272 2.49672e-18 381 55.845 0.00179518 -4.17519 55.845000 Fe 0.431038 0.306219 0.5 382 55.845 0.000171181 -4.17557 55.845000 Fe 0.411456 0.351565 0.5 402 55.845 7.35363e-05 -4.17429 55.845000 Fe 0.421593 0.328893 3.39554e-16 403 55.845 0.000548287 -4.17582 55.845000 Fe 0.512114 0.329765 0.5 404 55.845 0.00053585 -4.17535 55.845000 Fe 0.52158 0.307108 6.2418e-16 405 55.845 0.000145906 -4.17699 55.845000 Fe 0.61208 0.308061 0.5 406 55.845 0.00372592 -4.17524 55.845000 Fe 0.501973 0.352412 3.07097e-16 425 55.845 0.000101217 -4.17556 55.845000 Fe 0.592479 0.353331 0.5 426 55.845 0.00342902 -4.17651 55.845000 Fe 0.602623 0.3307 4.59397e-16 427 55.845 0.00423539 -4.17545 55.845000 Fe 0.712044 0.286832 0.5 408 55.845 0.0281723 -4.17801 55.845000 Fe 0.692922 0.332117 0.5 428 55.845 0.0248175 -4.1732 55.845000 Fe 0.702389 0.309489 3.49541e-16 429 55.845 0.0256304 -4.17825 55.845000 Fe 0.792217 0.312175 0.5 430 55.845 0.0258135 -4.16732 55.845000 Fe 0.801774 0.289572 6.96585e-16 431 55.845 0.019716 -4.16761 55.845000 Fe 0.89101 0.293413 0.5 432 55.845 0.0786285 -4.1867 55.845000 Fe 0.682818 0.354708 9.31277e-16 448 55.845 0.0244514 -4.17222 55.845000 Fe 0.782731 0.334761 6.19187e-16 450 55.845 0.0354758 -4.16039 55.845000 Fe 0.871802 0.338874 0.5 451 55.845 0.133912 -4.20146 55.845000 Fe 0.881459 0.316122 4.16952e-16 452 55.845 0.10052 -4.19784 55.845000 Fe 0.971791 0.317579 0.5 453 55.845 0.00423783 -4.16449 55.845000 Fe 0.981213 0.295054 6.36664e-16 454 55.845 0.00179389 -4.16113 55.845000 Fe 0.96212 0.340116 6.74115e-16 469 55.845 0.00734042 -4.16178 55.845000 Fe 0.0324127 0.386835 0.5 374 55.845 0.235316 -4.12107 55.845000 Fe 0.0422981 0.364454 4.7188e-16 375 55.845 0.15826 -4.13606 55.845000 Fe 0.1311 0.369377 0.5 376 55.845 0.0647509 -4.20668 55.845000 Fe 0.0217797 0.409144 6.19187e-16 395 55.845 0.364466 -4.09962 55.845000 Fe 0.109828 0.415251 0.5 396 55.845 0.190857 -4.22793 55.845000 Fe 0.120896 0.392272 4.7188e-16 397 55.845 0.110007 -4.21615 55.845000 Fe 0.210308 0.395108 0.5 398 55.845 0.0554346 -4.17825 55.845000 Fe 0.22059 0.372299 9.31277e-16 399 55.845 0.0549408 -4.18231 55.845000 Fe 0.310964 0.373382 0.5 400 55.845 0.000891479 -4.17607 55.845000 Fe 0.199153 0.417926 3.59528e-16 419 55.845 0.0494989 -4.17131 55.845000 Fe 0.289535 0.418864 0.5 420 55.845 0.000632948 -4.17706 55.845000 Fe 0.300666 0.396113 5.14325e-16 421 55.845 0.00131834 -4.17452 55.845000 Fe 0.391123 0.396927 0.5 422 55.845 0.0005568 -4.17328 55.845000 Fe 0.401456 0.374242 7.01579e-16 423 55.845 0.00013574 -4.17509 55.845000 Fe 0.491974 0.375066 0.5 424 55.845 0.000201391 -4.17674 55.845000 Fe 0.380061 0.419614 6.19187e-16 442 55.845 0.000119748 -4.17647 55.845000 Fe 0.470626 0.420367 0.5 443 55.845 0.000353793 -4.17663 55.845000 Fe 0.481617 0.39772 6.86598e-16 444 55.845 0.000475215 -4.17414 55.845000 Fe 0.572089 0.398574 0.5 445 55.845 0.00314316 -4.17568 55.845000 Fe 0.582499 0.375956 4.31933e-16 446 55.845 0.00338968 -4.17707 55.845000 Fe 0.561149 0.421196 4.7188e-16 461 55.845 0.00246846 -4.17935 55.845000 Fe 0.651541 0.422384 0.5 462 55.845 0.0267574 -4.16597 55.845000 Fe 0.662402 0.399849 6.29174e-16 463 55.845 0.0251834 -4.16678 55.845000 Fe 0.672853 0.37729 0.5 447 55.845 0.0248748 -4.17152 55.845000 Fe 0.772655 0.357314 0.5 449 55.845 0.0502606 -4.15659 55.845000 Fe 0.752255 0.402367 0.5 464 55.845 0.119645 -4.13862 55.845000 Fe 0.762728 0.379859 4.7188e-16 465 55.845 0.0758965 -4.15051 55.845000 Fe 0.851462 0.384581 0.5 466 55.845 0.274221 -4.22679 55.845000 Fe 0.861596 0.361676 9.78715e-16 467 55.845 0.18612 -4.21285 55.845000 Fe 0.952007 0.362652 0.5 468 55.845 0.0109931 -4.16184 55.845000 Fe 0.741427 0.424844 5.14325e-16 476 55.845 0.196375 -4.1216 55.845000 Fe 0.840606 0.407591 9.31277e-16 478 55.845 0.414404 -4.23815 55.845000 Fe 0.931286 0.407766 0.5 479 55.845 0.0233286 -4.16114 55.845000 Fe 0.942024 0.385196 2.8962e-16 480 55.845 0.0174219 -4.1627 55.845000 Fe 0.0110431 0.431375 0.5 394 55.845 0.596041 -4.07112 55.845000 Fe 0.0861556 0.461865 0.5 416 55.845 4.56124 -4.2753 55.845000 Fe 0.0986169 0.438416 7.7648e-16 417 55.845 0.35735 -4.25083 55.845000 Fe 0.187923 0.440772 0.5 418 55.845 0.0377558 -4.15673 55.845000 Fe 0.0713097 0.485892 5.79239e-16 436 55.845 7.78485 -4.24058 55.845000 Fe 0.160367 0.486654 0.5 437 55.845 0.134494 -4.06363 55.845000 Fe 0.175569 0.463655 3.59528e-16 438 55.845 0.0251068 -4.13858 55.845000 Fe 0.265899 0.464456 0.5 439 55.845 0.0109097 -4.16746 55.845000 Fe 0.278223 0.441641 4.7188e-16 440 55.845 0.00166999 -4.17101 55.845000 Fe 0.250443 0.487334 4.7188e-16 455 55.845 0.0573749 -4.13183 55.845000 Fe 0.368669 0.442322 0.5 441 55.845 0.000744097 -4.17043 55.845000 Fe 0.340967 0.487809 0.5 456 55.845 0.0298043 -4.16093 55.845000 Fe 0.356436 0.465049 4.74377e-16 457 55.845 0.0108684 -4.17221 55.845000 Fe 0.447101 0.465692 0.5 458 55.845 0.0111842 -4.17376 55.845000 Fe 0.459137 0.443025 4.79371e-16 459 55.845 0.00044536 -4.17019 55.845000 Fe 0.549591 0.44382 0.5 460 55.845 0.00142163 -4.17084 55.845000 Fe 0.431797 0.488352 4.89357e-16 470 55.845 0.0234254 -4.17814 55.845000 Fe 0.522913 0.489023 0.5 471 55.845 0.0298424 -4.19575 55.845000 Fe 0.537824 0.466439 6.19187e-16 472 55.845 0.0111969 -4.17302 55.845000 Fe 0.628527 0.467435 0.5 473 55.845 0.0336318 -4.14338 55.845000 Fe 0.639916 0.444906 1.62287e-16 474 55.845 0.0261915 -4.15589 55.845000 Fe 0.614492 0.489842 8.23918e-17 481 55.845 0.0905258 -4.20287 55.845000 Fe 0.829267 0.430761 0.5 477 55.845 0.648436 -4.25668 55.845000 Fe 0.986738 0.475345 0.5 414 55.845 2.03381 -3.90666 55.845000 Fe 0.999523 0.453471 4.6439e-16 415 55.845 1.04427 -4.01852 55.845000 Fe 0.973719 0.4971 4.4192e-16 435 55.845 9.66892 -3.60482 55.845000 Fe 0.895018 0.475922 6.092e-16 1 55.845 0.0707963 -4.12264 55.845000 Fe 0.884435 0.499457 0.5 2 55.845 4.70885 -4.11913 55.845000 Fe 0.920219 0.430375 4.44416e-16 46 55.845 0.0318911 -4.16421 55.845000 Fe 0.90817 0.453055 0.5 240 55.845 0.0416763 -4.16537 55.845000 Fe 0.816998 0.454215 4.4941e-16 243 55.845 1.07698 -4.27967 55.845000 Fe 0.804797 0.478344 0.5 244 55.845 7.9458 -4.26878 55.845000 Fe 0.718602 0.4697 4.7188e-16 245 55.845 0.667154 -4.05122 55.845000 Fe 0.729836 0.447266 0.5 475 55.845 0.345237 -4.09634 55.845000 Fe 0.707089 0.492077 0.5 482 55.845 4.8666 -3.98845 55.845000 Fe 0.227582 0.510243 0.5 29 55.845 0.207505 -4.21904 55.845000 Fe 0.320135 0.510597 3.72011e-16 30 55.845 0.118746 -4.20279 55.845000 Fe 0.309993 0.533364 0.5 31 55.845 0.198103 -4.15347 55.845000 Fe 0.0397743 0.51265 0.5 47 55.845 10.8549 -4.36929 55.845000 Fe 0.133807 0.509809 7.51513e-16 48 55.845 0.603421 -4.23497 55.845000 Fe 0.127689 0.533201 0.5 49 55.845 0.314811 -4.1291 55.845000 Fe 0.218857 0.533145 8.33905e-16 50 55.845 0.166727 -4.13481 55.845000 Fe 0.222804 0.556119 0.5 51 55.845 0.00520928 -4.1514 55.845000 Fe 0.313696 0.556207 6.19187e-16 52 55.845 0.00331498 -4.1644 55.845000 Fe 0.0367885 0.536819 6.76612e-16 68 55.845 0.323204 -4.2338 55.845000 Fe 0.042461 0.560761 0.5 69 55.845 0.0757777 -4.2223 55.845000 Fe 0.131972 0.556499 5.06834e-16 70 55.845 0.244481 -4.16314 55.845000 Fe 0.593013 0.512376 0.5 7 55.845 0.104273 -4.1403 55.845000 Fe 0.411761 0.51104 0.5 16 55.845 0.0863457 -4.18589 55.845000 Fe 0.502673 0.511635 7.29043e-16 17 55.845 0.0829891 -4.16814 55.845000 Fe 0.491369 0.534304 0.5 18 55.845 0.244164 -4.16001 55.845000 Fe 0.581543 0.535 1.62287e-16 19 55.845 0.272332 -4.14844 55.845000 Fe 0.586316 0.557723 0.5 20 55.845 0.00225855 -4.18996 55.845000 Fe 0.400832 0.533745 3.32064e-16 32 55.845 0.222978 -4.1605 55.845000 Fe 0.40459 0.556535 0.5 33 55.845 0.00293368 -4.17388 55.845000 Fe 0.495441 0.557061 6.19187e-16 34 55.845 0.00206079 -4.1818 55.845000 Fe 0.791862 0.503497 4.19449e-16 3 55.845 8.15886 -4.41692 55.845000 Fe 0.683332 0.513357 3.32064e-16 8 55.845 6.25623 -3.89386 55.845000 Fe 0.67155 0.53584 0.5 9 55.845 0.790814 -4.01597 55.845000 Fe 0.677562 0.558094 2.79633e-16 21 55.845 0.315043 -4.10781 55.845000 Fe 0.847383 0.525059 0.5 4 55.845 4.38198 -4.05897 55.845000 Fe 0.938977 0.521739 5.34298e-16 5 55.845 8.041 -4.13567 55.845000 Fe 0.947563 0.544326 0.5 6 55.845 0.197986 -4.02828 55.845000 Fe 0.762008 0.5313 3.17084e-16 10 55.845 5.65766 -3.96903 55.845000 Fe 0.767846 0.554041 0.5 11 55.845 0.0396303 -4.14426 55.845000 Fe 0.857684 0.548426 9.0631e-16 12 55.845 0.0641435 -4.19265 55.845000 Fe 0.952932 0.567162 6.19187e-16 14 55.845 0.0659185 -4.11705 55.845000 Fe 0.318918 0.579033 0.5 53 55.845 0.00146137 -4.16975 55.845000 Fe 0.137384 0.579811 0.5 71 55.845 0.224687 -4.19125 55.845000 Fe 0.228028 0.57905 7.04075e-16 72 55.845 0.00900953 -4.15697 55.845000 Fe 0.233481 0.601945 0.5 73 55.845 0.0180352 -4.15943 55.845000 Fe 0.324394 0.601846 9.41264e-16 74 55.845 0.00193591 -4.171 55.845000 Fe 0.32942 0.624637 0.5 75 55.845 0.002431 -4.17052 55.845000 Fe 0.047855 0.584308 3.14587e-16 88 55.845 0.0242595 -4.2102 55.845000 Fe 0.0532348 0.607624 0.5 89 55.845 0.00889953 -4.20111 55.845000 Fe 0.142887 0.603098 6.19187e-16 90 55.845 0.183228 -4.20527 55.845000 Fe 0.148137 0.626352 0.5 91 55.845 0.136049 -4.20442 55.845000 Fe 0.238554 0.624801 7.88964e-16 92 55.845 0.0313029 -4.15782 55.845000 Fe 0.0584987 0.63081 6.19187e-16 108 55.845 0.00423979 -4.19006 55.845000 Fe 0.500819 0.579801 0.5 35 55.845 8.1801e-05 -4.18341 55.845000 Fe 0.591875 0.580355 7.56507e-16 36 55.845 0.00379571 -4.18183 55.845000 Fe 0.597255 0.602997 0.5 37 55.845 0.0062504 -4.17657 55.845000 Fe 0.409845 0.579311 1.99738e-16 54 55.845 0.000772499 -4.17561 55.845000 Fe 0.415318 0.602075 0.5 55 55.845 0.00104304 -4.17551 55.845000 Fe 0.506282 0.602532 6.61631e-16 56 55.845 0.000187696 -4.1778 55.845000 Fe 0.511327 0.625243 0.5 57 55.845 0.000217636 -4.17684 55.845000 Fe 0.602342 0.625636 7.63997e-16 58 55.845 0.00830173 -4.17594 55.845000 Fe 0.420347 0.624839 6.69121e-16 76 55.845 0.000883676 -4.17739 55.845000 Fe 0.682928 0.580424 0.5 22 55.845 0.233587 -4.12804 55.845000 Fe 0.862925 0.571537 0.5 13 55.845 0.00983408 -4.19783 55.845000 Fe 0.958254 0.590013 0.5 15 55.845 0.0232335 -4.14291 55.845000 Fe 0.773169 0.576681 3.49541e-16 23 55.845 0.0316626 -4.15892 55.845000 Fe 0.778481 0.599332 0.5 24 55.845 0.0274636 -4.16675 55.845000 Fe 0.868321 0.594517 6.54141e-16 25 55.845 0.00163241 -4.19307 55.845000 Fe 0.873559 0.617438 0.5 26 55.845 5.35873e-05 -4.18927 55.845000 Fe 0.963487 0.612883 6.06703e-16 27 55.845 0.00796109 -4.15858 55.845000 Fe 0.968784 0.63576 0.5 28 55.845 0.00260786 -4.16288 55.845000 Fe 0.688223 0.602841 8.71356e-16 38 55.845 0.180775 -4.14003 55.845000 Fe 0.693294 0.625316 0.5 39 55.845 0.143878 -4.15212 55.845000 Fe 0.783632 0.622006 6.86598e-16 40 55.845 0.0255179 -4.17142 55.845000 Fe 0.87894 0.640316 6.19187e-16 42 55.845 0.000585996 -4.18381 55.845000 Fe 0.244114 0.647634 0.5 93 55.845 0.0451309 -4.1613 55.845000 Fe 0.0641231 0.653883 0.5 109 55.845 0.00242835 -4.1844 55.845000 Fe 0.15379 0.649529 5.39292e-16 110 55.845 0.0974311 -4.20097 55.845000 Fe 0.159457 0.672621 0.5 111 55.845 0.0707951 -4.19888 55.845000 Fe 0.249761 0.670453 9.31277e-16 112 55.845 0.0579083 -4.16584 55.845000 Fe 0.255449 0.693264 0.5 113 55.845 0.069419 -4.1695 55.845000 Fe 0.0697218 0.676886 5.69252e-16 128 55.845 0.0020186 -4.18272 55.845000 Fe 0.0755818 0.699831 0.5 129 55.845 0.0025424 -4.17937 55.845000 Fe 0.165259 0.695649 8.81343e-16 130 55.845 0.0526695 -4.19263 55.845000 Fe 0.334965 0.647413 7.36533e-16 94 55.845 0.00262625 -4.17039 55.845000 Fe 0.607846 0.648282 0.5 59 55.845 0.00904488 -4.17271 55.845000 Fe 0.425845 0.647596 0.5 77 55.845 0.000513943 -4.17514 55.845000 Fe 0.516827 0.647949 4.26939e-16 78 55.845 4.91236e-05 -4.17676 55.845000 Fe 0.522526 0.670655 0.5 79 55.845 5.55816e-05 -4.17657 55.845000 Fe 0.613519 0.670915 9.33774e-16 80 55.845 0.00849383 -4.16938 55.845000 Fe 0.61924 0.69356 0.5 81 55.845 0.00770245 -4.17085 55.845000 Fe 0.340587 0.670182 0.5 95 55.845 0.00289998 -4.173 55.845000 Fe 0.431532 0.670335 6.44154e-16 96 55.845 0.000449017 -4.17563 55.845000 Fe 0.437227 0.693067 0.5 97 55.845 0.000992417 -4.17686 55.845000 Fe 0.528229 0.693362 3.84495e-16 98 55.845 0.000623146 -4.17633 55.845000 Fe 0.34627 0.692946 7.81474e-16 114 55.845 0.00364143 -4.17346 55.845000 Fe 0.789009 0.64469 0.5 41 55.845 0.0232443 -4.17223 55.845000 Fe 0.884515 0.663166 0.5 43 55.845 0.00151453 -4.18217 55.845000 Fe 0.974374 0.658619 3.17084e-16 44 55.845 0.000593672 -4.17008 55.845000 Fe 0.979973 0.681495 0.5 45 55.845 0.000275847 -4.17483 55.845000 Fe 0.698756 0.647864 6.96585e-16 60 55.845 0.122152 -4.15779 55.845000 Fe 0.704409 0.670449 0.5 61 55.845 0.106683 -4.16192 55.845000 Fe 0.794618 0.667407 5.16821e-16 62 55.845 0.0231714 -4.17604 55.845000 Fe 0.800323 0.690174 0.5 63 55.845 0.025418 -4.18053 55.845000 Fe 0.890195 0.686011 7.49016e-16 64 55.845 0.0021891 -4.18095 55.845000 Fe 0.896299 0.708844 0.5 65 55.845 0.00297317 -4.17835 55.845000 Fe 0.985933 0.704359 5.09331e-16 66 55.845 0.000693501 -4.17507 55.845000 Fe 0.710116 0.693087 6.69121e-16 82 55.845 0.096238 -4.16772 55.845000 Fe 0.806573 0.712949 8.26415e-16 84 55.845 0.0275649 -4.17916 55.845000 Fe 0.17178 0.718589 0.5 131 55.845 0.0415118 -4.1863 55.845000 Fe 0.261873 0.716059 7.7648e-16 132 55.845 0.0754993 -4.17162 55.845000 Fe 0.269036 0.738817 0.5 133 55.845 0.0788922 -4.1708 55.845000 Fe 0.0821897 0.722712 4.04469e-16 148 55.845 0.00249352 -4.17627 55.845000 Fe 0.0894452 0.745542 0.5 149 55.845 0.00220485 -4.17431 55.845000 Fe 0.179003 0.74145 6.56638e-16 150 55.845 0.0343383 -4.18256 55.845000 Fe 0.18641 0.764265 0.5 151 55.845 0.0294535 -4.17961 55.845000 Fe 0.276448 0.761538 1.523e-16 152 55.845 0.0838436 -4.17026 55.845000 Fe 0.00732193 0.77281 0.5 169 55.845 0.000337922 -4.17412 55.845000 Fe 0.0968194 0.768339 3.44548e-16 170 55.845 0.00276961 -4.17498 55.845000 Fe 4.89435e-06 0.75 4.7188e-16 168 55.845 4.33687e-08 -4.17347 55.845000 Fe 0.283552 0.784239 0.5 153 55.845 0.0891481 -4.16957 55.845000 Fe 0.625628 0.716228 7.44023e-16 100 55.845 0.00698754 -4.17208 55.845000 Fe 0.534608 0.716063 0.5 99 55.845 0.000805934 -4.17572 55.845000 Fe 0.632762 0.73891 0.5 101 55.845 0.00570061 -4.17178 55.845000 Fe 0.352671 0.715684 0.5 115 55.845 0.00447705 -4.1714 55.845000 Fe 0.443621 0.715801 6.84102e-16 116 55.845 0.000940166 -4.17663 55.845000 Fe 0.450776 0.738521 0.5 117 55.845 0.000324732 -4.17631 55.845000 Fe 0.541782 0.738768 8.51382e-16 118 55.845 0.000258715 -4.17612 55.845000 Fe 0.549235 0.761479 0.5 119 55.845 0.00032518 -4.17625 55.845000 Fe 0.64019 0.761607 6.26677e-16 120 55.845 0.00497974 -4.17091 55.845000 Fe 0.647337 0.784316 0.5 121 55.845 0.00448762 -4.17139 55.845000 Fe 0.359821 0.738394 5.49279e-16 134 55.845 0.00496779 -4.17089 55.845000 Fe 0.367248 0.76109 0.5 135 55.845 0.00570512 -4.17175 55.845000 Fe 0.458229 0.761232 4.39423e-16 136 55.845 0.000258707 -4.17614 55.845000 Fe 0.465401 0.783937 0.5 137 55.845 0.000803135 -4.17568 55.845000 Fe 0.556387 0.784199 6.2418e-16 138 55.845 0.000935181 -4.1766 55.845000 Fe 0.37438 0.783772 4.36926e-16 154 55.845 0.00698881 -4.17211 55.845000 Fe 0.716456 0.715761 0.5 83 55.845 0.0892035 -4.16962 55.845000 Fe 0.992687 0.72719 0.5 67 55.845 0.000336854 -4.17418 55.845000 Fe 0.813599 0.735734 0.5 85 55.845 0.0293598 -4.17958 55.845000 Fe 0.903189 0.73166 6.19187e-16 86 55.845 0.0027674 -4.17498 55.845000 Fe 0.910565 0.754457 0.5 87 55.845 0.00219314 -4.17427 55.845000 Fe 0.723562 0.738462 5.61762e-16 102 55.845 0.0839341 -4.17026 55.845000 Fe 0.730974 0.761183 0.5 103 55.845 0.0789388 -4.1708 55.845000 Fe 0.821007 0.758548 7.21552e-16 104 55.845 0.0342654 -4.18259 55.845000 Fe 0.828227 0.78141 0.5 105 55.845 0.0414436 -4.18635 55.845000 Fe 0.917818 0.777287 4.4192e-16 106 55.845 0.00248597 -4.17629 55.845000 Fe 0.738135 0.783942 6.2418e-16 122 55.845 0.0755654 -4.17164 55.845000 Fe 0.103709 0.791155 0.5 171 55.845 0.00298297 -4.17834 55.845000 Fe 0.193434 0.787049 5.74246e-16 172 55.845 0.0276186 -4.17923 55.845000 Fe 0.199683 0.809826 0.5 173 55.845 0.0254129 -4.18061 55.845000 Fe 0.28989 0.806912 7.31539e-16 174 55.845 0.096317 -4.1676 55.845000 Fe 0.295597 0.82955 0.5 175 55.845 0.106913 -4.16191 55.845000 Fe 0.0140732 0.795642 5.49279e-16 190 55.845 0.000689293 -4.17507 55.845000 Fe 0.0200316 0.818505 0.5 191 55.845 0.000271973 -4.17476 55.845000 Fe 0.109811 0.813988 4.7188e-16 192 55.845 0.00219885 -4.18097 55.845000 Fe 0.11549 0.836833 0.5 193 55.845 0.00152177 -4.18215 55.845000 Fe 0.205387 0.832593 7.7648e-16 194 55.845 0.023103 -4.17612 55.845000 Fe 0.301248 0.852135 4.7188e-16 196 55.845 0.122318 -4.15784 55.845000 Fe 0.0256295 0.84138 1.84757e-16 209 55.845 0.000595022 -4.17003 55.845000 Fe 0.210995 0.85531 0.5 195 55.845 0.0231741 -4.17221 55.845000 Fe 0.562779 0.806933 0.5 139 55.845 0.000988324 -4.17689 55.845000 Fe 0.653736 0.807054 7.7648e-16 140 55.845 0.00363905 -4.17346 55.845000 Fe 0.659417 0.829819 0.5 141 55.845 0.00290503 -4.17298 55.845000 Fe 0.380767 0.80644 0.5 155 55.845 0.00768118 -4.17089 55.845000 Fe 0.471778 0.806638 1.94744e-16 156 55.845 0.000621461 -4.1763 55.845000 Fe 0.47748 0.829346 0.5 157 55.845 5.54505e-05 -4.17663 55.845000 Fe 0.568473 0.829666 4.66887e-16 158 55.845 0.000448031 -4.17561 55.845000 Fe 0.574157 0.852404 0.5 159 55.845 0.000509234 -4.17514 55.845000 Fe 0.386487 0.829085 6.2418e-16 176 55.845 0.00845703 -4.16936 55.845000 Fe 0.392157 0.851719 0.5 177 55.845 0.00903445 -4.17268 55.845000 Fe 0.483177 0.852052 4.61893e-16 178 55.845 4.90202e-05 -4.1768 55.845000 Fe 0.665037 0.852587 3.17084e-16 160 55.845 0.00263373 -4.17039 55.845000 Fe 0.924423 0.800168 0.5 107 55.845 0.0025299 -4.17938 55.845000 Fe 0.744557 0.806737 0.5 123 55.845 0.0694906 -4.16946 55.845000 Fe 0.834746 0.804351 6.092e-16 124 55.845 0.0526298 -4.1927 55.845000 Fe 0.840548 0.827379 0.5 125 55.845 0.0708549 -4.19895 55.845000 Fe 0.930282 0.823113 7.7648e-16 126 55.845 0.00200561 -4.1827 55.845000 Fe 0.93588 0.846117 0.5 127 55.845 0.00241645 -4.1844 55.845000 Fe 0.750243 0.829547 6.34167e-16 142 55.845 0.0578921 -4.16577 55.845000 Fe 0.755888 0.852366 0.5 143 55.845 0.0450842 -4.16126 55.845000 Fe 0.846213 0.850472 3.69515e-16 144 55.845 0.0975861 -4.20102 55.845000 Fe 0.306707 0.874683 0.5 197 55.845 0.143987 -4.15211 55.845000 Fe 0.0312187 0.864239 0.5 210 55.845 0.00260959 -4.16288 55.845000 Fe 0.121064 0.859683 4.7188e-16 211 55.845 0.00059365 -4.18378 55.845000 Fe 0.126443 0.88256 0.5 212 55.845 5.41658e-05 -4.18925 55.845000 Fe 0.21637 0.877994 5.26808e-16 213 55.845 0.0254604 -4.17139 55.845000 Fe 0.221518 0.900668 0.5 214 55.845 0.0273792 -4.16683 55.845000 Fe 0.311777 0.897158 3.14587e-16 215 55.845 0.180949 -4.14004 55.845000 Fe 0.0365136 0.887116 5.66756e-16 224 55.845 0.00797037 -4.1586 55.845000 Fe 0.0417444 0.909986 0.5 225 55.845 0.0232464 -4.14289 55.845000 Fe 0.131677 0.905481 3.1209e-16 226 55.845 0.00161298 -4.19304 55.845000 Fe 0.137071 0.928462 0.5 227 55.845 0.00977801 -4.19783 55.845000 Fe 0.226827 0.92332 2.62156e-16 228 55.845 0.0315429 -4.15887 55.845000 Fe 0.317067 0.919575 0.5 216 55.845 0.233796 -4.12807 55.845000 Fe 0.488673 0.874758 0.5 179 55.845 0.000215024 -4.17681 55.845000 Fe 0.579652 0.875162 4.09462e-16 180 55.845 0.000878503 -4.17743 55.845000 Fe 0.584681 0.897926 0.5 181 55.845 0.00104324 -4.17552 55.845000 Fe 0.397659 0.874364 1.5979e-16 198 55.845 0.00830153 -4.17592 55.845000 Fe 0.402745 0.897004 0.5 199 55.845 0.00624227 -4.17656 55.845000 Fe 0.493717 0.897469 5.84233e-16 200 55.845 0.000186617 -4.17777 55.845000 Fe 0.499177 0.9202 0.5 201 55.845 8.31978e-05 -4.18345 55.845000 Fe 0.590153 0.92069 5.79239e-16 202 55.845 0.000773497 -4.17563 55.845000 Fe 0.408121 0.919646 4.99344e-16 217 55.845 0.00379435 -4.18184 55.845000 Fe 0.851865 0.873649 0.5 145 55.845 0.136292 -4.2044 55.845000 Fe 0.941503 0.86919 7.24049e-16 146 55.845 0.00422132 -4.19006 55.845000 Fe 0.946765 0.892376 0.5 147 55.845 0.00889412 -4.20119 55.845000 Fe 0.670579 0.875364 0.5 161 55.845 0.00243343 -4.17053 55.845000 Fe 0.761445 0.8752 4.7188e-16 162 55.845 0.0312388 -4.15787 55.845000 Fe 0.766518 0.898055 0.5 163 55.845 0.0180194 -4.15944 55.845000 Fe 0.857111 0.896903 2.84626e-16 164 55.845 0.183377 -4.20522 55.845000 Fe 0.862614 0.920189 0.5 165 55.845 0.224763 -4.19123 55.845000 Fe 0.952143 0.915692 6.1669e-16 166 55.845 0.0242753 -4.21022 55.845000 Fe 0.675604 0.898155 3.79502e-16 182 55.845 0.00193457 -4.17099 55.845000 Fe 0.681079 0.920968 0.5 183 55.845 0.00146046 -4.16976 55.845000 Fe 0.77197 0.920951 5.66756e-16 184 55.845 0.00900614 -4.15702 55.845000 Fe 0.20813 0.996503 3.32064e-16 251 55.845 8.15898 -4.4169 55.845000 Fe 0.232147 0.94596 0.5 229 55.845 0.0395621 -4.14422 55.845000 Fe 0.0470642 0.932838 4.7188e-16 235 55.845 0.0659622 -4.11711 55.845000 Fe 0.0524303 0.955674 0.5 236 55.845 0.197929 -4.02825 55.845000 Fe 0.142308 0.951573 3.29567e-16 237 55.845 0.0640524 -4.19263 55.845000 Fe 0.152606 0.97494 0.5 238 55.845 4.38178 -4.05899 55.845000 Fe 0.237982 0.968701 3.96979e-16 239 55.845 5.65726 -3.96908 55.845000 Fe 0.0610092 0.978261 2.09725e-16 242 55.845 8.04128 -4.13569 55.845000 Fe 0.322431 0.941906 4.66887e-16 230 55.845 0.315134 -4.10785 55.845000 Fe 0.328444 0.96416 0.5 231 55.845 0.790887 -4.01606 55.845000 Fe 0.316662 0.986644 6.26677e-16 241 55.845 6.25587 -3.89388 55.845000 Fe 0.595406 0.943466 0.5 203 55.845 0.00292748 -4.17387 55.845000 Fe 0.413678 0.942278 0.5 218 55.845 0.00225528 -4.18995 55.845000 Fe 0.504554 0.942941 6.19187e-16 219 55.845 0.00205754 -4.1818 55.845000 Fe 0.508627 0.965697 0.5 220 55.845 0.2442 -4.16 55.845000 Fe 0.599164 0.966256 7.49016e-16 221 55.845 0.223048 -4.16048 55.845000 Fe 0.588233 0.988961 0.5 222 55.845 0.0862742 -4.18587 55.845000 Fe 0.418451 0.965 4.7188e-16 232 55.845 0.272355 -4.14845 55.845000 Fe 0.406981 0.987624 0.5 233 55.845 0.104205 -4.1403 55.845000 Fe 0.497322 0.988366 5.8673e-16 234 55.845 0.0829555 -4.1681 55.845000 Fe 0.957535 0.939239 0.5 167 55.845 0.0758555 -4.22233 55.845000 Fe 0.777191 0.943881 0.5 185 55.845 0.00519282 -4.15138 55.845000 Fe 0.868023 0.943502 5.66756e-16 186 55.845 0.244482 -4.16315 55.845000 Fe 0.872306 0.9668 0.5 187 55.845 0.31492 -4.12906 55.845000 Fe 0.963205 0.963182 1.87254e-16 188 55.845 0.323308 -4.23374 55.845000 Fe 0.960214 0.98735 0.5 189 55.845 10.8555 -4.36935 55.845000 Fe 0.686299 0.943794 4.7188e-16 204 55.845 0.00330774 -4.16441 55.845000 Fe 0.690003 0.966637 0.5 205 55.845 0.198182 -4.15346 55.845000 Fe 0.781138 0.966856 2.54666e-16 206 55.845 0.166845 -4.13482 55.845000 Fe 0.77241 0.989757 0.5 207 55.845 0.207333 -4.21904 55.845000 Fe 0.866184 0.990192 3.67018e-16 208 55.845 0.603054 -4.23495 55.845000 Fe 0.679858 0.989404 6.96585e-16 223 55.845 0.118654 -4.20274